0 B11R1.28 BrCCNCc1ccccc1 ac057fc43e8d6ea85181427003cd8239 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.28 BrCCNCc1ccccn1 90bb93ff46fc49bde9265b45b65f9d87 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.28 BrCCNCc1cccnc1 a9888ba9b6c914af5c547c17a572df8f [0,0,0,0,0,0|4,0,0]=4 3 B11R1.28 BrCCNCc1cccnn1 b768633755d3d5e80d9e7a1d90688eef [0,0,0,0,0,0|3,0,0]=3 4 B11R1.28 BrCCNCc1ccncn1 f162626abcab5d0b5ade1edd41d87537 [0,0,0,0,0,0|3,0,0]=3 5 B11R1.28 BrCCNCc1ncccn1 db9e4586b003b20816beb6944fa16353 [0,0,0,0,0,0|3,0,0]=3 6 B11R1.28 C#CCCNc1ccccc1 a50e6468b9593b4ac45e12d5e3b3638a [0,0,0,0,0,0|2,0,2]=4 7 B11R1.28 C#CCCNc1ccccn1 f7a1e5b263bb577848e2c7d42a3f97ae [0,0,0,0,0,0|1,0,2]=3 8 B11R1.28 C#CCCNc1cccnn1 b94702aacf0564be53812572b7e43416 [0,0,0,0,0,0|2,0,2]=4 9 B11R1.28 C#CCCNc1ccncn1 02e272f6b945ab3a69669b2c94e0f184 [0,0,0,0,0,0|2,0,2]=4 10 B11R1.28 C#CCCNc1cnccn1 70c1d21524b3bdc9f3520b790b2faf0d [0,0,0,0,0,0|2,0,2]=4 11 B11R1.28 C#CCCNc1ncccn1 3c60f759031d6302c8722aa80ff2cf9e [0,0,0,0,0,0|2,0,2]=4 12 B11R1.28 C#CCCOc1ccccn1 e508d62db929222e2eb37d5403bac035 [0,0,0,0,0,0|1,0,2]=3 13 B11R1.28 C#CCCOc1cnccn1 6b34965dc48df2212b18c19b8085f010 [0,0,0,0,0,0|2,0,2]=4 14 B11R1.28 C#CCCOc1ncccn1 ceffa558ae7e082a06f3d3d3417bbf31 [0,0,0,0,0,0|2,0,2]=4 15 B11R1.28 C#CCNCc1ccccc1 5ab7d08152aaaf12430a9163e509ecd1 [0,0,0,0,0,0|2,0,2]=4 16 B11R1.28 C#CCNCc1ccccn1 a9c6f935a920670fb547218475a4aafd [0,0,0,0,0,0|1,0,2]=3 17 B11R1.28 C#CCNCc1cccnn1 3f03d22b1f339920504c4e6d3bb3faf6 [0,0,0,0,0,0|2,0,2]=4 18 B11R1.28 C#CCNCc1ccncn1 f92eb5fdce70c36e8e810f455dbca6ec [0,0,0,0,0,0|2,0,2]=4 19 B11R1.28 C#CCNCc1cnccn1 56cca75d363da247ece901a3a2792b88 [0,0,0,0,0,0|2,0,2]=4 20 B11R1.28 C#CCNCc1ncccn1 49551b76e78f4edd4ee03c9484aa4055 [0,0,0,0,0,0|2,0,2]=4 21 B11R1.28 C#CCOCc1ccccc1 4aff10236737b564a9b29132113db7f4 [0,0,0,0,0,0|2,0,2]=4 22 B11R1.28 C#CCOCc1ccccn1 2e4da7abeb61c83d6f30a0e249bff80d [0,0,0,0,0,0|1,0,2]=3 23 B11R1.28 C#CCOCc1cccnn1 6feb445d8f6507efc74a5358c8c7c325 [0,0,0,0,0,0|2,0,2]=4 24 B11R1.28 C#CCOCc1ccncn1 55bbfb1650161f16a284ee6285d24a14 [0,0,0,0,0,0|2,0,2]=4 25 B11R1.28 C#CCOCc1cnccn1 e6d6a3b2d057948931f2a63a3c31c099 [0,0,0,0,0,0|2,0,2]=4 26 B11R1.28 C#CCOCc1ncccn1 4721f17f1723ebcce9660c53c9b74e01 [0,0,0,0,0,0|2,0,2]=4 27 B11R1.28 C/C=C/CNc1ccccc1 e02cbeaffef0ff2c4795b558e93457ed [0,0,0,0,0,0|2,0,2]=4 28 B11R1.28 C/C=C/CNc1ccccn1 5a61b9aee47fe046ef4ac884866e0a57 [0,0,0,0,0,0|1,0,2]=3 29 B11R1.28 C/C=C/CNc1cccnn1 f2722efdd8c7a96c49ca7f5ad54e30e9 [0,0,0,0,0,0|2,0,2]=4 30 B11R1.28 C/C=C/CNc1ccncn1 1d2ea4b4a11e09a987062855102e5b66 [0,0,0,0,0,0|2,0,2]=4 31 B11R1.28 C/C=C/CNc1cnccn1 5d6aa3ff812a6eaf94686ca08968ea31 [0,0,0,0,0,0|2,0,2]=4 32 B11R1.28 C/C=C/CNc1ncccn1 2b21eb1f0fd0bacd24ca596b611568ec [0,0,0,0,0,0|2,0,2]=4 33 B11R1.28 C/C=C/COc1ccccn1 ed755d9f4a3a906e4d287cc92f6a9256 [0,0,0,0,0,0|1,0,2]=3 34 B11R1.28 C/C=C/COc1cnccn1 85823c1c6d2023da6588af5580a5caba [0,0,0,0,0,0|2,0,2]=4 35 B11R1.28 C/C=C/COc1ncccn1 0dd7a721d8ccdc1c3eab51687a5ba0be [0,0,0,0,0,0|2,0,2]=4 36 B11R1.28 C/C=C\CNc1ccccc1 f25f4c9ee5d52b5a340bd4a7fd720817 [0,0,0,0,0,0|2,0,2]=4 37 B11R1.28 C/C=C\CNc1ccccn1 c173af20e99f83d9a5c456a592ef1e15 [0,0,0,0,0,0|1,0,2]=3 38 B11R1.28 C/C=C\CNc1cccnn1 5389b866a2827f6da2d81bab7189280b [0,0,0,0,0,0|2,0,2]=4 39 B11R1.28 C/C=C\CNc1ccncn1 bbfd81bafc6925dd65df7226447b10a8 [0,0,0,0,0,0|2,0,2]=4 40 B11R1.28 C/C=C\CNc1cnccn1 7027c690ceaa69d20b23aebd92f8f62a [0,0,0,0,0,0|2,0,2]=4 41 B11R1.28 C/C=C\CNc1ncccn1 bf8a03faa99df64de2c3d3c77b47add4 [0,0,0,0,0,0|2,0,2]=4 42 B11R1.28 C/C=C\COc1ccccn1 69073974b597ab405a0094b540a97f81 [0,0,0,0,0,0|1,0,2]=3 43 B11R1.28 C/C=C\COc1cnccn1 c00ea75da659218ea75bb003849efbfc [0,0,0,0,0,0|2,0,2]=4 44 B11R1.28 C/C=C\COc1ncccn1 b5b19a500ea574e1248ce7b30a37a4a8 [0,0,0,0,0,0|2,0,2]=4 45 B11R1.28 C=CCCNc1ccccc1 41e5ae44107c117783190eb282a3dc50 [0,0,0,0,0,0|2,0,2]=4 46 B11R1.28 C=CCCNc1ccccn1 e92a5093fa2898ea30d4fe7927707a16 [0,0,0,0,0,0|1,0,2]=3 47 B11R1.28 C=CCCNc1cccnn1 b05f9e4479d8d41a40c9fe70f5e5ff26 [0,0,0,0,0,0|2,0,2]=4 48 B11R1.28 C=CCCNc1ccncn1 4dd9f7ae7d4be12b76b8730acf2166fe [0,0,0,0,0,0|2,0,2]=4 49 B11R1.28 C=CCCNc1cnccn1 dddc9d6fd83ce426503af94a596f3771 [0,0,0,0,0,0|2,0,2]=4 50 B11R1.28 C=CCCNc1ncccn1 10ecf84b4de4144f23846d5ea38c968c [0,0,0,0,0,0|2,0,2]=4 51 B11R1.28 C=CCCOc1ccccn1 0ab523476c40cca7ddeb1371fcb5c049 [0,0,0,0,0,0|1,0,2]=3 52 B11R1.28 C=CCCOc1cnccn1 a60c2825e78c17c87f475ea128b8e1ab [0,0,0,0,0,0|2,0,2]=4 53 B11R1.28 C=CCCOc1ncccn1 41984f371a61920e00fd7bbbe372017a [0,0,0,0,0,0|2,0,2]=4 54 B11R1.28 C=CCNCc1ccccc1 c3088ea78b0f7fe35bdb5a0a79f4eb2a [0,0,0,0,0,0|2,0,2]=4 55 B11R1.28 C=CCNCc1ccccn1 e7bb58472b2cfc748af211be177c817f [0,0,0,0,0,0|1,0,2]=3 56 B11R1.28 C=CCNCc1cccnn1 b341bf8e0f00c8d18557c09a9cfcdb90 [0,0,0,0,0,0|2,0,2]=4 57 B11R1.28 C=CCNCc1ccncn1 89dea5c6a75b5f63279ee70925494e66 [0,0,0,0,0,0|2,0,2]=4 58 B11R1.28 C=CCNCc1cnccn1 24cfbc0193223b0523fcef83caaa72f4 [0,0,0,0,0,0|2,0,2]=4 59 B11R1.28 C=CCNCc1ncccn1 f1d876316a9637f585a058bfd24cba68 [0,0,0,0,0,0|2,0,2]=4 60 B11R1.28 C=CCOCc1ccccc1 38f1b42f9627b73302287ed7d9c08f3f [0,0,0,0,0,0|2,0,2]=4 61 B11R1.28 C=CCOCc1ccccn1 11821b5ce58a574dd3347fc8c16e0da7 [0,0,0,0,0,0|1,0,2]=3 62 B11R1.28 C=CCOCc1cccnn1 ec05b2f649093fc8ecfa46041443e56d [0,0,0,0,0,0|2,0,2]=4 63 B11R1.28 C=CCOCc1ccncn1 93650e65022fe1f86d5140555e58c9d0 [0,0,0,0,0,0|2,0,2]=4 64 B11R1.28 C=CCOCc1cnccn1 0fe8f6b1b5ee2d286128d9df862f343c [0,0,0,0,0,0|2,0,2]=4 65 B11R1.28 C=CCOCc1ncccn1 247d5a2067eeb198615ef0645fee62f8 [0,0,0,0,0,0|2,0,2]=4 66 B11R1.28 CC=CCNc1ccccc1 c43b41b8b675349badfe26c48e3f7c5f [0,0,0,0,0,0|2,0,2]=4 67 B11R1.28 CC=CCNc1ccccn1 dff63d253924f7dd0d25e5ccec37e70c [0,0,0,0,0,0|1,0,2]=3 68 B11R1.28 CC=CCNc1cccnn1 1be6081791fa1a05b9d684d053d41258 [0,0,0,0,0,0|2,0,2]=4 69 B11R1.28 CC=CCNc1ccncn1 8c59574a1ec91da23237bf39e3868488 [0,0,0,0,0,0|2,0,2]=4 70 B11R1.28 CC=CCNc1cnccn1 624a4e385f3a26516887975ae8830dc4 [0,0,0,0,0,0|2,0,2]=4 71 B11R1.28 CC=CCNc1ncccn1 14bd4111706ca6ec55ebc07ad07913c4 [0,0,0,0,0,0|2,0,2]=4 72 B11R1.28 CCCCCN1CC=CCC1 d500fffaf2826f4f41d6075397a993f5 [0,0,0,0,0,0|2,0,2]=4 73 B11R1.28 CCCCNc1ccccc1 178647391839dfbe95aed182d7dc43ba [0,0,0,0,0,0|2,0,0]=2 74 B11R1.28 CCCCNc1ccccn1 91c5e93b79177d6bf2e79f08485f5335 [0,0,0,0,0,0|1,0,0]=1 75 B11R1.28 CCCCNc1cccnc1 b72453a6fd2f6ec63a951a849bd6d4ab [0,0,0,0,0,0|3,0,0]=3 76 B11R1.28 CCCCNc1cccnn1 3dfd51777ba04f9375640c74ab9fa2e6 [0,0,0,0,0,0|2,0,0]=2 77 B11R1.28 CCCCNc1ccncc1 24fb8abdae77c89030f13cd0949f55ff [0,0,0,0,0,0|3,0,0]=3 78 B11R1.28 CCCCNc1ccncn1 285343aee96e8f045fe913fc70b195a9 [0,0,0,0,0,0|2,0,0]=2 79 B11R1.28 CCCCNc1ccnnc1 ff8398fcae5d1b92f9ec3bc78a562cec [0,0,0,0,0,0|4,0,0]=4 80 B11R1.28 CCCCNc1cnccn1 94ad2094a4d853e068f8fa7ebd18c7ff [0,0,0,0,0,0|2,0,0]=2 81 B11R1.28 CCCCNc1cncnc1 5898f2b85902d6f8660c7182ee3b2170 [0,0,0,0,0,0|4,0,0]=4 82 B11R1.28 CCCCNc1cnncn1 bdd7d665f8c7d76a076d062e16600b45 [0,0,0,0,0,0|3,0,0]=3 83 B11R1.28 CCCCNc1ncccn1 1c9a1ed7a4872dfade79e48decc1fc1d [0,0,0,0,0,0|2,0,0]=2 84 B11R1.28 CCCCNc1nccnn1 560ef2f12eabbad67e6661fe4624d7b9 [0,0,0,0,0,0|3,0,0]=3 85 B11R1.28 CCCCNc1ncncn1 f37f74726d1ca9322f8a3a7bac26cb21 [0,0,0,0,0,0|3,0,0]=3 86 B11R1.28 CCCCOc1ccccn1 6484ab4f70c598bfd74c056129d64bfe [0,0,0,0,0,0|1,0,0]=1 87 B11R1.28 CCCCOc1cccnc1 5afbbe8f7376fe71bb9dd4caf03cbd91 [0,0,0,0,0,0|3,0,0]=3 88 B11R1.28 CCCCOc1ccncc1 fc01d35869db11789e0b4af0f1677b1b [0,0,0,0,0,0|3,0,0]=3 89 B11R1.28 CCCCOc1ccnnc1 667207acd2d82bae5786ac94d3b108de [0,0,0,0,0,0|4,0,0]=4 90 B11R1.28 CCCCOc1cnccn1 74c5e85aaa9b94ec4e088971edd3244b [0,0,0,0,0,0|2,0,0]=2 91 B11R1.28 CCCCOc1cncnc1 d754e073f477d30ef4fb9949b36048b9 [0,0,0,0,0,0|4,0,0]=4 92 B11R1.28 CCCCOc1cncnn1 dc395df6bfebd51ae61b86be3230a0bd [0,0,0,0,0,0|3,0,0]=3 93 B11R1.28 CCCCOc1ncccn1 cea963446efaea4e45d8684cc469bd67 [0,0,0,0,0,0|2,0,0]=2 94 B11R1.28 CCCNCc1ccccc1 6e74fa6187fccbc3617e9cc264b3e7aa [0,0,0,0,0,0|2,0,0]=2 95 B11R1.28 CCCNCc1ccccn1 80119cb7f5f54b354b4e2a1110975477 [0,0,0,0,0,0|1,0,0]=1 96 B11R1.28 CCCNCc1cccnc1 bc1eb1c5ec13776685acded27d44c636 [0,0,0,0,0,0|3,0,0]=3 97 B11R1.28 CCCNCc1cccnn1 f9771734910ebcad90f8cb14178ca09d [0,0,0,0,0,0|2,0,0]=2 98 B11R1.28 CCCNCc1ccncc1 a4e33f26d038f90cea08a211a6327f1b [0,0,0,0,0,0|3,0,0]=3 99 B11R1.28 CCCNCc1ccncn1 4c6d605a0ccf50e124c7a439ea71cca1 [0,0,0,0,0,0|2,0,0]=2 100 B11R1.28 CCCNCc1ccnnc1 f0dc052fccb98d09ed6a02caf7ad77f6 [0,0,0,0,0,0|4,0,0]=4 101 B11R1.28 CCCNCc1cnccn1 c9890f6f5a4e09bed341b3daf3b2c549 [0,0,0,0,0,0|2,0,0]=2 102 B11R1.28 CCCNCc1cncnc1 b63f5b77d0d35d3228827f3601ca0c32 [0,0,0,0,0,0|4,0,0]=4 103 B11R1.28 CCCNCc1ncccn1 9d6cc7b3819df7e77a589192f2bf91c0 [0,0,0,0,0,0|2,0,0]=2 104 B11R1.28 CCCOCc1ccccc1 112c1e14e862b8fbffa225764759b8ec [0,0,0,0,0,0|2,0,0]=2 105 B11R1.28 CCCOCc1ccccn1 a2de9c7a7551b2ca6641b10a888e1203 [0,0,0,0,0,0|1,0,0]=1 106 B11R1.28 CCCOCc1cccnc1 02843d33c5a54d2140670eb60a4dfb7b [0,0,0,0,0,0|3,0,0]=3 107 B11R1.28 CCCOCc1cccnn1 b324e54ae74b0a57b2f9b766e3c0e490 [0,0,0,0,0,0|2,0,0]=2 108 B11R1.28 CCCOCc1ccncc1 56ee45f2e5ce25d41ded46b7cfbb89b5 [0,0,0,0,0,0|3,0,0]=3 109 B11R1.28 CCCOCc1ccncn1 c21e413653b185c946f470cd3c989a49 [0,0,0,0,0,0|2,0,0]=2 110 B11R1.28 CCCOCc1ccnnc1 835d98ea225e99027be93ac65a9ecaeb [0,0,0,0,0,0|4,0,0]=4 111 B11R1.28 CCCOCc1cnccn1 2f92d9f2b0d873450f90961d7406570a [0,0,0,0,0,0|2,0,0]=2 112 B11R1.28 CCCOCc1cncnc1 62dd4b6cbce5110705e084fd1f6898a2 [0,0,0,0,0,0|4,0,0]=4 113 B11R1.28 CCCOCc1ncccn1 aded070bc849868bd77e139f41cc86fb [0,0,0,0,0,0|2,0,0]=2 114 B11R1.28 CCNCCc1ccccc1 a4bcdd097e726e04ab2794cdb42f5f71 [0,0,0,0,0,0|2,0,0]=2 115 B11R1.28 CCNCCc1ccccn1 08ffb64a8c703d8e611cb4b81d73ea48 [0,0,0,0,0,0|1,0,0]=1 116 B11R1.28 CCNCCc1cccnc1 4a3a0c73e4e732e57ab84a312bb6bfb2 [0,0,0,0,0,0|3,0,0]=3 117 B11R1.28 CCNCCc1ccncc1 8e4e115f84a67e767e5e9ff1560cacbe [0,0,0,0,0,0|3,0,0]=3 118 B11R1.28 CCNCCc1ccncn1 dba79812e975c4d64e5e25d258f9e6a6 [0,0,0,0,0,0|2,0,0]=2 119 B11R1.28 CCNCCc1cnccn1 2497cab3d04dd1dac7aa9e87fb020630 [0,0,0,0,0,0|2,0,0]=2 120 B11R1.28 CCNCCc1ncccn1 8878621879d60c35f5e690c8ce15ae29 [0,0,0,0,0,0|2,0,0]=2 121 B11R1.28 CCOCCc1ccccc1 4c8fc52cc53157c0b0cd10959d18f86a [0,0,0,0,0,0|2,0,0]=2 122 B11R1.28 CCOCCc1ccccn1 0d3553a98e2eb283c6e354f56bb7c09d [0,0,0,0,0,0|1,0,0]=1 123 B11R1.28 CCOCCc1cccnc1 fde9743ce24696d5aa5aa82dfaaaf4a7 [0,0,0,0,0,0|3,0,0]=3 124 B11R1.28 CCOCCc1ccncc1 630579b198392670c66e884689fb17ef [0,0,0,0,0,0|3,0,0]=3 125 B11R1.28 CCOCCc1ccncn1 bedc028f31c05778aab48e9543338256 [0,0,0,0,0,0|2,0,0]=2 126 B11R1.28 CCOCCc1cnccn1 df7cb588e7f62873ee34f1155b413714 [0,0,0,0,0,0|2,0,0]=2 127 B11R1.28 CCOCCc1cncnc1 58c96cb82c933f213a2e027db9cf3e79 [0,0,0,0,0,0|4,0,0]=4 128 B11R1.28 CCOCCc1ncccn1 3fe5ff61de16184188b5260ddcb372ea [0,0,0,0,0,0|2,0,0]=2 129 B11R1.28 CCOCNc1ccccc1 00b4118c5fbc36d206f093517b5cafbb [0,0,0,0,0,0|3,0,0]=3 130 B11R1.28 CCOCNc1ccccn1 ac3729b96ca810b5bc3bde9ed19bf9fa [0,0,0,0,0,0|2,0,0]=2 131 B11R1.28 CCOCNc1cccnc1 d3b3fa022b30954b0290fed1cdafa77a [0,0,0,0,0,0|4,0,0]=4 132 B11R1.28 CCOCNc1cccnn1 e45400654c951e5da57247b84fef5d3a [0,0,0,0,0,0|3,0,0]=3 133 B11R1.28 CCOCNc1ccncc1 7b541819d70b7814c284336c668c77e2 [0,0,0,0,0,0|4,0,0]=4 134 B11R1.28 CCOCNc1ccncn1 ac025a168367c6a81f61efd458de89aa [0,0,0,0,0,0|3,0,0]=3 135 B11R1.28 CCOCNc1cnccn1 b10f54b02233d2aa203f7b5134c91fdb [0,0,0,0,0,0|3,0,0]=3 136 B11R1.28 CCOCNc1cnncn1 e5079005038cb248c52698839680931f [0,0,0,0,0,0|4,0,0]=4 137 B11R1.28 CCOCNc1ncccn1 fcb38bd4c27d2ec9bea1e232fffc4a03 [0,0,0,0,0,0|3,0,0]=3 138 B11R1.28 CCOCNc1nccnn1 e0edc23dfc52a2e559a076a4158c0b6c [0,0,0,0,0,0|4,0,0]=4 139 B11R1.28 CCOCNc1ncncn1 4ca15c81581c38e3253e3d30c1775326 [0,0,0,0,0,0|4,0,0]=4 140 B11R1.28 CCOCOc1ccccn1 54f1e3cb35931cbfff15b357666888af [0,0,0,0,0,0|2,0,0]=2 141 B11R1.28 CCOCOc1cccnc1 ead2fcc768ce8c5c30053e5139f1a3f8 [0,0,0,0,0,0|4,0,0]=4 142 B11R1.28 CCOCOc1ccncc1 432375e2a4c080d14e68465c24c6befc [0,0,0,0,0,0|4,0,0]=4 143 B11R1.28 CCOCOc1cnccn1 bec42aacd144c9dd6c28b79c769a9705 [0,0,0,0,0,0|3,0,0]=3 144 B11R1.28 CCOCOc1ncccn1 6f3d977a126a9911e9141c2a752b2884 [0,0,0,0,0,0|3,0,0]=3 145 B11R1.28 COCCNc1ccccc1 5ef0d3255ad59be77d905fd9c0e71e6d [0,0,0,0,0,0|3,0,0]=3 146 B11R1.28 COCCNc1ccccn1 89ce959fbd9c09f77faba6fd797cd6ad [0,0,0,0,0,0|2,0,0]=2 147 B11R1.28 COCCNc1cccnc1 3616fb0bfda365de01dc790c24f19ca2 [0,0,0,0,0,0|4,0,0]=4 148 B11R1.28 COCCNc1cccnn1 8733c04e0a44ea8a7038e5961b1befad [0,0,0,0,0,0|3,0,0]=3 149 B11R1.28 COCCNc1ccncc1 e86302258d425dce02b6a807adbdf19d [0,0,0,0,0,0|4,0,0]=4 150 B11R1.28 COCCNc1ccncn1 c6d474a468adffcb122226924683c6d3 [0,0,0,0,0,0|3,0,0]=3 151 B11R1.28 COCCNc1cnccn1 89a57d49972f4332836b38e03ec7c28e [0,0,0,0,0,0|3,0,0]=3 152 B11R1.28 COCCNc1cncnn1 c62ae06f2077abe7018bf40c5b1f79b5 [0,0,0,0,0,0|4,0,0]=4 153 B11R1.28 COCCNc1cnncn1 8bed46e58ba55a169732af2571e75622 [0,0,0,0,0,0|4,0,0]=4 154 B11R1.28 COCCNc1ncccn1 7e1e5eb4cfa8afc12d90009e638d22ba [0,0,0,0,0,0|3,0,0]=3 155 B11R1.28 COCCNc1nccnn1 e6e1e0e57193871e0c93f078772356d3 [0,0,0,0,0,0|4,0,0]=4 156 B11R1.28 COCCNc1ncncn1 1be8f8af0900a208365cd0c489ff5002 [0,0,0,0,0,0|4,0,0]=4 157 B11R1.28 COCCOc1ccccn1 c15a0f2a35a14a6120db222de8e43d40 [0,0,0,0,0,0|2,0,0]=2 158 B11R1.28 COCCOc1cccnc1 7d9dde4ce0ac45ab046b208edae409a9 [0,0,0,0,0,0|4,0,0]=4 159 B11R1.28 COCCOc1ccncc1 13c01b88dd4fec82579627c21ba6ed06 [0,0,0,0,0,0|4,0,0]=4 160 B11R1.28 COCCOc1cnccn1 3195bf44c40b4cfe23cd964d6107e835 [0,0,0,0,0,0|3,0,0]=3 161 B11R1.28 COCCOc1cncnn1 dac8db74ace88b84001640c23c976840 [0,0,0,0,0,0|4,0,0]=4 162 B11R1.28 COCCOc1ncccn1 ecaf6dd7fa3225dcb21592e471186427 [0,0,0,0,0,0|3,0,0]=3 163 B11R1.28 COCNCc1ccccc1 658bb4bb78d053244c07843f6f02f062 [0,0,0,0,0,0|3,0,0]=3 164 B11R1.28 COCNCc1ccccn1 cb969ddff5a45a0c4df4b7717e547f81 [0,0,0,0,0,0|2,0,0]=2 165 B11R1.28 COCNCc1cccnc1 35b8b6083a32f9db8795c63f618b2f12 [0,0,0,0,0,0|4,0,0]=4 166 B11R1.28 COCNCc1cccnn1 9aaebdac9b44cb036a6c4efec8b145a8 [0,0,0,0,0,0|3,0,0]=3 167 B11R1.28 COCNCc1ccncc1 3fb6af955e4c1e6a3044742c559cc5ae [0,0,0,0,0,0|4,0,0]=4 168 B11R1.28 COCNCc1ccncn1 d1470f86349a91c3077428a64eeb245d [0,0,0,0,0,0|3,0,0]=3 169 B11R1.28 COCNCc1cnccn1 e7da00a079ae82f27242b20b43289b5a [0,0,0,0,0,0|3,0,0]=3 170 B11R1.28 COCNCc1ncccn1 910dc37e487213f00ebe28f7f96b3dad [0,0,0,0,0,0|3,0,0]=3 171 B11R1.28 COCOCc1ccccc1 33758b3ae4df68a136cb96076fbeb2ee [0,0,0,0,0,0|3,0,0]=3 172 B11R1.28 COCOCc1ccccn1 c7e2d466f64f2796a0fb099c19cb65e2 [0,0,0,0,0,0|2,0,0]=2 173 B11R1.28 COCOCc1cccnc1 f4d73442b3dd40c1495fadfe4fccda61 [0,0,0,0,0,0|4,0,0]=4 174 B11R1.28 COCOCc1cccnn1 6a346636ce31dd66677c2c2e6f45b6aa [0,0,0,0,0,0|3,0,0]=3 175 B11R1.28 COCOCc1ccncc1 99c1a2805ee24504fc8830c71e80abe6 [0,0,0,0,0,0|4,0,0]=4 176 B11R1.28 COCOCc1ccncn1 5977780fcd5de8ad874d004f7b7d968c [0,0,0,0,0,0|3,0,0]=3 177 B11R1.28 COCOCc1cnccn1 6fe649a8173b64bf80af621a9eaae369 [0,0,0,0,0,0|3,0,0]=3 178 B11R1.28 COCOCc1ncccn1 0812a457fd84b7c7be763e51ebbce2d3 [0,0,0,0,0,0|3,0,0]=3 179 B11R1.28 CSCCNc1ccccc1 f8eb965b60d0615781c928cdcd30bc15 [0,0,0,0,0,0|3,0,0]=3 180 B11R1.28 CSCCNc1ccccn1 1ebdb7d56171ddc5a7c67867cc88039f [0,0,0,0,0,0|2,0,0]=2 181 B11R1.28 CSCCNc1cccnc1 5c27e85010b1a349b69a05e89d2c3c43 [0,0,0,0,0,0|4,0,0]=4 182 B11R1.28 CSCCNc1cccnn1 22d4fb47f31c865b2abde66f85f7bf43 [0,0,0,0,0,0|3,0,0]=3 183 B11R1.28 CSCCNc1ccncc1 54710d8ef290046b70669623e9f1800b [0,0,0,0,0,0|4,0,0]=4 184 B11R1.28 CSCCNc1ccncn1 f8b2e77946b95e128c5a8a125ef8b57b [0,0,0,0,0,0|3,0,0]=3 185 B11R1.28 CSCCNc1cnccn1 9eb52a287cd8fa8fe36dcf6953bf6294 [0,0,0,0,0,0|3,0,0]=3 186 B11R1.28 CSCCNc1cnncn1 8ae61226763cedef35c843b65bce1d0f [0,0,0,0,0,0|4,0,0]=4 187 B11R1.28 CSCCNc1ncccn1 303e31e122c6b1f3f92f1d57b831f4b6 [0,0,0,0,0,0|3,0,0]=3 188 B11R1.28 CSCCNc1nccnn1 ed4cf6e4f3604c7ae895584f6f1fbf29 [0,0,0,0,0,0|4,0,0]=4 189 B11R1.28 CSCCNc1ncncn1 cb37ac84f23c23dcb3653d0caa0e4bfe [0,0,0,0,0,0|4,0,0]=4 190 B11R1.28 CSCCOc1ccccn1 8b8b6f4f12e2bd5052045e36f5e8d7b9 [0,0,0,0,0,0|2,0,0]=2 191 B11R1.28 CSCCOc1cccnc1 035ac2b2fc138dfaa1d6bea025347e4a [0,0,0,0,0,0|4,0,0]=4 192 B11R1.28 CSCCOc1ccncc1 bc39eaa4e5a78fcb3ef7ff94e955c20b [0,0,0,0,0,0|4,0,0]=4 193 B11R1.28 CSCCOc1cnccn1 eddb2cab03b974e07a130b3afd541113 [0,0,0,0,0,0|3,0,0]=3 194 B11R1.28 CSCCOc1cncnn1 8d39701af4984b6d184b031eb3a3179d [0,0,0,0,0,0|4,0,0]=4 195 B11R1.28 CSCCOc1ncccn1 969e2fe1dd37951a51db8df424d75b02 [0,0,0,0,0,0|3,0,0]=3 196 B11R1.28 CSCNCc1ccccc1 5b3aef5f0ecdedc4b2903ec980e5dc72 [0,0,0,0,0,0|3,0,0]=3 197 B11R1.28 CSCNCc1ccccn1 2c467e079eb5903cc68e04796a70abe6 [0,0,0,0,0,0|2,0,0]=2 198 B11R1.28 CSCNCc1cccnc1 3f297bb785f90b40b12fe1a85e9c71ce [0,0,0,0,0,0|4,0,0]=4 199 B11R1.28 CSCNCc1cccnn1 38a48aae0f10e8a8a408eb551a279969 [0,0,0,0,0,0|3,0,0]=3 200 B11R1.28 CSCNCc1ccncc1 f9e31be92d2ea3f9692e6bd87f906a5c [0,0,0,0,0,0|4,0,0]=4 201 B11R1.28 CSCNCc1ccncn1 36701466f9b2ee3aeda97d3f152942e1 [0,0,0,0,0,0|3,0,0]=3 202 B11R1.28 CSCNCc1cnccn1 b6d98476646f609643b9e079c1ea699d [0,0,0,0,0,0|3,0,0]=3 203 B11R1.28 CSCNCc1ncccn1 f3cad45c6ccc4f1897c8a82d57c8d736 [0,0,0,0,0,0|3,0,0]=3 204 B11R1.28 CSCOCc1ccccc1 5941de554d8996d7d45b8f8eee2daf73 [0,0,0,0,0,0|3,0,0]=3 205 B11R1.28 CSCOCc1ccccn1 15e9634e2b7543dc2be21ac6d26f304b [0,0,0,0,0,0|2,0,0]=2 206 B11R1.28 CSCOCc1cccnc1 43f679691f8dba66a7e0f36103db118e [0,0,0,0,0,0|4,0,0]=4 207 B11R1.28 CSCOCc1cccnn1 3db940d669fdd690980d19050429109a [0,0,0,0,0,0|3,0,0]=3 208 B11R1.28 CSCOCc1ccncc1 11cf6b0bd99fe96e04f2abe6d07a06aa [0,0,0,0,0,0|4,0,0]=4 209 B11R1.28 CSCOCc1ccncn1 bf53b930b7d63ac46198d267087bd835 [0,0,0,0,0,0|3,0,0]=3 210 B11R1.28 CSCOCc1cnccn1 06296d91c838cce0a2774d80459318b9 [0,0,0,0,0,0|3,0,0]=3 211 B11R1.28 CSCOCc1ncccn1 93cf7df7d12e72075e9aeff8278ad111 [0,0,0,0,0,0|3,0,0]=3 212 B11R1.28 Cl/C=C/CNc1ccccn1 893fcb433253dfa6af2c640facebd871 [0,0,0,0,0,0|2,0,2]=4 213 B11R1.28 Cl/C=C/COc1ccccn1 fc8e32ffcd696aa21b384695882dbb82 [0,0,0,0,0,0|2,0,2]=4 214 B11R1.28 Cl/C=C\CNc1ccccn1 0eaed82ec617ba6b064e05e462ba0ed3 [0,0,0,0,0,0|2,0,2]=4 215 B11R1.28 Cl/C=C\COc1ccccn1 57e73453ad210a0d931cd71403fa56b4 [0,0,0,0,0,0|2,0,2]=4 216 B11R1.28 ClCCCNc1ccccc1 b7f587f82b83ca90917a5139ff536b22 [0,0,0,0,0,0|3,0,0]=3 217 B11R1.28 ClCCCNc1ccccn1 8bdf4144e9a2a7a9c2cc08aafaf861f1 [0,0,0,0,0,0|2,0,0]=2 218 B11R1.28 ClCCCNc1cccnc1 46d49c887f9c8f9ac001059b66aa76f9 [0,0,0,0,0,0|4,0,0]=4 219 B11R1.28 ClCCCNc1cccnn1 7cd493fd0307f877c7e0b9f8c8e45189 [0,0,0,0,0,0|3,0,0]=3 220 B11R1.28 ClCCCNc1ccncc1 970fb2252914a50a867c4051715341da [0,0,0,0,0,0|4,0,0]=4 221 B11R1.28 ClCCCNc1ccncn1 ac587a599505b071e50f4eebf541374b [0,0,0,0,0,0|3,0,0]=3 222 B11R1.28 ClCCCNc1cnccn1 95eb107627969ec22a7382f919b06d14 [0,0,0,0,0,0|3,0,0]=3 223 B11R1.28 FCCCNc1ccccc1 b3f41abfb84c10f658d04a58ad820f46 [0,0,0,0,0,0|3,0,0]=3 224 B11R1.28 FCCCNc1ccccn1 565f4368802921f33e165ca06a4e0884 [0,0,0,0,0,0|2,0,0]=2 225 B11R1.28 FCCCNc1cccnc1 bf0c678c727f753f2416107c8fb7c2aa [0,0,0,0,0,0|4,0,0]=4 226 B11R1.28 FCCCNc1cccnn1 6e324a8fc1244ec41469b42c269ee8ea [0,0,0,0,0,0|3,0,0]=3 227 B11R1.28 FCCCNc1ccncc1 6a3cdf6587efe4480e7c908186350ce5 [0,0,0,0,0,0|4,0,0]=4 228 B11R1.28 FCCCNc1ccncn1 caab3b2fd0ac8fd97bd0f3edbbf34bdf [0,0,0,0,0,0|3,0,0]=3 229 B11R1.28 FCCCNc1cnccn1 89cb41b624fed856de26c1d3c4db977e [0,0,0,0,0,0|3,0,0]=3 230 B11R1.28 FCCCNc1cnncn1 67d9da37ccd6d3a23c466ba71e120dac [0,0,0,0,0,0|4,0,0]=4 231 B11R1.28 FCCCNc1ncccn1 695e5da76682e4ec67becb120dfc7ae2 [0,0,0,0,0,0|3,0,0]=3 232 B11R1.28 FCCCNc1nccnn1 3d033ac61011ec6dfe466d5f0389ab85 [0,0,0,0,0,0|4,0,0]=4 233 B11R1.28 FCCCNc1ncncn1 84c19c0904d90d81e6ac40341778dad0 [0,0,0,0,0,0|4,0,0]=4 234 B11R1.28 FCCCOc1ccccn1 cbed731556df3029ce519d57f9054d0b [0,0,0,0,0,0|2,0,0]=2 235 B11R1.28 FCCCOc1cccnc1 c358cc6076a85c51e04e470481f11a56 [0,0,0,0,0,0|4,0,0]=4 236 B11R1.28 FCCCOc1ccncc1 df30532896d176c22270c75c82382b5e [0,0,0,0,0,0|4,0,0]=4 237 B11R1.28 FCCCOc1cnccn1 d7f32d87b8dd0b90afb5b2f6bdc7d145 [0,0,0,0,0,0|3,0,0]=3 238 B11R1.28 FCCCOc1cncnn1 f84b3a9a896b3bc1f3ca1e236a2a592d [0,0,0,0,0,0|4,0,0]=4 239 B11R1.28 FCCCOc1ncccn1 1e129a3c16af0e941eeb7d1092880417 [0,0,0,0,0,0|3,0,0]=3 240 B11R1.28 FCCNCc1ccccc1 562ef8707f4288c2162274968d966312 [0,0,0,0,0,0|3,0,0]=3 241 B11R1.28 FCCNCc1ccccn1 4b02ff9e4d9d7623f6691b060ab82228 [0,0,0,0,0,0|2,0,0]=2 242 B11R1.28 FCCNCc1cccnc1 baa596bf0364075f3290f4a60a205b9b [0,0,0,0,0,0|4,0,0]=4 243 B11R1.28 FCCNCc1cccnn1 291a8a98cca567959b610961e1bb604d [0,0,0,0,0,0|3,0,0]=3 244 B11R1.28 FCCNCc1ccncc1 50b686a8fc08fd5effeaeb333b2ed93d [0,0,0,0,0,0|4,0,0]=4 245 B11R1.28 FCCNCc1ccncn1 21fdc6280eadc5e509bffdf177e16499 [0,0,0,0,0,0|3,0,0]=3 246 B11R1.28 FCCNCc1cnccn1 05b253d67f9070c628b10cb53c6f4f1d [0,0,0,0,0,0|3,0,0]=3 247 B11R1.28 FCCNCc1ncccn1 fe78f71374bafbc7a6b6bbf36a21ea95 [0,0,0,0,0,0|3,0,0]=3 248 B11R1.28 FCCOCc1ccccc1 d9b83bdc5263ec616987dc5988d5ee5b [0,0,0,0,0,0|3,0,0]=3 249 B11R1.28 FCCOCc1ccccn1 eeb2239e9027d0ce3a24146b5979566a [0,0,0,0,0,0|2,0,0]=2 250 B11R1.28 FCCOCc1cccnc1 e02a816ea65f063a58402293132849f2 [0,0,0,0,0,0|4,0,0]=4 251 B11R1.28 FCCOCc1cccnn1 045349780ec8439f32f3c03fdcbd7c6a [0,0,0,0,0,0|3,0,0]=3 252 B11R1.28 FCCOCc1ccncc1 14445d664118b43034c3d85510da7389 [0,0,0,0,0,0|4,0,0]=4 253 B11R1.28 FCCOCc1ccncn1 e7653e1637306c85ddbb0f8377c4534f [0,0,0,0,0,0|3,0,0]=3 254 B11R1.28 FCCOCc1cnccn1 d58701cb88fb9b58fb6be6651fc4e38c [0,0,0,0,0,0|3,0,0]=3 255 B11R1.28 FCCOCc1ncccn1 2ffa7486bad59fae35764fd3cd997651 [0,0,0,0,0,0|3,0,0]=3 256 B11R1.28 FCNCCc1ccccc1 0081f6dcce701ffe77378524f92f490b [0,0,0,0,0,0|3,0,0]=3 257 B11R1.28 FCNCCc1ccccn1 e15d9eaa28b96f67f0199ee7ab918bb8 [0,0,0,0,0,0|2,0,0]=2 258 B11R1.28 FCNCCc1cccnc1 ca44ff0aa2770a7476d8fe29ab7de27f [0,0,0,0,0,0|4,0,0]=4 259 B11R1.28 FCNCCc1ccncc1 534789a7dc9aa58bac25bdd251ebaa53 [0,0,0,0,0,0|4,0,0]=4 260 B11R1.28 FCNCCc1ccncn1 71d87b99838316558ab41f74e7a6ad39 [0,0,0,0,0,0|3,0,0]=3 261 B11R1.28 FCNCCc1cnccn1 a6fff95115e37691aedec5697188885d [0,0,0,0,0,0|3,0,0]=3 262 B11R1.28 FCNCCc1ncccn1 d4c74a64550de3aecd897af5dda17e37 [0,0,0,0,0,0|3,0,0]=3 263 B11R1.28 FCOCCc1ccccc1 f68582be9a805c98452f747e5a13d902 [0,0,0,0,0,0|3,0,0]=3 264 B11R1.28 FCOCCc1ccccn1 a87eac3bbe6c96cceb2ad793702bad9f [0,0,0,0,0,0|2,0,0]=2 265 B11R1.28 FCOCCc1cccnc1 95fb7ccc93ac5365251261a770f3e438 [0,0,0,0,0,0|4,0,0]=4 266 B11R1.28 FCOCCc1ccncc1 6e5a2cb5c96fa3a2dd4f846c43af9a9a [0,0,0,0,0,0|4,0,0]=4 267 B11R1.28 FCOCCc1ccncn1 42f65ea3fce13080ce28dc59f0361160 [0,0,0,0,0,0|3,0,0]=3 268 B11R1.28 FCOCCc1cnccn1 b992c651bab7313204deb41b6e2eb885 [0,0,0,0,0,0|3,0,0]=3 269 B11R1.28 FCOCCc1ncccn1 b64c0291aeb618931da15052e46cee6a [0,0,0,0,0,0|3,0,0]=3 270 B11R1.28 ICCNCc1ccccc1 697ca1617b546014ae02b06ad2981d8a [0,0,0,0,0,0|3,0,0]=3 271 B11R1.28 ICCNCc1ccccn1 33a419599dd52be8486dfb89562c6ffa [0,0,0,0,0,0|2,0,0]=2 272 B11R1.28 ICCNCc1cccnc1 7ed4e3e46a4c12f8a4c531489f3ab39c [0,0,0,0,0,0|4,0,0]=4 273 B11R1.28 ICCNCc1cccnn1 a65e7073d95b405ffeccc2df6f5819a9 [0,0,0,0,0,0|3,0,0]=3 274 B11R1.28 ICCNCc1ccncn1 cb4d0636a2fe5fa6f01a666a20ee081a [0,0,0,0,0,0|3,0,0]=3 275 B11R1.28 ICCNCc1ncccn1 488d37e468cbbb4c7fd896e124054349 [0,0,0,0,0,0|3,0,0]=3 276 B11R1.28 N#CCCNc1ccccc1 11cc2433e70294ae10477f88fd0e31d0 [0,0,0,0,0,0|3,0,1]=4 277 B11R1.28 N#CCCNc1ccccn1 9e13b9df3de22e2203631765bbe95860 [0,0,0,0,0,0|2,0,1]=3 278 B11R1.28 N#CCCNc1cccnn1 60fb60407cf9efc4c76e1314152f790f [0,0,0,0,0,0|3,0,1]=4 279 B11R1.28 N#CCCNc1ccncn1 69280f5d16b4e950255a0ac8ac928e91 [0,0,0,0,0,0|3,0,1]=4 280 B11R1.28 N#CCCNc1cnccn1 56408d673d0808eb1d453b2b8abfcb9a [0,0,0,0,0,0|3,0,1]=4 281 B11R1.28 N#CCCNc1ncccn1 e0d07af0e167bdfb23d02f205258343a [0,0,0,0,0,0|3,0,1]=4 282 B11R1.28 N#CCCOc1ccccn1 bd7f580d381a306ac6216b8462276232 [0,0,0,0,0,0|2,0,1]=3 283 B11R1.28 N#CCCOc1cnccn1 886f8e5fe9273e000db8f5e449395f21 [0,0,0,0,0,0|3,0,1]=4 284 B11R1.28 N#CCCOc1ncccn1 ce85de5d75fd9d68a283b541a77a848b [0,0,0,0,0,0|3,0,1]=4 285 B11R1.28 N#CCNCc1ccccc1 f23a3b4a1088925db39a0117b8e4d4c1 [0,0,0,0,0,0|3,0,1]=4 286 B11R1.28 N#CCNCc1ccccn1 b05b586b32bb564b4dc4c2b5f1c2deb2 [0,0,0,0,0,0|2,0,1]=3 287 B11R1.28 N#CCNCc1cccnn1 00aab79029ab03076018da08d717dc6d [0,0,0,0,0,0|3,0,1]=4 288 B11R1.28 N#CCNCc1ccncn1 14eb716530436078077c09bef391e3de [0,0,0,0,0,0|3,0,1]=4 289 B11R1.28 N#CCNCc1cnccn1 e88bdbb63dcf8cfd70f3a654b77ff4e0 [0,0,0,0,0,0|3,0,1]=4 290 B11R1.28 N#CCNCc1ncccn1 3bea84e0d2eae806712af0d5c344b230 [0,0,0,0,0,0|3,0,1]=4 291 B11R1.28 N#CCOCc1ccccc1 c6fb0c0fa9f97c70e5fbc997cccd1b4f [0,0,0,0,0,0|3,0,1]=4 292 B11R1.28 N#CCOCc1ccccn1 a0088b244471bb1db944b031bb167833 [0,0,0,0,0,0|2,0,1]=3 293 B11R1.28 N#CCOCc1cccnn1 b95ce81ea6ae6a705918ad73dba09ac2 [0,0,0,0,0,0|3,0,1]=4 294 B11R1.28 N#CCOCc1ccncn1 b3297f2407dcccd5ae008860caaf60d1 [0,0,0,0,0,0|3,0,1]=4 295 B11R1.28 N#CCOCc1cnccn1 ac90e51deba64c6460aa9629e3a59894 [0,0,0,0,0,0|3,0,1]=4 296 B11R1.28 N#CCOCc1ncccn1 f969392d9784a265b89051a614f5f979 [0,0,0,0,0,0|3,0,1]=4 297 B11R1.28 N#CNCCc1ccccc1 cc0f6fa18b1c1eb0550ef90401294e13 [0,0,0,0,0,0|3,0,1]=4 298 B11R1.28 N#CNCCc1ccccn1 6a52f53dd6b8c94fd37432a5813238ef [0,0,0,0,0,0|2,0,1]=3 299 B11R1.28 N#CSCOc1ccccn1 6af4f587c268b4b40768f51a4a5d6c68 [0,0,0,0,0,0|3,0,1]=4 300 B11R1.28 NOCCNc1ccccc1 6c5b7062e9d75a57daf03317347aff96 [0,0,0,0,0,0|4,0,0]=4 301 B11R1.28 NOCCNc1ccccn1 e682b49988380a8ee2db570ecbf6f017 [0,0,0,0,0,0|3,0,0]=3 302 B11R1.28 NOCCNc1cccnn1 bf9d9972d6e75e9141266ca2d4358a63 [0,0,0,0,0,0|4,0,0]=4 303 B11R1.28 NOCCNc1ccncn1 150a0aeb6f4a3b1f9ad7ed40ae2fddea [0,0,0,0,0,0|4,0,0]=4 304 B11R1.28 NOCCNc1cnccn1 bb456b35dd039c8fd0aa232b7f0c9c37 [0,0,0,0,0,0|4,0,0]=4 305 B11R1.28 NOCCNc1ncccn1 848cae5d0065999fbbfea31d92521fb0 [0,0,0,0,0,0|4,0,0]=4 306 B11R1.28 O/C=C\CNc1ccccn1 8552c5b8053856ab2aa5ee1e23f07468 [0,0,0,0,0,0|2,0,2]=4 307 B11R1.28 O=CCCNc1ccccc1 5adfd28b693cf17e4441c0e8b873a1f0 [0,0,0,0,0,0|3,0,1]=4 308 B11R1.28 O=CCCNc1ccccn1 a0dc64366680f7288fe7bdf7cc671acd [0,0,0,0,0,0|2,0,1]=3 309 B11R1.28 O=CCCNc1cccnn1 9390c4bf94c25ae4b4c838a5ad98980f [0,0,0,0,0,0|3,0,1]=4 310 B11R1.28 O=CCCNc1ccncn1 aecbe635db5db93fe59d436e7f8cf5f7 [0,0,0,0,0,0|3,0,1]=4 311 B11R1.28 O=CCCNc1cnccn1 fe687cbaeeff5bc57114aceb909e83c3 [0,0,0,0,0,0|3,0,1]=4 312 B11R1.28 O=CCCNc1ncccn1 3977e95c299502ccb39cbd12c5143cce [0,0,0,0,0,0|3,0,1]=4 313 B11R1.28 O=CCCOc1ccccn1 a44954cc28e77e68c48d11a6e381d2ee [0,0,0,0,0,0|2,0,1]=3 314 B11R1.28 O=CCCOc1cnccn1 c66353c7d013ed88269a3337cffab1d8 [0,0,0,0,0,0|3,0,1]=4 315 B11R1.28 O=CCCOc1ncccn1 9f5d73c6d85b1cb580662f0d36076946 [0,0,0,0,0,0|3,0,1]=4 316 B11R1.28 O=CCNCc1ccccc1 2b4b8121ff6ad050b40b87d13d8f5a1a [0,0,0,0,0,0|3,0,1]=4 317 B11R1.28 O=CCNCc1ccccn1 e205fc2dfe1b7f5a0d5f0647f95b66cb [0,0,0,0,0,0|2,0,1]=3 318 B11R1.28 O=CCNCc1cccnn1 3ec681ab244f7edd9eb873abea35a09f [0,0,0,0,0,0|3,0,1]=4 319 B11R1.28 O=CCNCc1ccncn1 f4cc42f2f9932342b6a0df366877ada0 [0,0,0,0,0,0|3,0,1]=4 320 B11R1.28 O=CCNCc1cnccn1 64e87f3a1a44784468df29ec03c2080d [0,0,0,0,0,0|3,0,1]=4 321 B11R1.28 O=CCNCc1ncccn1 3ba782c93bebe0220b1857f27e6c89e3 [0,0,0,0,0,0|3,0,1]=4 322 B11R1.28 O=CCOCc1ccccc1 7bd4c1ac5902422e7c3cafad9115c4f2 [0,0,0,0,0,0|3,0,1]=4 323 B11R1.28 O=CCOCc1ccccn1 a6f535e6c372012997e3b2297923fbfc [0,0,0,0,0,0|2,0,1]=3 324 B11R1.28 O=CCOCc1cccnn1 ab7f679920a155c06d99954360cb9102 [0,0,0,0,0,0|3,0,1]=4 325 B11R1.28 O=CCOCc1ccncn1 15eb1d0777a7a61a8263fa74d8807dcd [0,0,0,0,0,0|3,0,1]=4 326 B11R1.28 O=CCOCc1cnccn1 989027f70e8c30d5e19e311378e95ebf [0,0,0,0,0,0|3,0,1]=4 327 B11R1.28 O=CCOCc1ncccn1 010aa99096c3c81eff59b4b1c256a75f [0,0,0,0,0,0|3,0,1]=4 328 B11R1.28 O=CNCCc1ccccc1 d1fab3f35b45ae0bc45cf7bf9f19384c [0,0,0,0,0,0|3,0,1]=4 329 B11R1.28 O=CNCCc1ccccn1 36fb465b4a699ed2860619296ed044a4 [0,0,0,0,0,0|2,0,1]=3 330 B11R1.28 O=CNCCc1ccncn1 c61ffee11aa76c4b79dbd40eecd5754f [0,0,0,0,0,0|3,0,1]=4 331 B11R1.28 O=CNCCc1cnccn1 aa33cad7c82b76f9314494217572508e [0,0,0,0,0,0|3,0,1]=4 332 B11R1.28 O=CNCCc1ncccn1 205f827e0f0482740367998916b6a3ab [0,0,0,0,0,0|3,0,1]=4 333 B11R1.28 OCCCNc1ccccc1 6f65c15387fc952c20110ea29ef53956 [0,0,0,0,0,0|3,0,0]=3 334 B11R1.28 OCCCNc1ccccn1 587693fe3960ae4ed00c51618661aeab [0,0,0,0,0,0|2,0,0]=2 335 B11R1.28 OCCCNc1cccnc1 90b07b63ba2da4339e6031d93f7df208 [0,0,0,0,0,0|4,0,0]=4 336 B11R1.28 OCCCNc1cccnn1 247aa2fcb6c99ae0f56cb06724ac3034 [0,0,0,0,0,0|3,0,0]=3 337 B11R1.28 OCCCNc1ccncc1 7676a46d9ab85382fda372d12f0ec436 [0,0,0,0,0,0|4,0,0]=4 338 B11R1.28 OCCCNc1ccncn1 8f8e0fe811bf9371817f728d08c59f5f [0,0,0,0,0,0|3,0,0]=3 339 B11R1.28 OCCCNc1cnccn1 394ab3fd80b46dcc8203d15389985779 [0,0,0,0,0,0|3,0,0]=3 340 B11R1.28 OCCCNc1cnncn1 82a90744d3f091f67bc82d039cba59a8 [0,0,0,0,0,0|4,0,0]=4 341 B11R1.28 OCCCNc1ncccn1 1db3dee2f5e622c36a01a6f642b42373 [0,0,0,0,0,0|3,0,0]=3 342 B11R1.28 OCCCNc1nccnn1 5bd6014ecbd097f99153afdf98ebbe7a [0,0,0,0,0,0|4,0,0]=4 343 B11R1.28 OCCCNc1ncncn1 6d56ec45f05b8cf3722b4ebaf9ab08c8 [0,0,0,0,0,0|4,0,0]=4 344 B11R1.28 OCCNCc1ccccc1 6075728aab81556d5096d2980e4afa2d [0,0,0,0,0,0|3,0,0]=3 345 B11R1.28 OCCNCc1ccccn1 aee8d8851b64ae441b47dd7c19255c9b [0,0,0,0,0,0|2,0,0]=2 346 B11R1.28 OCCNCc1cccnc1 882a81680203d781920d7144e525a6cd [0,0,0,0,0,0|4,0,0]=4 347 B11R1.28 OCCNCc1cccnn1 e41c460ec8467c13b31f38e40901bc04 [0,0,0,0,0,0|3,0,0]=3 348 B11R1.28 OCCNCc1ccncc1 9ecc8a72acff6784c82756ff768b065d [0,0,0,0,0,0|4,0,0]=4 349 B11R1.28 OCCNCc1ccncn1 fef527a9dde408a7b55664eab4f2eb99 [0,0,0,0,0,0|3,0,0]=3 350 B11R1.28 OCCNCc1cnccn1 2ee89dc8c04206d44948d3c79c8e8f8a [0,0,0,0,0,0|3,0,0]=3 351 B11R1.28 OCCNCc1ncccn1 34cde4fdd469b9280baca8a787271f1f [0,0,0,0,0,0|3,0,0]=3 352 B11R1.28 OCNCCc1ccccc1 dba1af705064b03a49f56a10af922b9a [0,0,0,0,0,0|3,0,0]=3 353 B11R1.28 OCNCCc1ccccn1 870a6b93d6f817d2b7b76ee4a753e49e [0,0,0,0,0,0|2,0,0]=2 354 B11R1.28 OCNCCc1cccnc1 5a238842d821729331c809bafe95118a [0,0,0,0,0,0|4,0,0]=4 355 B11R1.28 OCNCCc1ccncc1 d4fdef2a16a1c89c93b39a7d349558eb [0,0,0,0,0,0|4,0,0]=4 356 B11R1.28 OCNCCc1ccncn1 6744261abdd24d42c96fea72d14f993a [0,0,0,0,0,0|3,0,0]=3 357 B11R1.28 OCNCCc1cnccn1 f4950c420442047f83981ab203d27aa5 [0,0,0,0,0,0|3,0,0]=3 358 B11R1.28 OCNCCc1ncccn1 ef945efe9c2fffc4c52fc2c7c7ec1101 [0,0,0,0,0,0|3,0,0]=3 359 B11R1.28 SCCCNc1ccccc1 0ed9842b503e3cd70fca4624b001f5d8 [0,0,0,0,0,0|3,0,0]=3 360 B11R1.28 SCCCNc1ccccn1 6e9255137fb1e7130c483b51e209e603 [0,0,0,0,0,0|2,0,0]=2 361 B11R1.28 SCCCNc1cccnc1 9d7b88e69ec7c6b34ca7771b6e0b91e4 [0,0,0,0,0,0|4,0,0]=4 362 B11R1.28 SCCCNc1cccnn1 baec61a9713dff8daf3ca7c4cac6b808 [0,0,0,0,0,0|3,0,0]=3 363 B11R1.28 SCCCNc1ccncc1 ca21b760b7ec316b64d15f3538d2549c [0,0,0,0,0,0|4,0,0]=4 364 B11R1.28 SCCCNc1ccncn1 840adef22daf6a19933e217bb9a9f500 [0,0,0,0,0,0|3,0,0]=3 365 B11R1.28 SCCCNc1cnccn1 272fd3f48e11eac14ab86db0420f1e23 [0,0,0,0,0,0|3,0,0]=3 366 B11R1.28 SCCCNc1cnncn1 c11514a0f494cb68aad1b0f533866281 [0,0,0,0,0,0|4,0,0]=4 367 B11R1.28 SCCCNc1ncccn1 06ea00dc6a5489dd4165dd3a53aabc49 [0,0,0,0,0,0|3,0,0]=3 368 B11R1.28 SCCCNc1nccnn1 bba1a670685ba593dea01351476de250 [0,0,0,0,0,0|4,0,0]=4 369 B11R1.28 SCCCNc1ncncn1 9c163f7c8a882a95190c713055572b12 [0,0,0,0,0,0|4,0,0]=4 370 B11R1.28 SCCCOc1ccccn1 a6c411fcae0c9e021a422469b3fdfe87 [0,0,0,0,0,0|2,0,0]=2 371 B11R1.28 SCCCOc1cccnc1 134743f8f7a869616fe16d61afd2d0e6 [0,0,0,0,0,0|4,0,0]=4 372 B11R1.28 SCCCOc1ccncc1 e86746acf63686675a8e18fe26221a62 [0,0,0,0,0,0|4,0,0]=4 373 B11R1.28 SCCCOc1cnccn1 49e064e5a2490e0ef11744b13f45f2e7 [0,0,0,0,0,0|3,0,0]=3 374 B11R1.28 SCCCOc1cncnn1 017d5cc125823e9de2bbe6922fc2458f [0,0,0,0,0,0|4,0,0]=4 375 B11R1.28 SCCCOc1ncccn1 51d8883d2c462ce976a6488d9e24f6d0 [0,0,0,0,0,0|3,0,0]=3 376 B11R1.28 SCCNCc1ccccc1 842b711568e585283783756ca8279842 [0,0,0,0,0,0|3,0,0]=3 377 B11R1.28 SCCNCc1ccccn1 ace948b27200a431fbd41a7ba53deb87 [0,0,0,0,0,0|2,0,0]=2 378 B11R1.28 SCCNCc1cccnc1 8ab6cc5726329dc3b917c71b0e8e3a12 [0,0,0,0,0,0|4,0,0]=4 379 B11R1.28 SCCNCc1cccnn1 b36fb77d560218cb054ebe8a417fefed [0,0,0,0,0,0|3,0,0]=3 380 B11R1.28 SCCNCc1ccncc1 3b6ef2e293d7e6f2b9cd175d9cbecd46 [0,0,0,0,0,0|4,0,0]=4 381 B11R1.28 SCCNCc1ccncn1 d0b375d31e920fe44bab2977f5737d48 [0,0,0,0,0,0|3,0,0]=3 382 B11R1.28 SCCNCc1cnccn1 229e48027f123997f1a159293a108938 [0,0,0,0,0,0|3,0,0]=3 383 B11R1.28 SCCNCc1ncccn1 6eea8a1d6f1d5c9341f6412e98660e00 [0,0,0,0,0,0|3,0,0]=3 384 B11R1.28 SCCOCc1ccccc1 ef1d3bfcf77b316513e3e84b7d85c143 [0,0,0,0,0,0|3,0,0]=3 385 B11R1.28 SCCOCc1ccccn1 922bd68bb819886f081031e9f73951e2 [0,0,0,0,0,0|2,0,0]=2 386 B11R1.28 SCCOCc1cccnc1 c1c52e309e8814a28fb8d713bda79484 [0,0,0,0,0,0|4,0,0]=4 387 B11R1.28 SCCOCc1cccnn1 6ff44a6505ccdc24e6801274e14d128b [0,0,0,0,0,0|3,0,0]=3 388 B11R1.28 SCCOCc1ccncc1 5a71ae8d634b1ad8f983b65a8abfb1e3 [0,0,0,0,0,0|4,0,0]=4 389 B11R1.28 SCCOCc1ccncn1 fc7035ecc1107a6ac0dd57d9c8565b14 [0,0,0,0,0,0|3,0,0]=3 390 B11R1.28 SCCOCc1cnccn1 263e375ea74000ad515cd81e03dc4781 [0,0,0,0,0,0|3,0,0]=3 391 B11R1.28 SCCOCc1ncccn1 164e82fcb3d17b4838dc1f7f9320f31e [0,0,0,0,0,0|3,0,0]=3 392 B10R1.17 BrCCNc1ccccc1 08c39138e90dcc3ad4c25fdba0569b67 [1,0,0,0,0,0|3,0,0]=4 393 B10R1.17 BrCCNc1ccccn1 3e3884def368abe14a8394ce1a1093e4 [1,0,0,0,0,0|2,0,0]=3 394 B10R1.17 BrCCNc1cccnn1 8bb1d2166673e66012e04a5297d759dc [1,0,0,0,0,0|3,0,0]=4 395 B10R1.17 BrCCNc1ccncn1 009ea89d37668eca0fd908b13fadca96 [1,0,0,0,0,0|3,0,0]=4 396 B10R1.17 C#CCNc1ccccn1 d6e1769cae1c3272157b84417d737e93 [1,0,0,0,0,0|1,0,2]=4 397 B10R1.17 C#CCOc1ccccn1 ed1d9c134ad2cbb060972098b462edbb [1,0,0,0,0,0|1,0,2]=4 398 B10R1.17 C=CCNc1ccccn1 a09a0780182f6d8fa8752ca3713a2f3e [1,0,0,0,0,0|1,0,2]=4 399 B10R1.17 C=CCOc1ccccn1 eb9f74f9d52407e143455993efad096c [1,0,0,0,0,0|1,0,2]=4 400 B10R1.17 CCCNc1ccccc1 b539dcf8361adb43cc5ffbb8617222f9 [1,0,0,0,0,0|2,0,0]=3 401 B10R1.17 CCCNc1ccccn1 d0e3424364e1c8a55b80e6e83d3696ba [1,0,0,0,0,0|1,0,0]=2 402 B10R1.17 CCCNc1cccnc1 54f0ece250e78709faf1eb2fd4dc869b [1,0,0,0,0,0|3,0,0]=4 403 B10R1.17 CCCNc1cccnn1 563334c6dadea743653cde03719d759b [1,0,0,0,0,0|2,0,0]=3 404 B10R1.17 CCCNc1ccncc1 d6095b2a5c05617a6cec49b81fb053c5 [1,0,0,0,0,0|3,0,0]=4 405 B10R1.17 CCCNc1ccncn1 b9fcfeaf51b4e3f06d605d771d307526 [1,0,0,0,0,0|2,0,0]=3 406 B10R1.17 CCCNc1cnccn1 21846cbecedbe2640cf1187c9cb12883 [1,0,0,0,0,0|2,0,0]=3 407 B10R1.17 CCCNc1cnncn1 ae485abbfb53ff29b4abc600381cf9a2 [1,0,0,0,0,0|3,0,0]=4 408 B10R1.17 CCCNc1ncccn1 75419027ddb25105c51dd1506820ccba [1,0,0,0,0,0|2,0,0]=3 409 B10R1.17 CCCNc1nccnn1 ba977de7796519a7c9234ce6324979fd [1,0,0,0,0,0|3,0,0]=4 410 B10R1.17 CCCNc1ncncn1 50d248fa06f762f479fc5160c627bfd9 [1,0,0,0,0,0|3,0,0]=4 411 B10R1.17 CCCOc1ccccn1 6e04423b9fd777130a88eaa9fd38fe0c [1,0,0,0,0,0|1,0,0]=2 412 B10R1.17 CCCOc1cccnc1 a97f517fc793a805aaab3ac7468bbd26 [1,0,0,0,0,0|3,0,0]=4 413 B10R1.17 CCCOc1ccncc1 f349ca52270425380eacc7a2a158cca4 [1,0,0,0,0,0|3,0,0]=4 414 B10R1.17 CCCOc1cnccn1 63621ef82dd8a608febe84451551c55a [1,0,0,0,0,0|2,0,0]=3 415 B10R1.17 CCCOc1cncnn1 bc5670d65c0c36d3b12443fc4957fbb6 [1,0,0,0,0,0|3,0,0]=4 416 B10R1.17 CCCOc1ncccn1 5c5a6b9b9ac104a48d6c4b0d32992f0c [1,0,0,0,0,0|2,0,0]=3 417 B10R1.17 CCNCc1ccccc1 b1285c6596ffdf0473a3780bf23df272 [1,0,0,0,0,0|2,0,0]=3 418 B10R1.17 CCNCc1ccccn1 18cfef8413e038075fdfe85720c8bb60 [1,0,0,0,0,0|1,0,0]=2 419 B10R1.17 CCNCc1cccnc1 ef83bfb13d2744bc293d6f1d68f67b86 [1,0,0,0,0,0|3,0,0]=4 420 B10R1.17 CCNCc1cccnn1 d81bd9bf1bc516576c473bbc4cf064a6 [1,0,0,0,0,0|2,0,0]=3 421 B10R1.17 CCNCc1ccncc1 2e26d8de78e71e06bcd28df387653244 [1,0,0,0,0,0|3,0,0]=4 422 B10R1.17 CCNCc1ccncn1 ae6a093ba5aef71c0ed8d67651e0dd26 [1,0,0,0,0,0|2,0,0]=3 423 B10R1.17 CCNCc1cnccn1 e42a4917d2a6a9dffed5bdafd4c5a5d6 [1,0,0,0,0,0|2,0,0]=3 424 B10R1.17 CCNCc1ncccn1 7e64da8f6dedc74d9803d8b0ac5afe0e [1,0,0,0,0,0|2,0,0]=3 425 B10R1.17 CCOCc1ccccc1 551a24ad73c54bc42b4e27015fdb411f [1,0,0,0,0,0|2,0,0]=3 426 B10R1.17 CCOCc1ccccn1 0c63694580ac3136b3801886d248907b [1,0,0,0,0,0|1,0,0]=2 427 B10R1.17 CCOCc1cccnc1 5f09f824e7a9d5177841898d80553992 [1,0,0,0,0,0|3,0,0]=4 428 B10R1.17 CCOCc1cccnn1 a18ecdaafc84bd92138525fb2f4ad399 [1,0,0,0,0,0|2,0,0]=3 429 B10R1.17 CCOCc1ccncc1 1d1afe04b02325a5cf955e686c22ba10 [1,0,0,0,0,0|3,0,0]=4 430 B10R1.17 CCOCc1ccncn1 d55d0b80fa8d405bad8866668c0f9fa7 [1,0,0,0,0,0|2,0,0]=3 431 B10R1.17 CCOCc1cnccn1 7fb271123056acc990d03d3767398eec [1,0,0,0,0,0|2,0,0]=3 432 B10R1.17 CCOCc1ncccn1 ba95357c7224be2db8f523f6aa6f9bb0 [1,0,0,0,0,0|2,0,0]=3 433 B10R1.17 COCNc1ccccc1 6c62c6b48b6ce69fe29d4b52e03d5674 [1,0,0,0,0,0|3,0,0]=4 434 B10R1.17 COCNc1ccccn1 a7abef3468bc69aa80ea510854a664da [1,0,0,0,0,0|2,0,0]=3 435 B10R1.17 COCNc1cccnn1 81506436050659ef73117567fa6791d8 [1,0,0,0,0,0|3,0,0]=4 436 B10R1.17 COCNc1ccncn1 0121271d6ad38ca03fde203df163daca [1,0,0,0,0,0|3,0,0]=4 437 B10R1.17 COCNc1cnccn1 e1b86a322d65d71968ad3b0b53c14350 [1,0,0,0,0,0|3,0,0]=4 438 B10R1.17 COCNc1ncccn1 3760316947979d077818f7dd79f44e4b [1,0,0,0,0,0|3,0,0]=4 439 B10R1.17 COCOc1ccccn1 20cd252a71a5a01c3e93af63053a4326 [1,0,0,0,0,0|2,0,0]=3 440 B10R1.17 COCOc1cnccn1 91692ef16c539c2f51ce9f654d4e167a [1,0,0,0,0,0|3,0,0]=4 441 B10R1.17 COCOc1ncccn1 2bd9fff082f7aee48935ad67be70ba10 [1,0,0,0,0,0|3,0,0]=4 442 B10R1.17 CSCNc1ccccc1 7a27a5c68b132b0ae36908396631930e [1,0,0,0,0,0|3,0,0]=4 443 B10R1.17 CSCNc1ccccn1 cc0ec9b3c5cc0b5eddbb2cfb429d6e35 [1,0,0,0,0,0|2,0,0]=3 444 B10R1.17 CSCNc1cccnn1 25ab19c91bfa446099e97e2e9884abac [1,0,0,0,0,0|3,0,0]=4 445 B10R1.17 CSCNc1ccncn1 c8f5e25272793ac1621ccdc638520744 [1,0,0,0,0,0|3,0,0]=4 446 B10R1.17 CSCNc1cnccn1 930f16f0ffaab42f985807a52dc0c6d1 [1,0,0,0,0,0|3,0,0]=4 447 B10R1.17 CSCNc1ncccn1 c2922d243c5be83b9b56350e712309ad [1,0,0,0,0,0|3,0,0]=4 448 B10R1.17 CSCOc1ccccn1 af78560ad465f4d707ca132fa83d0e3a [1,0,0,0,0,0|2,0,0]=3 449 B10R1.17 CSCOc1cnccn1 52ffcd2be78a9b2f46dfb44270cb610f [1,0,0,0,0,0|3,0,0]=4 450 B10R1.17 CSCOc1ncccn1 f123fda50715e79ccef9ccaf5caca47e [1,0,0,0,0,0|3,0,0]=4 451 B10R1.17 FCCNc1ccccc1 f275d2eb426a2818882d3c7dcacca572 [1,0,0,0,0,0|3,0,0]=4 452 B10R1.17 FCCNc1ccccn1 6ab197fb6cbd8dea7ad6d85c80356b58 [1,0,0,0,0,0|2,0,0]=3 453 B10R1.17 FCCNc1cccnn1 50662e1b5530675bc8d8d1093a0bcb88 [1,0,0,0,0,0|3,0,0]=4 454 B10R1.17 FCCNc1ccncn1 28287bfb6cdbc721436daf6264c17c69 [1,0,0,0,0,0|3,0,0]=4 455 B10R1.17 FCCNc1cnccn1 dd60db3af5d33017b5272adbacfa821e [1,0,0,0,0,0|3,0,0]=4 456 B10R1.17 FCCNc1ncccn1 b6a3f35367c076e0e2eb0138e0781769 [1,0,0,0,0,0|3,0,0]=4 457 B10R1.17 FCCOc1ccccn1 06b65dfb48082d4779fc37c34dadb476 [1,0,0,0,0,0|2,0,0]=3 458 B10R1.17 FCCOc1cnccn1 a0c148fc7e01278295d3fef98ce5f3d8 [1,0,0,0,0,0|3,0,0]=4 459 B10R1.17 FCCOc1ncccn1 20e83a8a3be70e78ea887ddb53a9464b [1,0,0,0,0,0|3,0,0]=4 460 B10R1.17 FCNCc1ccccc1 0dcd541b35f2d813e3bd4529f13aa61b [1,0,0,0,0,0|3,0,0]=4 461 B10R1.17 FCNCc1ccccn1 14327276004818c05fc55a3ce987673c [1,0,0,0,0,0|2,0,0]=3 462 B10R1.17 FCNCc1cccnn1 bce279edad5329c009e9b508fb1aee5b [1,0,0,0,0,0|3,0,0]=4 463 B10R1.17 FCNCc1ccncn1 86997bd0980cabeeea4fdf8cfb1980d9 [1,0,0,0,0,0|3,0,0]=4 464 B10R1.17 FCNCc1cnccn1 b6859870939f07ca1816c457c1ced744 [1,0,0,0,0,0|3,0,0]=4 465 B10R1.17 FCNCc1ncccn1 631804a848c2f7581758f33d98025650 [1,0,0,0,0,0|3,0,0]=4 466 B10R1.17 FCOCc1ccccc1 602c85a0828834d1798ab6d91c5aa92b [1,0,0,0,0,0|3,0,0]=4 467 B10R1.17 FCOCc1ccccn1 52de5aacdb8cde16edb0cbea31183c40 [1,0,0,0,0,0|2,0,0]=3 468 B10R1.17 FCOCc1cccnn1 be211298f0d8017761d0379df43db85c [1,0,0,0,0,0|3,0,0]=4 469 B10R1.17 FCOCc1ccncn1 095b77e062a0a54a0c13c35fafab8dee [1,0,0,0,0,0|3,0,0]=4 470 B10R1.17 FCOCc1cnccn1 a11466f76fde0f26dadf75b6a45d47be [1,0,0,0,0,0|3,0,0]=4 471 B10R1.17 FCOCc1ncccn1 01a146b5b6805692958b2312a16de3b5 [1,0,0,0,0,0|3,0,0]=4 472 B10R1.17 ICCNc1ccccc1 2e8d29f41a7952c3a309dd8ce57744b3 [1,0,0,0,0,0|3,0,0]=4 473 B10R1.17 ICCNc1cccnn1 25a4665350da72721cd932013095093a [1,0,0,0,0,0|3,0,0]=4 474 B10R1.17 N#CCNc1ccccn1 49c7d19f4d4a23e5bd1952f105c61103 [1,0,0,0,0,0|2,0,1]=4 475 B10R1.17 N#CCOc1ccccn1 34a3895b8030e0f5731db636d99745cf [1,0,0,0,0,0|2,0,1]=4 476 B10R1.17 N#CNCc1ccccn1 73d970ffa881cb91d14134c59642f4f6 [1,0,0,0,0,0|2,0,1]=4 477 B10R1.17 O=CCNc1ccccn1 b00390cf782e1a66064d84fbb4455a3c [1,0,0,0,0,0|2,0,1]=4 478 B10R1.17 O=CCOc1ccccn1 78f53edacda55ffdc5004f3168d63b47 [1,0,0,0,0,0|2,0,1]=4 479 B10R1.17 O=CNCc1ccccn1 2a4bd7c465ac0ab8804867d1eeb7fd18 [1,0,0,0,0,0|2,0,1]=4 480 B10R1.17 OCCNc1ccccc1 39a30f826fab6ed2b66a9ec4a9dddbdb [1,0,0,0,0,0|3,0,0]=4 481 B10R1.17 OCCNc1ccccn1 14d1f9671b0391e7cf5b318b74673aa8 [1,0,0,0,0,0|2,0,0]=3 482 B10R1.17 OCCNc1cccnn1 904669d1e67b66fbedf39e30d8f01302 [1,0,0,0,0,0|3,0,0]=4 483 B10R1.17 OCCNc1ccncn1 16630884411af81ebaafd51b9ece01ce [1,0,0,0,0,0|3,0,0]=4 484 B10R1.17 OCCNc1cnccn1 b8c8b329bec75a99372dd1b5fe38a887 [1,0,0,0,0,0|3,0,0]=4 485 B10R1.17 OCCNc1ncccn1 f239abfea1ae338c0c6b2d47a465751c [1,0,0,0,0,0|3,0,0]=4 486 B10R1.17 OCNCc1ccccc1 c4aaeb48f32c090af3c65531a6e27cd4 [1,0,0,0,0,0|3,0,0]=4 487 B10R1.17 OCNCc1ccccn1 9488b9a65408dc593594baac432012ff [1,0,0,0,0,0|2,0,0]=3 488 B10R1.17 OCNCc1cccnn1 ab22a6b6bf709ff19959feb80ebef395 [1,0,0,0,0,0|3,0,0]=4 489 B10R1.17 OCNCc1ccncn1 e1601b835614d257d03e1a317c6e849b [1,0,0,0,0,0|3,0,0]=4 490 B10R1.17 OCNCc1cnccn1 2e97e3c7cc39869beec41193ed233122 [1,0,0,0,0,0|3,0,0]=4 491 B10R1.17 OCNCc1ncccn1 c2a1de97786ff8120b7277138f237b3a [1,0,0,0,0,0|3,0,0]=4 492 B10R1.17 SCCNc1ccccc1 9bbad99372906cf90d9dd5df1e41681f [1,0,0,0,0,0|3,0,0]=4 493 B10R1.17 SCCNc1ccccn1 de2447df01f4514b4267a28db291424f [1,0,0,0,0,0|2,0,0]=3 494 B10R1.17 SCCNc1cccnn1 ea4f3403b14ed9358eb50c9965b8278f [1,0,0,0,0,0|3,0,0]=4 495 B10R1.17 SCCNc1ccncn1 2bfdb9a116c43f44649ab3d9243c2a49 [1,0,0,0,0,0|3,0,0]=4 496 B10R1.17 SCCNc1cnccn1 7a532bee0aa009efe26ced5e1fd07b4c [1,0,0,0,0,0|3,0,0]=4 497 B10R1.17 SCCNc1ncccn1 d101d1cc4fdf91fde35f39137b9892aa [1,0,0,0,0,0|3,0,0]=4 498 B10R1.17 SCCOc1ccccn1 80884e7103538d273738856f1f9d4222 [1,0,0,0,0,0|2,0,0]=3 499 B10R1.17 SCCOc1cnccn1 9ed631421fd79ea9b405fc40aac58272 [1,0,0,0,0,0|3,0,0]=4 500 B10R1.17 SCCOc1ncccn1 9ee0a1056d21851b24aff1da7da6461b [1,0,0,0,0,0|3,0,0]=4 501 B12R1.1 BrCCNCc1ccc(cc1)Br 20450213ce8b054b984ff490a50ef1fa [0,1,0,0,0,0|3,0,0]=4 502 B12R1.1 BrCCNCc1ccc(cc1)I cb0bc4759e46ae9c4f093aeccd44029f [0,1,0,0,0,0|3,0,0]=4 503 B12R1.1 BrCCNCc1ccc(cn1)Br f962cfa8d175797e31e4859cbb850cf0 [0,1,0,0,0,0|2,0,0]=3 504 B12R1.1 BrCCNCc1cnc(cn1)Br 4ed08b462061fc005b27831b4f7b857b [0,1,0,0,0,0|3,0,0]=4 505 B12R1.1 BrCCNCc1ncc(cn1)Br 1121885c62934d997629c337b0fe5a2f [0,1,0,0,0,0|3,0,0]=4 506 B12R1.1 Brc1ccc(cc1)CNCCI 73ba4c9bc494173a2854cf80c7bda7f2 [0,1,0,0,0,0|3,0,0]=4 507 B12R1.1 Brc1ccc(nc1)CNCCI 20cb5f1a1b59ccacbc538a9586523a60 [0,1,0,0,0,0|2,0,0]=3 508 B12R1.1 Brc1cnc(cn1)CNCCI 30e8b1131d46c6b68ce2307385f823f0 [0,1,0,0,0,0|3,0,0]=4 509 B12R1.1 Brc1cnc(nc1)CNCCI 784bae70862367d33b9229b1dbf89ec2 [0,1,0,0,0,0|3,0,0]=4 510 B12R1.1 C#CCCNc1ccc(cn1)Br 1d28ab91c978d7e8a0c79f4e90b4a024 [0,1,0,0,0,0|1,0,2]=4 511 B12R1.1 C#CCCNc1ccc(cn1)C 5194ac7dc2a140b80c7ef190f45e4c93 [0,1,0,0,0,0|1,0,2]=4 512 B12R1.1 C#CCCNc1ccc(cn1)Cl 74b1eced5646378ae0a4697135893039 [0,1,0,0,0,0|1,0,2]=4 513 B12R1.1 C#CCCNc1ccc(cn1)F 29d6f7652880034ed616a5f9a4a3ab3a [0,1,0,0,0,0|1,0,2]=4 514 B12R1.1 C#CCCNc1ccc(cn1)I 9749a7ff6c1af2f92f2cf05d651a9ea5 [0,1,0,0,0,0|1,0,2]=4 515 B12R1.1 C#CCCOc1ccc(cn1)C 747f89bac3c03b754f04ad7fe2aed4cd [0,1,0,0,0,0|1,0,2]=4 516 B12R1.1 C#CCCOc1ccc(cn1)Cl a3ada43410a2e158fa58479741845cf1 [0,1,0,0,0,0|1,0,2]=4 517 B12R1.1 C#CCCOc1ccc(cn1)F 75eee3b11d1b160dbc81c6470f521cac [0,1,0,0,0,0|1,0,2]=4 518 B12R1.1 C#CCCOc1ccc(cn1)I 29155ff83a435dbd12cae9ed63d5d096 [0,1,0,0,0,0|1,0,2]=4 519 B12R1.1 C#CCNCc1ccc(cn1)Br 669049faf583749f10c96cbf96a8bd0e [0,1,0,0,0,0|1,0,2]=4 520 B12R1.1 C#CCNCc1ccc(cn1)C 58f0d409da59c0674d8ac2c45f77651c [0,1,0,0,0,0|1,0,2]=4 521 B12R1.1 C#CCNCc1ccc(cn1)Cl 53647037c0c4aceb509af84bf305c84c [0,1,0,0,0,0|1,0,2]=4 522 B12R1.1 C#CCNCc1ccc(cn1)F f8da5c82bd65dcf0388d30e64ba266d7 [0,1,0,0,0,0|1,0,2]=4 523 B12R1.1 C#CCOCc1ccc(cn1)Br e9622a6081e0af137e02ed939f7d3451 [0,1,0,0,0,0|1,0,2]=4 524 B12R1.1 C#CCOCc1ccc(cn1)C acadcbd2a3be84a6ca11ef4bf6a23a4a [0,1,0,0,0,0|1,0,2]=4 525 B12R1.1 C#CCOCc1ccc(cn1)Cl 7491bba86b718ea837cc4e7b3654592e [0,1,0,0,0,0|1,0,2]=4 526 B12R1.1 C#CCOCc1ccc(cn1)F ce31688c412b2a2566c88b22306e796a [0,1,0,0,0,0|1,0,2]=4 527 B12R1.1 C#CCOCc1ccc(cn1)I dc06b39e45e0d2c93ad857aa2525ad6a [0,1,0,0,0,0|1,0,2]=4 528 B12R1.1 C/C=C/CNc1ccc(cn1)Br 4bd1bb78e711c657e8783eed53c90483 [0,1,0,0,0,0|1,0,2]=4 529 B12R1.1 C/C=C/CNc1ccc(cn1)C 33cd430e2b5893e328d303ef43c4ad72 [0,1,0,0,0,0|1,0,2]=4 530 B12R1.1 C/C=C/CNc1ccc(cn1)Cl f83e46635f13bda0606a708235988fd9 [0,1,0,0,0,0|1,0,2]=4 531 B12R1.1 C/C=C/CNc1ccc(cn1)F 2ecdb010aa98fbb278183f4ea8709eef [0,1,0,0,0,0|1,0,2]=4 532 B12R1.1 C/C=C/CNc1ccc(cn1)I ce2e59497eddfac5a012a8d224afe242 [0,1,0,0,0,0|1,0,2]=4 533 B12R1.1 C/C=C/COc1ccc(cn1)C 19d9f45a1d6637ebf37188e8361c2b94 [0,1,0,0,0,0|1,0,2]=4 534 B12R1.1 C/C=C/COc1ccc(cn1)Cl dc616a86e245b77ac2a8f4bcbc7a9bfc [0,1,0,0,0,0|1,0,2]=4 535 B12R1.1 C/C=C/COc1ccc(cn1)F 301fff3a53e2470c1528b28255a2f01b [0,1,0,0,0,0|1,0,2]=4 536 B12R1.1 C/C=C/COc1ccc(cn1)I d84acb004ed83826433c30d119781908 [0,1,0,0,0,0|1,0,2]=4 537 B12R1.1 C/C=C\CNc1ccc(cn1)Br ae706438e4e506e7e2714ac73fde195b [0,1,0,0,0,0|1,0,2]=4 538 B12R1.1 C/C=C\CNc1ccc(cn1)C 7ea97470488b091c01c0823a7455a1ce [0,1,0,0,0,0|1,0,2]=4 539 B12R1.1 C/C=C\CNc1ccc(cn1)Cl ecca74732aadc05a8bca68fe40c70a12 [0,1,0,0,0,0|1,0,2]=4 540 B12R1.1 C/C=C\CNc1ccc(cn1)F 7fc3fd656dc2fc625475c109f9cf180c [0,1,0,0,0,0|1,0,2]=4 541 B12R1.1 C/C=C\CNc1ccc(cn1)I 2e02a5135dc47f4a8c5e7e16cc26ca39 [0,1,0,0,0,0|1,0,2]=4 542 B12R1.1 C/C=C\COc1ccc(cn1)C cbfe39afff902c5898825418b66c46ab [0,1,0,0,0,0|1,0,2]=4 543 B12R1.1 C/C=C\COc1ccc(cn1)Cl 689303a2349559827a9214c50a33b101 [0,1,0,0,0,0|1,0,2]=4 544 B12R1.1 C/C=C\COc1ccc(cn1)F 463fe8b16dfebe5ad89f48d468cf1f4e [0,1,0,0,0,0|1,0,2]=4 545 B12R1.1 C/C=C\COc1ccc(cn1)I 7a3a679cde9d61c2aaa44d790db6d16c [0,1,0,0,0,0|1,0,2]=4 546 B12R1.1 C=CCCNc1ccc(cn1)Br 6af7ce1f7203fd0f612e9ebaff4a84cc [0,1,0,0,0,0|1,0,2]=4 547 B12R1.1 C=CCCNc1ccc(cn1)C 8c87e029af816c8f55fbac9642499de9 [0,1,0,0,0,0|1,0,2]=4 548 B12R1.1 C=CCCNc1ccc(cn1)Cl ce4894ae04f9c4029897efac535a34eb [0,1,0,0,0,0|1,0,2]=4 549 B12R1.1 C=CCCNc1ccc(cn1)F 086a26f6823627aa4a75527423982405 [0,1,0,0,0,0|1,0,2]=4 550 B12R1.1 C=CCCNc1ccc(cn1)I d5293ec93206eb58c412e009291ad60b [0,1,0,0,0,0|1,0,2]=4 551 B12R1.1 C=CCCNc1ccc(cn1)O af380ccb8b0e758f1ab7a08dcd5e5067 [0,1,0,0,0,0|1,0,2]=4 552 B12R1.1 C=CCCNc1ccc(cn1)S 2d7a9021c28ffccee541973a09ff2fbe [0,1,0,0,0,0|1,0,2]=4 553 B12R1.1 C=CCCOc1ccc(cn1)C 928886244039ef61d887af30c0fb4597 [0,1,0,0,0,0|1,0,2]=4 554 B12R1.1 C=CCCOc1ccc(cn1)Cl 137a7d52a601eadca0fdc27a7fd8f525 [0,1,0,0,0,0|1,0,2]=4 555 B12R1.1 C=CCCOc1ccc(cn1)F 71baa0ec2daa24340ec455e6ff19c282 [0,1,0,0,0,0|1,0,2]=4 556 B12R1.1 C=CCCOc1ccc(cn1)I 5385a537dbf89040d52a1abba998f614 [0,1,0,0,0,0|1,0,2]=4 557 B12R1.1 C=CCNCc1ccc(cn1)Br 115565841e82c4a5e5bac42ff3766be9 [0,1,0,0,0,0|1,0,2]=4 558 B12R1.1 C=CCNCc1ccc(cn1)C 65167246ef1b1d8eb72c50225dbf298e [0,1,0,0,0,0|1,0,2]=4 559 B12R1.1 C=CCNCc1ccc(cn1)Cl 3f44fa94f4bc6dd100d200be59a00334 [0,1,0,0,0,0|1,0,2]=4 560 B12R1.1 C=CCNCc1ccc(cn1)F d0727d5e0ac4a1af092dc07544f26126 [0,1,0,0,0,0|1,0,2]=4 561 B12R1.1 C=CCOCc1ccc(cn1)Br ed88250a659c9eda92bc4a35fe50a79d [0,1,0,0,0,0|1,0,2]=4 562 B12R1.1 C=CCOCc1ccc(cn1)C fcbd7b318bc346fe8fd71a6afcd05ccf [0,1,0,0,0,0|1,0,2]=4 563 B12R1.1 C=CCOCc1ccc(cn1)Cl dc9e0cdfb3455f950399ad5ea4e56918 [0,1,0,0,0,0|1,0,2]=4 564 B12R1.1 C=CCOCc1ccc(cn1)F d0f33e5d8cab2aec878b78b6ab36301b [0,1,0,0,0,0|1,0,2]=4 565 B12R1.1 C=CCOCc1ccc(cn1)I 8c20e3c744c96e213e9bbbe66b53eb97 [0,1,0,0,0,0|1,0,2]=4 566 B12R1.1 CC=CCNc1ccc(cn1)C dd65c363f967e5ef45d0d4e7a621d43e [0,1,0,0,0,0|1,0,2]=4 567 B12R1.1 CC=CCNc1ccc(cn1)F 8de06f55f579506def209044d68e8bd5 [0,1,0,0,0,0|1,0,2]=4 568 B12R1.1 CC=CCNc1ccc(cn1)O ef39eec9a0111e10736457c1a092b696 [0,1,0,0,0,0|1,0,2]=4 569 B12R1.1 CC=CCNc1ccc(cn1)S 5cb07f8e265d1fcd93cf4c01af35ae44 [0,1,0,0,0,0|1,0,2]=4 570 B12R1.1 CCCCNc1c[nH]c(=S)cn1 1133b3203a4d04333d3dce974b0a7fde [0,1,0,0,0,0|2,0,0]=3 571 B12R1.1 CCCCNc1ccc(=O)[nH]c1 02a79ca1969806667926017962f8be99 [0,1,0,0,0,0|3,0,0]=4 572 B12R1.1 CCCCNc1ccc(cc1)Br e89341169cbc44b59d16faec024cd1cb [0,1,0,0,0,0|2,0,0]=3 573 B12R1.1 CCCCNc1ccc(cc1)C 0509e0e75b6937a8ea7e0f62aa8886c7 [0,1,0,0,0,0|2,0,0]=3 574 B12R1.1 CCCCNc1ccc(cc1)Cl 1775dd898ae9be4c4106930801b27a2f [0,1,0,0,0,0|2,0,0]=3 575 B12R1.1 CCCCNc1ccc(cc1)F 205012603421f378155c17b633b33114 [0,1,0,0,0,0|2,0,0]=3 576 B12R1.1 CCCCNc1ccc(cc1)I 92f4d6d08bf3c52ef14290fb1084639a [0,1,0,0,0,0|2,0,0]=3 577 B12R1.1 CCCCNc1ccc(cc1)S 74533acd090bd71f2b34f5065040b599 [0,1,0,0,0,0|2,0,0]=3 578 B12R1.1 CCCCNc1ccc(cn1)Br 2147d0487acab31419a643db0484fa62 [0,1,0,0,0,0|1,0,0]=2 579 B12R1.1 CCCCNc1ccc(cn1)C 998adba6fba82ff0970d6030353c7365 [0,1,0,0,0,0|1,0,0]=2 580 B12R1.1 CCCCNc1ccc(cn1)Cl 042111bb41580bf256eb9f12ba97b780 [0,1,0,0,0,0|1,0,0]=2 581 B12R1.1 CCCCNc1ccc(cn1)F 746733710bba02fd4d704c1e085b8b50 [0,1,0,0,0,0|1,0,0]=2 582 B12R1.1 CCCCNc1ccc(cn1)I 0047bdc6626e6145afb77fb61f2e6165 [0,1,0,0,0,0|1,0,0]=2 583 B12R1.1 CCCCNc1ccc(nc1)Br 03175bcde4b54162bbf246fba10395a8 [0,1,0,0,0,0|3,0,0]=4 584 B12R1.1 CCCCNc1ccc(nc1)C cfc8492ab8a121a11fbcba16a1747a17 [0,1,0,0,0,0|3,0,0]=4 585 B12R1.1 CCCCNc1ccc(nc1)Cl 571e53e10e8cb1d62f214726f101dfe1 [0,1,0,0,0,0|3,0,0]=4 586 B12R1.1 CCCCNc1ccc(nc1)F 0b3ebaf1b1b3f43bf02ddb3b8b9cba97 [0,1,0,0,0,0|3,0,0]=4 587 B12R1.1 CCCCNc1ccc(nc1)I 7c29fa746193ba14b69f78a98be6bb00 [0,1,0,0,0,0|3,0,0]=4 588 B12R1.1 CCCCNc1ccc(nn1)Br a9fff27580e3f9c250b070a9d2c0f643 [0,1,0,0,0,0|2,0,0]=3 589 B12R1.1 CCCCNc1ccc(nn1)C 819abe29a7c4500598eeef7c83e21a92 [0,1,0,0,0,0|2,0,0]=3 590 B12R1.1 CCCCNc1ccc(nn1)Cl c9222429e6cb0ff831e8f87dd11d9fdf [0,1,0,0,0,0|2,0,0]=3 591 B12R1.1 CCCCNc1ccc(nn1)F 150c24be939eed0ba44211f762e92e7a [0,1,0,0,0,0|2,0,0]=3 592 B12R1.1 CCCCNc1ccc(nn1)I b6b38c916f5f85c1b58c423a55b0726d [0,1,0,0,0,0|2,0,0]=3 593 B12R1.1 CCCCNc1cnc(cn1)Br 41fe0f7f31b11310e49c6dbdc8815dd4 [0,1,0,0,0,0|2,0,0]=3 594 B12R1.1 CCCCNc1cnc(cn1)C 663cb1c7a5d345d60d5955959a6543ae [0,1,0,0,0,0|2,0,0]=3 595 B12R1.1 CCCCNc1cnc(cn1)Cl deff7c8c7e3730185ab2e81190bbc78c [0,1,0,0,0,0|2,0,0]=3 596 B12R1.1 CCCCNc1cnc(cn1)I 4e7d3e0844167e9e530327b38ec40316 [0,1,0,0,0,0|2,0,0]=3 597 B12R1.1 CCCCNc1ncc(cn1)Br 833393a284c1213b7acec9dab263e214 [0,1,0,0,0,0|2,0,0]=3 598 B12R1.1 CCCCNc1ncc(cn1)C b03d44a2bfb33db118c05d33cb078f28 [0,1,0,0,0,0|2,0,0]=3 599 B12R1.1 CCCCNc1ncc(cn1)Cl 25dc60ea50f3ff63edc31b4f08a3ec28 [0,1,0,0,0,0|2,0,0]=3 600 B12R1.1 CCCCNc1ncc(cn1)F e8b9288b9f16f8f1d0d16594f64e7666 [0,1,0,0,0,0|2,0,0]=3 601 B12R1.1 CCCCNc1ncc(cn1)I 75e954aaf51a5a4150081b234c4cd3fb [0,1,0,0,0,0|2,0,0]=3 602 B12R1.1 CCCCNc1ncc(nn1)Br 515416aec00ccb75c89be0065e79aada [0,1,0,0,0,0|3,0,0]=4 603 B12R1.1 CCCCOc1ccc(cc1)Br 8eb0c018af7c0260ba3c2a30117b04a8 [0,1,0,0,0,0|2,0,0]=3 604 B12R1.1 CCCCOc1ccc(cc1)C 279c306997ac21401db621e075a1234e [0,1,0,0,0,0|2,0,0]=3 605 B12R1.1 CCCCOc1ccc(cc1)Cl 7d5544a2fd61c6804d0b5f9a5dcaff5e [0,1,0,0,0,0|2,0,0]=3 606 B12R1.1 CCCCOc1ccc(cc1)F 267efa67a22e96e8517f1d16b28b6cda [0,1,0,0,0,0|2,0,0]=3 607 B12R1.1 CCCCOc1ccc(cc1)I 576e978d44aba041bf60b2e8c0ca77dc [0,1,0,0,0,0|2,0,0]=3 608 B12R1.1 CCCCOc1ccc(cc1)S 32b0d10568509e9aba7b8b876a1dcd97 [0,1,0,0,0,0|2,0,0]=3 609 B12R1.1 CCCCOc1ccc(cn1)C 73f80a64d75c76f1625ecd7b6bf60afd [0,1,0,0,0,0|1,0,0]=2 610 B12R1.1 CCCCOc1ccc(cn1)Cl 2f3f36b0755b6968d932427b919a5191 [0,1,0,0,0,0|1,0,0]=2 611 B12R1.1 CCCCOc1ccc(cn1)F 714f99d2bf60a4e198c8d7fc7d3992d6 [0,1,0,0,0,0|1,0,0]=2 612 B12R1.1 CCCCOc1ccc(cn1)I 7a11f6fcbd5b72cfe1708e440ade4c11 [0,1,0,0,0,0|1,0,0]=2 613 B12R1.1 CCCCOc1ccc(nc1)Br edb7642f5597a5dbfa6d9f7163f9d53f [0,1,0,0,0,0|3,0,0]=4 614 B12R1.1 CCCCOc1ccc(nc1)C 4c062804bd5d363b81cb36e3fd4cfb06 [0,1,0,0,0,0|3,0,0]=4 615 B12R1.1 CCCCOc1ccc(nc1)Cl 0bc8dbabaffb09d392f3692c89f0a74d [0,1,0,0,0,0|3,0,0]=4 616 B12R1.1 CCCCOc1ccc(nc1)F 3a0976877ce97243ef82f159d6a097b4 [0,1,0,0,0,0|3,0,0]=4 617 B12R1.1 CCCCOc1ccc(nc1)I 8140092992cfe9c6902291788a1266f6 [0,1,0,0,0,0|3,0,0]=4 618 B12R1.1 CCCCOc1ccc(nn1)Br 25379e0e46fb781ebc35280e9f275b88 [0,1,0,0,0,0|2,0,0]=3 619 B12R1.1 CCCCOc1ccc(nn1)C 3a6df5dd384d7741ccac0f09303c9283 [0,1,0,0,0,0|2,0,0]=3 620 B12R1.1 CCCCOc1ccc(nn1)Cl 69a3577748fb4f9d7650779cec66c9f2 [0,1,0,0,0,0|2,0,0]=3 621 B12R1.1 CCCCOc1cnc(cn1)Br e6d979271a06f2918910f0256cc66d18 [0,1,0,0,0,0|2,0,0]=3 622 B12R1.1 CCCCOc1cnc(cn1)C b914438215cb663022695dcf37a28483 [0,1,0,0,0,0|2,0,0]=3 623 B12R1.1 CCCCOc1cnc(cn1)Cl d1125062e03d26363325a01d948de039 [0,1,0,0,0,0|2,0,0]=3 624 B12R1.1 CCCCOc1cnc(cn1)I 4b4dee80b48e86334558d52d60cb98b6 [0,1,0,0,0,0|2,0,0]=3 625 B12R1.1 CCCCOc1ncc(cn1)Br 3c493d1c03b8f664f2a415080795496a [0,1,0,0,0,0|2,0,0]=3 626 B12R1.1 CCCCOc1ncc(cn1)C b501cf9e5163e798de4cbe09406c7fb4 [0,1,0,0,0,0|2,0,0]=3 627 B12R1.1 CCCCOc1ncc(cn1)F 32d3d79ac4251c6a2504d95e55cbb131 [0,1,0,0,0,0|2,0,0]=3 628 B12R1.1 CCCCOc1ncc(cn1)I 85323eb500584ba7beb370182fe9f83c [0,1,0,0,0,0|2,0,0]=3 629 B12R1.1 CCCNCc1ccc(=O)[nH]c1 7538f417ad561b957ce036f792a167ba [0,1,0,0,0,0|3,0,0]=4 630 B12R1.1 CCCNCc1ccc(cc1)Br 6d7acb5c1d6eb4035cfecd636670ec88 [0,1,0,0,0,0|2,0,0]=3 631 B12R1.1 CCCNCc1ccc(cc1)C 821f67acfdb50b145a70c837e9673303 [0,1,0,0,0,0|2,0,0]=3 632 B12R1.1 CCCNCc1ccc(cc1)Cl a02313d9aa520f59216ac1ef5bf23381 [0,1,0,0,0,0|2,0,0]=3 633 B12R1.1 CCCNCc1ccc(cc1)F 788f6e4abed6506e1bd98834e24d71da [0,1,0,0,0,0|2,0,0]=3 634 B12R1.1 CCCNCc1ccc(cc1)I 25058b9c523bb9b3441cc38523ac0681 [0,1,0,0,0,0|2,0,0]=3 635 B12R1.1 CCCNCc1ccc(cn1)Br ce6bf34b40a640b4111b2e5163e26705 [0,1,0,0,0,0|1,0,0]=2 636 B12R1.1 CCCNCc1ccc(cn1)C 0859440e6ab41c7baa50b4dbb7bfaf38 [0,1,0,0,0,0|1,0,0]=2 637 B12R1.1 CCCNCc1ccc(cn1)Cl 518b2eeb37bf5f7f7618b8da0a2f2225 [0,1,0,0,0,0|1,0,0]=2 638 B12R1.1 CCCNCc1ccc(cn1)F 1bb258a69067a228981a13b7c8ffa600 [0,1,0,0,0,0|1,0,0]=2 639 B12R1.1 CCCNCc1ccc(nc1)Br 98a2a9f55c0e6a24dfd04ba8e737f4fe [0,1,0,0,0,0|3,0,0]=4 640 B12R1.1 CCCNCc1ccc(nc1)C 0861f89260ac0b04cea33d150d25c2c7 [0,1,0,0,0,0|3,0,0]=4 641 B12R1.1 CCCNCc1ccc(nc1)Cl 9f529880edca32193f0a62a30cf0afb2 [0,1,0,0,0,0|3,0,0]=4 642 B12R1.1 CCCNCc1ccc(nc1)F bd740dfa814b0679fc0c7f702414e823 [0,1,0,0,0,0|3,0,0]=4 643 B12R1.1 CCCNCc1ccc(nn1)C 32380c905b1ba0c05ca532f775e77c52 [0,1,0,0,0,0|2,0,0]=3 644 B12R1.1 CCCNCc1ccc(nn1)Cl b167ab00ee248e92eb6781b484eb4783 [0,1,0,0,0,0|2,0,0]=3 645 B12R1.1 CCCNCc1cnc(cn1)Br 44159f6a5f60fe761f3e9b1961525800 [0,1,0,0,0,0|2,0,0]=3 646 B12R1.1 CCCNCc1cnc(cn1)C af58452d9fb13e74f0a2e7c7a90b32d3 [0,1,0,0,0,0|2,0,0]=3 647 B12R1.1 CCCNCc1cnc(cn1)Cl ff8d756cf4012e0bb103793501aa29f1 [0,1,0,0,0,0|2,0,0]=3 648 B12R1.1 CCCNCc1ncc(cn1)Br e64a1e7bd3700662cf0dc04043701e6c [0,1,0,0,0,0|2,0,0]=3 649 B12R1.1 CCCNCc1ncc(cn1)C b7bb1fc7d6d5a78c8f9b0e783d380224 [0,1,0,0,0,0|2,0,0]=3 650 B12R1.1 CCCNCc1ncc(cn1)Cl bea56215ace7ba2db0d882a5896108f2 [0,1,0,0,0,0|2,0,0]=3 651 B12R1.1 CCCNCc1ncc(cn1)F 08da3b52ce3fbc090b01627f564b4076 [0,1,0,0,0,0|2,0,0]=3 652 B12R1.1 CCCOCc1cc[n+](cc1)[O-] b301fdbcacf119c101f8a1e22f942cbe [0,1,0,0,0,0|3,0,0]=4 653 B12R1.1 CCCOCc1ccc(cc1)Br 809153d8a160030943d450bde94926b3 [0,1,0,0,0,0|2,0,0]=3 654 B12R1.1 CCCOCc1ccc(cc1)C cdf710de7aab36c209d4f1e83badcc9f [0,1,0,0,0,0|2,0,0]=3 655 B12R1.1 CCCOCc1ccc(cc1)Cl 2e02717de8c7d8c7b558a4e515a34b08 [0,1,0,0,0,0|2,0,0]=3 656 B12R1.1 CCCOCc1ccc(cc1)F 0b046f7636661272767e3d62ac05dc4e [0,1,0,0,0,0|2,0,0]=3 657 B12R1.1 CCCOCc1ccc(cc1)I 93d3c433bb8fbd6d9bf77528cb7bdc86 [0,1,0,0,0,0|2,0,0]=3 658 B12R1.1 CCCOCc1ccc(cc1)S 430871fe1cf3c8f148963d62cce89de2 [0,1,0,0,0,0|2,0,0]=3 659 B12R1.1 CCCOCc1ccc(cn1)Br 49b2165de8bf470f908d401448c5b410 [0,1,0,0,0,0|1,0,0]=2 660 B12R1.1 CCCOCc1ccc(cn1)C ff405956dedef2634c60e1436e98f714 [0,1,0,0,0,0|1,0,0]=2 661 B12R1.1 CCCOCc1ccc(cn1)Cl 73222df82ad400a79f3ed27e070a7524 [0,1,0,0,0,0|1,0,0]=2 662 B12R1.1 CCCOCc1ccc(cn1)F 47efbedbe7a90cd69d4a967f412f2768 [0,1,0,0,0,0|1,0,0]=2 663 B12R1.1 CCCOCc1ccc(cn1)I 4983eead99cd391642e4ce62b61f7868 [0,1,0,0,0,0|1,0,0]=2 664 B12R1.1 CCCOCc1ccc(nc1)Br 5986c242d7c14820af1b46ea82277777 [0,1,0,0,0,0|3,0,0]=4 665 B12R1.1 CCCOCc1ccc(nc1)C 916d4ce8b149ccc705c0ba761cb705cc [0,1,0,0,0,0|3,0,0]=4 666 B12R1.1 CCCOCc1ccc(nc1)Cl 1a3c2f03dd347e64a0cd18252287212e [0,1,0,0,0,0|3,0,0]=4 667 B12R1.1 CCCOCc1ccc(nc1)F 924d4c24e4b904e8e6dc77785e7bf92a [0,1,0,0,0,0|3,0,0]=4 668 B12R1.1 CCCOCc1ccc(nn1)C ed25fade6d9775b87727b3b66a9b1147 [0,1,0,0,0,0|2,0,0]=3 669 B12R1.1 CCCOCc1ccc(nn1)Cl 07459d9f96943120393825313b4b491d [0,1,0,0,0,0|2,0,0]=3 670 B12R1.1 CCCOCc1cnc(cn1)Br 15d1cc85d7b1e4c499ce76b7773d9b75 [0,1,0,0,0,0|2,0,0]=3 671 B12R1.1 CCCOCc1cnc(cn1)C f35ebf995d2b9b5605a85e56ee7478a7 [0,1,0,0,0,0|2,0,0]=3 672 B12R1.1 CCCOCc1cnc(cn1)Cl 2ccb3bf6c458ac075190b0165e6b4765 [0,1,0,0,0,0|2,0,0]=3 673 B12R1.1 CCCOCc1ncc(cn1)Br fd7e60f3edb6251184753d6a4d7b1190 [0,1,0,0,0,0|2,0,0]=3 674 B12R1.1 CCCOCc1ncc(cn1)C fca8a1c0832cf6e5074bf95483cf47b5 [0,1,0,0,0,0|2,0,0]=3 675 B12R1.1 CCCOCc1ncc(cn1)Cl 488a6accf484cfa86a80b334166a8acb [0,1,0,0,0,0|2,0,0]=3 676 B12R1.1 CCCOCc1ncc(cn1)F 41f441b88a0408aae8c7d281a9c83614 [0,1,0,0,0,0|2,0,0]=3 677 B12R1.1 CCNCCc1ccc(cc1)Br c1e1856c8e561693e17b3fba9688bb01 [0,1,0,0,0,0|2,0,0]=3 678 B12R1.1 CCNCCc1ccc(cc1)C 9668e7887400d136ec1e3eb391085876 [0,1,0,0,0,0|2,0,0]=3 679 B12R1.1 CCNCCc1ccc(cc1)Cl 8e5264010838622c7519fd0dcde4d0b4 [0,1,0,0,0,0|2,0,0]=3 680 B12R1.1 CCNCCc1ccc(cc1)F 1a1f9ac0f1e5162cebd8c21d993978c3 [0,1,0,0,0,0|2,0,0]=3 681 B12R1.1 CCNCCc1ccc(cc1)I a943177ded045228b7557ed18509fc40 [0,1,0,0,0,0|2,0,0]=3 682 B12R1.1 CCNCCc1ccc(cn1)Br 071a48b22deb6b821a1caa4a94f022f3 [0,1,0,0,0,0|1,0,0]=2 683 B12R1.1 CCNCCc1ccc(nc1)Br 40501d04b290bcc6bd2ecdbd3d864206 [0,1,0,0,0,0|3,0,0]=4 684 B12R1.1 CCNCCc1ccc(nc1)C da0b9278676dd0fba6c61fc0ed22f989 [0,1,0,0,0,0|3,0,0]=4 685 B12R1.1 CCNCCc1ccc(nc1)Cl 0cc577b224a2d134852779de1dd40420 [0,1,0,0,0,0|3,0,0]=4 686 B12R1.1 CCOCCc1ccc(cc1)Br 373b968b1c2796bb8ccc0d6636f1b3d3 [0,1,0,0,0,0|2,0,0]=3 687 B12R1.1 CCOCCc1ccc(cc1)C 42e633922cb44e7ff341e38a29688961 [0,1,0,0,0,0|2,0,0]=3 688 B12R1.1 CCOCCc1ccc(cc1)Cl 724e191c5f6d1be9c5d9a12f103488fa [0,1,0,0,0,0|2,0,0]=3 689 B12R1.1 CCOCCc1ccc(cc1)F fd874c97516f9d501a7a7d365142f992 [0,1,0,0,0,0|2,0,0]=3 690 B12R1.1 CCOCCc1ccc(cc1)I e2ec89c0bf90f2dda962bfa898555cdd [0,1,0,0,0,0|2,0,0]=3 691 B12R1.1 CCOCCc1ccc(cn1)Br 4da8f1abec1823983ba9123c240ed526 [0,1,0,0,0,0|1,0,0]=2 692 B12R1.1 CCOCCc1ccc(cn1)C f8bfa9a6b9c5cf25e679ebe20d4c34d1 [0,1,0,0,0,0|1,0,0]=2 693 B12R1.1 CCOCCc1ccc(cn1)F 3104047a4d03b030dadc14553fe02c80 [0,1,0,0,0,0|1,0,0]=2 694 B12R1.1 CCOCCc1ccc(nc1)Br 77c550d44806648781a348047e80994f [0,1,0,0,0,0|3,0,0]=4 695 B12R1.1 CCOCCc1ccc(nc1)C d2cbfdfb1b149499f3a63e1ec7ca2e87 [0,1,0,0,0,0|3,0,0]=4 696 B12R1.1 CCOCCc1ccc(nc1)Cl cc1500b445b266c7e229a33c575d1f83 [0,1,0,0,0,0|3,0,0]=4 697 B12R1.1 CCOCCc1ccc(nc1)F 21d533bb352b69aa08b705a9a98802c5 [0,1,0,0,0,0|3,0,0]=4 698 B12R1.1 CCOCCc1ncc(cn1)Br b41735d6bdaa47066712f76e8c99df06 [0,1,0,0,0,0|2,0,0]=3 699 B12R1.1 CCOCNc1ccc(cc1)Br 4ee5ca282eba946fa39404fb9f2e2f49 [0,1,0,0,0,0|3,0,0]=4 700 B12R1.1 CCOCNc1ccc(cc1)C 40728cee7584de662c92ec4d4f9f2bce [0,1,0,0,0,0|3,0,0]=4 701 B12R1.1 CCOCNc1ccc(cc1)Cl d0dbb68cddbf57bccc516d9c4f88982a [0,1,0,0,0,0|3,0,0]=4 702 B12R1.1 CCOCNc1ccc(cc1)F 6741493e952a075c24d7387b1a13f85c [0,1,0,0,0,0|3,0,0]=4 703 B12R1.1 CCOCNc1ccc(cc1)I 98926b4f8768901e7cec2d6a87d3ecb7 [0,1,0,0,0,0|3,0,0]=4 704 B12R1.1 CCOCNc1ccc(cc1)S cebbce0e1e667215a01e85034183120b [0,1,0,0,0,0|3,0,0]=4 705 B12R1.1 CCOCNc1ccc(cn1)C f5772f37de2a2ea2043bf8a4113a58e4 [0,1,0,0,0,0|2,0,0]=3 706 B12R1.1 CCOCNc1ccc(cn1)I 83da325f98e749e3d9037a936828200c [0,1,0,0,0,0|2,0,0]=3 707 B12R1.1 CCOCNc1ccc(nn1)Br d9ef792777e72eff3b9ffe1c27feeec7 [0,1,0,0,0,0|3,0,0]=4 708 B12R1.1 CCOCNc1ccc(nn1)F 82c6b0866288989073927be3beb81f51 [0,1,0,0,0,0|3,0,0]=4 709 B12R1.1 CCOCNc1ncc(cn1)F 05ce708db9dfbcbe05b531e28a33c213 [0,1,0,0,0,0|3,0,0]=4 710 B12R1.1 CCOCNc1ncc(cn1)I a686339d565c2180c49dc8b0ed6a5c01 [0,1,0,0,0,0|3,0,0]=4 711 B12R1.1 CCOCOc1ccc(cc1)C 7ff79dea53674124be82709c4597b73f [0,1,0,0,0,0|3,0,0]=4 712 B12R1.1 CCOCOc1ccc(cc1)F 50357452ef2cbab5421b2c59afb55a46 [0,1,0,0,0,0|3,0,0]=4 713 B12R1.1 CCOCOc1ccc(cc1)I a2fff1ccbab39ecbcb6c924c73f9242f [0,1,0,0,0,0|3,0,0]=4 714 B12R1.1 CCOCOc1ccc(nn1)Br 03cc74a893fe904c279efb233d5474ac [0,1,0,0,0,0|3,0,0]=4 715 B12R1.1 CCOCOc1ccc(nn1)C 3118cde8430d661cdc71e4c8c5594308 [0,1,0,0,0,0|3,0,0]=4 716 B12R1.1 CCOCOc1ccc(nn1)Cl d42f653dea3f7f81e4c2b87d264ec3d6 [0,1,0,0,0,0|3,0,0]=4 717 B12R1.1 CCOCOc1cnc(cn1)Cl c24180da057cee4b3f3e622bc5a9a394 [0,1,0,0,0,0|3,0,0]=4 718 B12R1.1 CCOCOc1cnc(cn1)I 4d4ac1d62a111e86773f5b6f887ec132 [0,1,0,0,0,0|3,0,0]=4 719 B12R1.1 CCOCOc1ncc(cn1)Br 36db0fec050e18e3df738aa9c1cc886d [0,1,0,0,0,0|3,0,0]=4 720 B12R1.1 CCOCOc1ncc(cn1)C 7f1e28fb765c2c932898945123f9d6f0 [0,1,0,0,0,0|3,0,0]=4 721 B12R1.1 CCOCOc1ncc(cn1)F 8a93eac1cca233a38af96bd6d34a10e7 [0,1,0,0,0,0|3,0,0]=4 722 B12R1.1 CCOCOc1ncc(cn1)I a3f5fa80de9e5935ffa7a52e19341ba9 [0,1,0,0,0,0|3,0,0]=4 723 B12R1.1 COCCNc1c[nH]c(=S)cn1 34785b721ff2231183888f83e0ed652d [0,1,0,0,0,0|3,0,0]=4 724 B12R1.1 COCCNc1ccc(cc1)Br 2d926fbb1fcdd16bacc6f211d0fcfb4e [0,1,0,0,0,0|3,0,0]=4 725 B12R1.1 COCCNc1ccc(cc1)C 74fbcfec57bd0edf1bc5b11b7509662c [0,1,0,0,0,0|3,0,0]=4 726 B12R1.1 COCCNc1ccc(cc1)Cl af73116263228e2b54dd7e7b16a6a3a1 [0,1,0,0,0,0|3,0,0]=4 727 B12R1.1 COCCNc1ccc(cc1)F a4e8c5020277e3ea67e453e11663517f [0,1,0,0,0,0|3,0,0]=4 728 B12R1.1 COCCNc1ccc(cc1)I 043a7b95c30b748da12a71766d6e5d51 [0,1,0,0,0,0|3,0,0]=4 729 B12R1.1 COCCNc1ccc(cc1)O df6722b40212b9f51eec6a88b45d31aa [0,1,0,0,0,0|3,0,0]=4 730 B12R1.1 COCCNc1ccc(cc1)S 5c0c330b3d01b6a4f1cb1b35b6bc670a [0,1,0,0,0,0|3,0,0]=4 731 B12R1.1 COCCNc1ccc(cn1)Br deaba88b45a644de34ea2cfea007e007 [0,1,0,0,0,0|2,0,0]=3 732 B12R1.1 COCCNc1ccc(cn1)C 007698baeb5f195743191a9f71971722 [0,1,0,0,0,0|2,0,0]=3 733 B12R1.1 COCCNc1ccc(cn1)Cl c3ac47963e38142d5204c0bfeb95e232 [0,1,0,0,0,0|2,0,0]=3 734 B12R1.1 COCCNc1ccc(cn1)F f762f45dc64dea0ba1842fef1445e94e [0,1,0,0,0,0|2,0,0]=3 735 B12R1.1 COCCNc1ccc(cn1)I 54360701a034983285b4ecfc45d90891 [0,1,0,0,0,0|2,0,0]=3 736 B12R1.1 COCCNc1ccc(cn1)O bd0ec413fe2f63d0c0ec77cd40a01221 [0,1,0,0,0,0|2,0,0]=3 737 B12R1.1 COCCNc1ccc(cn1)S 57bcb276d04bcf19a32b8db4540c7c69 [0,1,0,0,0,0|2,0,0]=3 738 B12R1.1 COCCNc1ccc(nn1)Br 94f463f5ed2990afcc836b9c259a7924 [0,1,0,0,0,0|3,0,0]=4 739 B12R1.1 COCCNc1ccc(nn1)C 9db904ee912e73c22c11afe9285f79ac [0,1,0,0,0,0|3,0,0]=4 740 B12R1.1 COCCNc1ccc(nn1)Cl 01c2c721814cc30fc15735e751d1e38e [0,1,0,0,0,0|3,0,0]=4 741 B12R1.1 COCCNc1ccc(nn1)F b1c9c05533bb8dd2c376c1f77ad915e5 [0,1,0,0,0,0|3,0,0]=4 742 B12R1.1 COCCNc1ccc(nn1)I 0f2de95a7a678ceab59a5771626bda5a [0,1,0,0,0,0|3,0,0]=4 743 B12R1.1 COCCNc1ccc(nn1)O 3cfacd130096811576171f6d12884a3d [0,1,0,0,0,0|3,0,0]=4 744 B12R1.1 COCCNc1ccc(nn1)S e3f18aa8697b0f538813615921bb7468 [0,1,0,0,0,0|3,0,0]=4 745 B12R1.1 COCCNc1cnc(cn1)Br 111c0888ab3e9a9d58c57d0cbb24b9c0 [0,1,0,0,0,0|3,0,0]=4 746 B12R1.1 COCCNc1cnc(cn1)C 7eb18b46848f3aa84be4334401e9e2f5 [0,1,0,0,0,0|3,0,0]=4 747 B12R1.1 COCCNc1cnc(cn1)Cl 1bec16033cfdc5aabf4ed80b8d251f53 [0,1,0,0,0,0|3,0,0]=4 748 B12R1.1 COCCNc1cnc(cn1)F 09e0703b145c367ffe5dd1e9d0769d02 [0,1,0,0,0,0|3,0,0]=4 749 B12R1.1 COCCNc1cnc(cn1)I 8460f2e5ed3d77c99a6aa3049fbfb733 [0,1,0,0,0,0|3,0,0]=4 750 B12R1.1 COCCNc1ncc(cn1)Br 1f570e179e8b5d7cf84a1673c9658abc [0,1,0,0,0,0|3,0,0]=4 751 B12R1.1 COCCNc1ncc(cn1)C d5a2d6676b8961e03ab7aeab75bdaf8e [0,1,0,0,0,0|3,0,0]=4 752 B12R1.1 COCCNc1ncc(cn1)Cl 093359052cee853f666d7484ae37650a [0,1,0,0,0,0|3,0,0]=4 753 B12R1.1 COCCNc1ncc(cn1)F 24482449be47cdeb429801d5dc53c2e7 [0,1,0,0,0,0|3,0,0]=4 754 B12R1.1 COCCNc1ncc(cn1)I 64594ca2803097170424dd94e7247585 [0,1,0,0,0,0|3,0,0]=4 755 B12R1.1 COCCOc1ccc(cc1)Br 59f81cc694fddf63dd9c397498a8f71c [0,1,0,0,0,0|3,0,0]=4 756 B12R1.1 COCCOc1ccc(cc1)C b1d5560e5a325a25c8f516e70c9b7dd3 [0,1,0,0,0,0|3,0,0]=4 757 B12R1.1 COCCOc1ccc(cc1)Cl aedf1b3f939e7afd0ecf936ea9af8427 [0,1,0,0,0,0|3,0,0]=4 758 B12R1.1 COCCOc1ccc(cc1)F 353ef53d5cd36cd30d3c5a3be3e143d2 [0,1,0,0,0,0|3,0,0]=4 759 B12R1.1 COCCOc1ccc(cc1)I 1af5a8e2ac91f91f1a45abad84e7a86b [0,1,0,0,0,0|3,0,0]=4 760 B12R1.1 COCCOc1ccc(cc1)S be18e0df09b470cb83227bd8e52a0281 [0,1,0,0,0,0|3,0,0]=4 761 B12R1.1 COCCOc1ccc(cn1)C 2cfd14c3999f5320927b336c794e493e [0,1,0,0,0,0|2,0,0]=3 762 B12R1.1 COCCOc1ccc(cn1)Cl 4b74273ee1f05769173febcc208cf94c [0,1,0,0,0,0|2,0,0]=3 763 B12R1.1 COCCOc1ccc(cn1)F b41abae1ad93fc2b2f8d2b0e97bab001 [0,1,0,0,0,0|2,0,0]=3 764 B12R1.1 COCCOc1ccc(cn1)I ba4f627d8af5acdf2b979abccf1809da [0,1,0,0,0,0|2,0,0]=3 765 B12R1.1 COCCOc1ccc(nn1)Br 9443bd99c59c47a12720a215eb3f4a4b [0,1,0,0,0,0|3,0,0]=4 766 B12R1.1 COCCOc1ccc(nn1)C bed956e7bebf4eb92533afa355cfa7d3 [0,1,0,0,0,0|3,0,0]=4 767 B12R1.1 COCCOc1ccc(nn1)Cl 78e8a4b0b5f1bb6b257a3cfc24440e55 [0,1,0,0,0,0|3,0,0]=4 768 B12R1.1 COCCOc1cnc(cn1)Br 0a27659687505238691c023021d655b7 [0,1,0,0,0,0|3,0,0]=4 769 B12R1.1 COCCOc1cnc(cn1)C a578dbc6742a7faea0c50f888cc8d721 [0,1,0,0,0,0|3,0,0]=4 770 B12R1.1 COCCOc1cnc(cn1)Cl c8dc2af3d8c2242303f1d81f07d52fd1 [0,1,0,0,0,0|3,0,0]=4 771 B12R1.1 COCCOc1cnc(cn1)I 409aaed4c75f8a543978f535c8b59b3c [0,1,0,0,0,0|3,0,0]=4 772 B12R1.1 COCCOc1ncc(cn1)Br be501de68c17976590a099799c9e58f4 [0,1,0,0,0,0|3,0,0]=4 773 B12R1.1 COCCOc1ncc(cn1)C 3a3efc4911bd7444ed9c45f30bb9b7c2 [0,1,0,0,0,0|3,0,0]=4 774 B12R1.1 COCCOc1ncc(cn1)F 4368cba2d7a0f49d60c947008e52cd0e [0,1,0,0,0,0|3,0,0]=4 775 B12R1.1 COCCOc1ncc(cn1)I 3378789fe27f687312eebfc227048341 [0,1,0,0,0,0|3,0,0]=4 776 B12R1.1 COCNCc1ccc(cc1)Br 2101c8ffb2742f9e20614ebc2902f4e9 [0,1,0,0,0,0|3,0,0]=4 777 B12R1.1 COCNCc1ccc(cc1)C 1ddbf711bb1fd8e5bb368c453428b7c3 [0,1,0,0,0,0|3,0,0]=4 778 B12R1.1 COCNCc1ccc(cc1)Cl 2d350432a72c42f08586f91f64cfeb55 [0,1,0,0,0,0|3,0,0]=4 779 B12R1.1 COCNCc1ccc(cc1)F 1c3d2fa163bb11a20df738f7c1f91179 [0,1,0,0,0,0|3,0,0]=4 780 B12R1.1 COCNCc1ccc(cc1)I 37d68c073753166fb2f5673ea356dd9f [0,1,0,0,0,0|3,0,0]=4 781 B12R1.1 COCNCc1ccc(cn1)Br eb4a5b86258c2c3116f7d5cf571588ec [0,1,0,0,0,0|2,0,0]=3 782 B12R1.1 COCNCc1ccc(cn1)C 33eab755a5d001639e66d07c6417c96e [0,1,0,0,0,0|2,0,0]=3 783 B12R1.1 COCNCc1ccc(cn1)Cl 0de3190092ada4c1cfea21fb494ae49f [0,1,0,0,0,0|2,0,0]=3 784 B12R1.1 COCNCc1ccc(cn1)F 414fd94fc5410186eaafb50870e732b4 [0,1,0,0,0,0|2,0,0]=3 785 B12R1.1 COCNCc1ccc(nn1)C fec57b78d30e77aa9af2e336bb520a55 [0,1,0,0,0,0|3,0,0]=4 786 B12R1.1 COCNCc1ccc(nn1)Cl ca520033f52b2ea702e653f58560728f [0,1,0,0,0,0|3,0,0]=4 787 B12R1.1 COCNCc1cnc(cn1)Br 8c4efb38b951e964a5b9b8810a5594f5 [0,1,0,0,0,0|3,0,0]=4 788 B12R1.1 COCNCc1cnc(cn1)C 81e84bc76b2ade70ed1ded71a6955653 [0,1,0,0,0,0|3,0,0]=4 789 B12R1.1 COCNCc1cnc(cn1)Cl 179e149d3a09b7b54f104929ed090ec9 [0,1,0,0,0,0|3,0,0]=4 790 B12R1.1 COCNCc1ncc(cn1)Br f39716d454c51d53b5097865d3cfb924 [0,1,0,0,0,0|3,0,0]=4 791 B12R1.1 COCNCc1ncc(cn1)C 56aa0d1f342c4d977b4c917b8f81f199 [0,1,0,0,0,0|3,0,0]=4 792 B12R1.1 COCNCc1ncc(cn1)Cl 136a402775046611a293ed1f98b62771 [0,1,0,0,0,0|3,0,0]=4 793 B12R1.1 COCNCc1ncc(cn1)F 196cecd178670275d2cd880f82c03734 [0,1,0,0,0,0|3,0,0]=4 794 B12R1.1 COCOCc1ccc(cc1)Br 428c0675138106422df59babd0a4742f [0,1,0,0,0,0|3,0,0]=4 795 B12R1.1 COCOCc1ccc(cc1)C 193aa9ab931a6a24231e20923141b26a [0,1,0,0,0,0|3,0,0]=4 796 B12R1.1 COCOCc1ccc(cc1)Cl 8d1220ebec17a1d5ad87d7ecbe17ddba [0,1,0,0,0,0|3,0,0]=4 797 B12R1.1 COCOCc1ccc(cc1)F 837a7f154b9d2ab539edcef32fc8cbf5 [0,1,0,0,0,0|3,0,0]=4 798 B12R1.1 COCOCc1ccc(cc1)I d3b117bbf06fbd5bf254ea112ff039c6 [0,1,0,0,0,0|3,0,0]=4 799 B12R1.1 COCOCc1ccc(cc1)S fff07ccf7efce07c78db73dc16d32001 [0,1,0,0,0,0|3,0,0]=4 800 B12R1.1 COCOCc1ccc(cn1)Br 5ba023b8a8ffd631584ce6b06f5f8da6 [0,1,0,0,0,0|2,0,0]=3 801 B12R1.1 COCOCc1ccc(cn1)C ff676d411c527e57b34dd5d8979cdb04 [0,1,0,0,0,0|2,0,0]=3 802 B12R1.1 COCOCc1ccc(cn1)Cl d33e1130f1bc4798404db81ef9589c56 [0,1,0,0,0,0|2,0,0]=3 803 B12R1.1 COCOCc1ccc(cn1)F da9e7d0f7b824c6250f1fa01987f41fa [0,1,0,0,0,0|2,0,0]=3 804 B12R1.1 COCOCc1ccc(cn1)I 4ad87f486e6db41b8fe45a5bb7e8e090 [0,1,0,0,0,0|2,0,0]=3 805 B12R1.1 COCOCc1ccc(nn1)C 506e61954b860d47cbb3d8f8ea07a26d [0,1,0,0,0,0|3,0,0]=4 806 B12R1.1 COCOCc1ccc(nn1)Cl 79c7c53020a23d7b9a35f99bf0251ddb [0,1,0,0,0,0|3,0,0]=4 807 B12R1.1 COCOCc1cnc(cn1)Br fc35590e92e9da1d9e6c76e7e3b672a6 [0,1,0,0,0,0|3,0,0]=4 808 B12R1.1 COCOCc1cnc(cn1)C e83d2da28eed3e4c1e0c2770156ee9f0 [0,1,0,0,0,0|3,0,0]=4 809 B12R1.1 COCOCc1cnc(cn1)Cl 2b68c2cca15a6925138a23ad2a02ae16 [0,1,0,0,0,0|3,0,0]=4 810 B12R1.1 COCOCc1ncc(cn1)Br e930119ed36541cae5c91c99a6790aaa [0,1,0,0,0,0|3,0,0]=4 811 B12R1.1 COCOCc1ncc(cn1)C 661563b9a8784a567fe4cccbee191f45 [0,1,0,0,0,0|3,0,0]=4 812 B12R1.1 COCOCc1ncc(cn1)Cl eaf798c8d4c809ab2b64a31a860c4bdf [0,1,0,0,0,0|3,0,0]=4 813 B12R1.1 COCOCc1ncc(cn1)F c8beb739ecdfd1f25e3237802a8fbbd8 [0,1,0,0,0,0|3,0,0]=4 814 B12R1.1 CSCCNc1ccc(cc1)Br 8ab0677987b0eea2f7ca5e75fb396aff [0,1,0,0,0,0|3,0,0]=4 815 B12R1.1 CSCCNc1ccc(cc1)C 310ae1408eff8b26413c520510ae11cf [0,1,0,0,0,0|3,0,0]=4 816 B12R1.1 CSCCNc1ccc(cc1)Cl 4f204a2d9fd4023e1a5daab1a4b97091 [0,1,0,0,0,0|3,0,0]=4 817 B12R1.1 CSCCNc1ccc(cc1)F 28f70803d3770470a142bfaa1613d9e1 [0,1,0,0,0,0|3,0,0]=4 818 B12R1.1 CSCCNc1ccc(cc1)I 6aefca79dea20870dc631870bac7bc12 [0,1,0,0,0,0|3,0,0]=4 819 B12R1.1 CSCCNc1ccc(cc1)S 23d5e26bcf03f49e0545130793e63a46 [0,1,0,0,0,0|3,0,0]=4 820 B12R1.1 CSCCNc1ccc(cn1)Br 9297cb49290c0d777c151a347665d807 [0,1,0,0,0,0|2,0,0]=3 821 B12R1.1 CSCCNc1ccc(cn1)C c920f84822cda5a81ab400730a4f716e [0,1,0,0,0,0|2,0,0]=3 822 B12R1.1 CSCCNc1ccc(cn1)Cl 53a1f58cb26cbaa401ebbe18f45d7192 [0,1,0,0,0,0|2,0,0]=3 823 B12R1.1 CSCCNc1ccc(cn1)F 0b315319f184871f5b6d9e18e418dd6a [0,1,0,0,0,0|2,0,0]=3 824 B12R1.1 CSCCNc1ccc(cn1)I 22052232a7766d5d81c3093544cf6a06 [0,1,0,0,0,0|2,0,0]=3 825 B12R1.1 CSCCNc1ccc(nn1)Br b7f9e4cc6d7affcb72067f41f8e10ab7 [0,1,0,0,0,0|3,0,0]=4 826 B12R1.1 CSCCNc1ccc(nn1)C c2865ec2b95ad63d1e01d137451d5b8d [0,1,0,0,0,0|3,0,0]=4 827 B12R1.1 CSCCNc1ccc(nn1)Cl e179ff9294bc7dcaef0497c020ed61b6 [0,1,0,0,0,0|3,0,0]=4 828 B12R1.1 CSCCNc1ccc(nn1)F d04ccb86aadf5a76f8610bb983e289c4 [0,1,0,0,0,0|3,0,0]=4 829 B12R1.1 CSCCNc1ccc(nn1)I 8f8e193ce634d5591a02771b0e0d8887 [0,1,0,0,0,0|3,0,0]=4 830 B12R1.1 CSCCNc1cnc(cn1)Br d81aa2aabbe747a0d0df1dd9edba6e93 [0,1,0,0,0,0|3,0,0]=4 831 B12R1.1 CSCCNc1cnc(cn1)C eeec8f83ea1409b682bdac32512b3af5 [0,1,0,0,0,0|3,0,0]=4 832 B12R1.1 CSCCNc1cnc(cn1)Cl f272168bc771fc68d025cb3cb51a2c32 [0,1,0,0,0,0|3,0,0]=4 833 B12R1.1 CSCCNc1cnc(cn1)I 4fdc0f8d40dbc52e750fcdda5cad9761 [0,1,0,0,0,0|3,0,0]=4 834 B12R1.1 CSCCNc1ncc(cn1)Br 8fb9aacf205bd47480eb9969dc4a6c87 [0,1,0,0,0,0|3,0,0]=4 835 B12R1.1 CSCCNc1ncc(cn1)C 8b7055bd39d701cba426f06cf89bd3a4 [0,1,0,0,0,0|3,0,0]=4 836 B12R1.1 CSCCNc1ncc(cn1)Cl e1e88271a40a6e22cd687670b97f0c39 [0,1,0,0,0,0|3,0,0]=4 837 B12R1.1 CSCCNc1ncc(cn1)F 3147b94cfec859d5595163887ba43a51 [0,1,0,0,0,0|3,0,0]=4 838 B12R1.1 CSCCNc1ncc(cn1)I 0dd837170dee6f9d7494699765fcbe09 [0,1,0,0,0,0|3,0,0]=4 839 B12R1.1 CSCCOc1ccc(cc1)Br c234e90f741991c47604f539f2d99f42 [0,1,0,0,0,0|3,0,0]=4 840 B12R1.1 CSCCOc1ccc(cc1)C 24a3be47a5236d6fcfdb3dd31ef924e1 [0,1,0,0,0,0|3,0,0]=4 841 B12R1.1 CSCCOc1ccc(cc1)Cl 198ed529c59d9f64135f4216da3c0c09 [0,1,0,0,0,0|3,0,0]=4 842 B12R1.1 CSCCOc1ccc(cc1)F fefa248d3af27dfc611f32de34246b14 [0,1,0,0,0,0|3,0,0]=4 843 B12R1.1 CSCCOc1ccc(cc1)I 7e7eedf216c574333f818acb7f46b313 [0,1,0,0,0,0|3,0,0]=4 844 B12R1.1 CSCCOc1ccc(cc1)S 1f2c0987d2a08e98131fab5ab97aece6 [0,1,0,0,0,0|3,0,0]=4 845 B12R1.1 CSCCOc1ccc(cn1)C f38a553ea061c70bde8c7ea2bd5eb464 [0,1,0,0,0,0|2,0,0]=3 846 B12R1.1 CSCCOc1ccc(cn1)Cl 6c38c88f57811a01ba287e33cc0797d3 [0,1,0,0,0,0|2,0,0]=3 847 B12R1.1 CSCCOc1ccc(cn1)F b12ea9cb4b04080e725dda6c3dded86e [0,1,0,0,0,0|2,0,0]=3 848 B12R1.1 CSCCOc1ccc(cn1)I 414a8d4e020159230d9442c2db17f0ed [0,1,0,0,0,0|2,0,0]=3 849 B12R1.1 CSCCOc1ccc(nn1)Br db1b16569c8ca4fefa4c9dfa75c7be3e [0,1,0,0,0,0|3,0,0]=4 850 B12R1.1 CSCCOc1ccc(nn1)C 7088b89d449bbee7fba7d2dc6d22df73 [0,1,0,0,0,0|3,0,0]=4 851 B12R1.1 CSCCOc1ccc(nn1)Cl be2e584c30b586d7d107d0c640effd94 [0,1,0,0,0,0|3,0,0]=4 852 B12R1.1 CSCCOc1cnc(cn1)Br 2f76d964b1c8bfc9a96f42ad679f0f20 [0,1,0,0,0,0|3,0,0]=4 853 B12R1.1 CSCCOc1cnc(cn1)C c9030d6360ca446de7d6f26e887cd764 [0,1,0,0,0,0|3,0,0]=4 854 B12R1.1 CSCCOc1cnc(cn1)Cl 694b121bb16a168fea59db3c82cd5a87 [0,1,0,0,0,0|3,0,0]=4 855 B12R1.1 CSCCOc1cnc(cn1)I 38e9f38f10f2a3cacfc656156e445941 [0,1,0,0,0,0|3,0,0]=4 856 B12R1.1 CSCCOc1ncc(cn1)Br 58101626adb00f7a5063f4603fcf1e50 [0,1,0,0,0,0|3,0,0]=4 857 B12R1.1 CSCCOc1ncc(cn1)C 238225e136f122c90dae2a99dd741c33 [0,1,0,0,0,0|3,0,0]=4 858 B12R1.1 CSCCOc1ncc(cn1)F 2ae75b79395344aa3426da736ffcae21 [0,1,0,0,0,0|3,0,0]=4 859 B12R1.1 CSCCOc1ncc(cn1)I 155d8f9a34b32660e9ebb853249bc215 [0,1,0,0,0,0|3,0,0]=4 860 B12R1.1 CSCNCc1ccc(cc1)Br 693801023c71ab41fb46dfde2783c840 [0,1,0,0,0,0|3,0,0]=4 861 B12R1.1 CSCNCc1ccc(cc1)C 9fc32bcf202f13dafa59ca6cad147642 [0,1,0,0,0,0|3,0,0]=4 862 B12R1.1 CSCNCc1ccc(cc1)Cl 0bfdbe8848ec3a5aff321142c87584b1 [0,1,0,0,0,0|3,0,0]=4 863 B12R1.1 CSCNCc1ccc(cc1)F c6129a00308c9d4832a29e22c5adc4b0 [0,1,0,0,0,0|3,0,0]=4 864 B12R1.1 CSCNCc1ccc(cc1)I b29bd17b4320cd66526146eb19c64d3d [0,1,0,0,0,0|3,0,0]=4 865 B12R1.1 CSCNCc1ccc(cn1)C 2526d339bf492358ab7424e0ac27e7c0 [0,1,0,0,0,0|2,0,0]=3 866 B12R1.1 CSCNCc1ccc(cn1)Cl efca04196fbe5126c26b656a71dc17eb [0,1,0,0,0,0|2,0,0]=3 867 B12R1.1 CSCNCc1ccc(cn1)F ca2916f6c07cf3ff7aa118ff8d12f35f [0,1,0,0,0,0|2,0,0]=3 868 B12R1.1 CSCNCc1ccc(nn1)C fc9cc8ef73ff930185c3c66efd0f2dcd [0,1,0,0,0,0|3,0,0]=4 869 B12R1.1 CSCNCc1ccc(nn1)Cl e8620467a6517fbd99647917fa744901 [0,1,0,0,0,0|3,0,0]=4 870 B12R1.1 CSCNCc1cnc(cn1)Cl b5d0c82f9df7c8d370ba374f6c032e42 [0,1,0,0,0,0|3,0,0]=4 871 B12R1.1 CSCNCc1ncc(cn1)Br b5899ad1d101eec6a6afa2373f02f5ed [0,1,0,0,0,0|3,0,0]=4 872 B12R1.1 CSCNCc1ncc(cn1)C 64c1efe6571566316c6c61fc19bda326 [0,1,0,0,0,0|3,0,0]=4 873 B12R1.1 CSCNCc1ncc(cn1)Cl a2352e2eaf254fef2e6f5b25d809b811 [0,1,0,0,0,0|3,0,0]=4 874 B12R1.1 CSCNCc1ncc(cn1)F 1877829b8faa40e1bbf148ce9e96b187 [0,1,0,0,0,0|3,0,0]=4 875 B12R1.1 CSCOCc1ccc(cc1)Br 04076c930c60c8026e8859d12af51795 [0,1,0,0,0,0|3,0,0]=4 876 B12R1.1 CSCOCc1ccc(cc1)C 8f292a47087d0909cd576163e4db1532 [0,1,0,0,0,0|3,0,0]=4 877 B12R1.1 CSCOCc1ccc(cc1)Cl 03e78d5cbe8215e8240c6356bb118866 [0,1,0,0,0,0|3,0,0]=4 878 B12R1.1 CSCOCc1ccc(cc1)F 2f1cad00f1363f49def9c4fdb797866b [0,1,0,0,0,0|3,0,0]=4 879 B12R1.1 CSCOCc1ccc(cc1)I 31f9b1d8cf943b9f6280d8a2c534b898 [0,1,0,0,0,0|3,0,0]=4 880 B12R1.1 CSCOCc1ccc(cc1)S fc2f705e251814c6788644bc46a6aca1 [0,1,0,0,0,0|3,0,0]=4 881 B12R1.1 CSCOCc1ccc(cn1)Br 7691a2ac9876054dccd283c60be52d5a [0,1,0,0,0,0|2,0,0]=3 882 B12R1.1 CSCOCc1ccc(cn1)C 1773de23779958289212fb11c198f5e3 [0,1,0,0,0,0|2,0,0]=3 883 B12R1.1 CSCOCc1ccc(cn1)Cl 5e4e2939a91f1fa42020a9c1c6944fd9 [0,1,0,0,0,0|2,0,0]=3 884 B12R1.1 CSCOCc1ccc(cn1)F b95159b84111d70642a2846b981cccef [0,1,0,0,0,0|2,0,0]=3 885 B12R1.1 CSCOCc1ccc(cn1)I c50d84c0b46eec93fec0896f14bb0ddd [0,1,0,0,0,0|2,0,0]=3 886 B12R1.1 CSCOCc1ccc(nn1)C 845e93027f97d5da29602928afa7a50a [0,1,0,0,0,0|3,0,0]=4 887 B12R1.1 CSCOCc1ccc(nn1)Cl e7b18ef28e0d7a3983230e49b1cb5f65 [0,1,0,0,0,0|3,0,0]=4 888 B12R1.1 CSCOCc1ncc(cn1)Br 3ef3407388e7c0b41c03758ba4b87993 [0,1,0,0,0,0|3,0,0]=4 889 B12R1.1 CSCOCc1ncc(cn1)C 11025643f763d9ae1fa8c27add0edd29 [0,1,0,0,0,0|3,0,0]=4 890 B12R1.1 CSCOCc1ncc(cn1)Cl 0a181292663f191db81dded025af3d6a [0,1,0,0,0,0|3,0,0]=4 891 B12R1.1 CSCOCc1ncc(cn1)F a253cea7bcbe62e945a357eac6733bb1 [0,1,0,0,0,0|3,0,0]=4 892 B12R1.1 Cc1ccc(cc1)CCNCF 55db78b5c6b65959b4c4a038e04170d2 [0,1,0,0,0,0|3,0,0]=4 893 B12R1.1 Cc1ccc(cc1)CCNCO 8265feb14c5c78ac0b9f16d74e5916ae [0,1,0,0,0,0|3,0,0]=4 894 B12R1.1 Cc1ccc(cc1)CCOCF 23e471ed521d6c702e5222c5224f343c [0,1,0,0,0,0|3,0,0]=4 895 B12R1.1 Cc1ccc(cc1)CNCCBr 2d8aaef5002dee05b5b0d139516346b7 [0,1,0,0,0,0|3,0,0]=4 896 B12R1.1 Cc1ccc(cc1)CNCCF 45de62b9a51bd1d0feae8b987f81bbf3 [0,1,0,0,0,0|3,0,0]=4 897 B12R1.1 Cc1ccc(cc1)CNCCI 0f947b3f245796fc1dcd52661dd84fa8 [0,1,0,0,0,0|3,0,0]=4 898 B12R1.1 Cc1ccc(cc1)CNCCO 47cbe1348c331b475579d0d8d51b73f3 [0,1,0,0,0,0|3,0,0]=4 899 B12R1.1 Cc1ccc(cc1)CNCCS f4f6d094efa9a75c2d676e4e1bf95e4c [0,1,0,0,0,0|3,0,0]=4 900 B12R1.1 Cc1ccc(cc1)COCCF 0d130b7ab7dcfaf08d1b5194bdc3e4e7 [0,1,0,0,0,0|3,0,0]=4 901 B12R1.1 Cc1ccc(cc1)COCCS fa0ba5736fc27a43635ffecb1320bef1 [0,1,0,0,0,0|3,0,0]=4 902 B12R1.1 Cc1ccc(cc1)NCCCCl 20a97402e32410da2dbcec2aa3bbe78c [0,1,0,0,0,0|3,0,0]=4 903 B12R1.1 Cc1ccc(cc1)NCCCF 851b4770ba02f29cfff9aabe778a437d [0,1,0,0,0,0|3,0,0]=4 904 B12R1.1 Cc1ccc(cc1)NCCCO 46aa73ad3705fe83d5925f133ae7c772 [0,1,0,0,0,0|3,0,0]=4 905 B12R1.1 Cc1ccc(cc1)NCCCS 72b037e31eb66dc652e81da4beb6cd18 [0,1,0,0,0,0|3,0,0]=4 906 B12R1.1 Cc1ccc(cc1)OCCCF feeaf145cc496d1fd07364d6aa7e43fc [0,1,0,0,0,0|3,0,0]=4 907 B12R1.1 Cc1ccc(cc1)OCCCS 29a5e3dab250bf0932d27e1725c97389 [0,1,0,0,0,0|3,0,0]=4 908 B12R1.1 Cc1ccc(nc1)CCOCF 7f2d0a874f431f6002914f87185517b3 [0,1,0,0,0,0|2,0,0]=3 909 B12R1.1 Cc1ccc(nc1)CNCC#N 020a95e81021de542bfb04dfe3609e44 [0,1,0,0,0,0|2,0,1]=4 910 B12R1.1 Cc1ccc(nc1)CNCC=O 8697fa1ec58054ca9a9415a1b09bc68a [0,1,0,0,0,0|2,0,1]=4 911 B12R1.1 Cc1ccc(nc1)CNCCBr 9ef3c7616019857ffa4c04299496e2ca [0,1,0,0,0,0|2,0,0]=3 912 B12R1.1 Cc1ccc(nc1)CNCCF e128dc68575cddda1073105faed583a2 [0,1,0,0,0,0|2,0,0]=3 913 B12R1.1 Cc1ccc(nc1)CNCCI 5773dfd5602931fe2be1cf658ae03d8c [0,1,0,0,0,0|2,0,0]=3 914 B12R1.1 Cc1ccc(nc1)CNCCO 18e78eee4d4949c8aa219cb631466434 [0,1,0,0,0,0|2,0,0]=3 915 B12R1.1 Cc1ccc(nc1)CNCCS 885f1e6417321fcaef68d3694ea5f250 [0,1,0,0,0,0|2,0,0]=3 916 B12R1.1 Cc1ccc(nc1)COCC#N b52c05fd17dbfea7f946cae47f2761bd [0,1,0,0,0,0|2,0,1]=4 917 B12R1.1 Cc1ccc(nc1)COCC=O f15cb67ad417ea66fcd45e31f47d008a [0,1,0,0,0,0|2,0,1]=4 918 B12R1.1 Cc1ccc(nc1)COCCF 25348f3da608e2f9245d055f4afb2254 [0,1,0,0,0,0|2,0,0]=3 919 B12R1.1 Cc1ccc(nc1)COCCS 08abd308e3949fb3c411d3bdaf65c1c8 [0,1,0,0,0,0|2,0,0]=3 920 B12R1.1 Cc1ccc(nc1)NCCC#N c959419f87bb00d88221239a496aa177 [0,1,0,0,0,0|2,0,1]=4 921 B12R1.1 Cc1ccc(nc1)NCCC=O 59254c1361a974ad356356798bed428b [0,1,0,0,0,0|2,0,1]=4 922 B12R1.1 Cc1ccc(nc1)NCCCCl dac1536a4d26c4abc51a57660fbc2f6a [0,1,0,0,0,0|2,0,0]=3 923 B12R1.1 Cc1ccc(nc1)NCCCF f3209b819e401104f4182f07d56000b4 [0,1,0,0,0,0|2,0,0]=3 924 B12R1.1 Cc1ccc(nc1)NCCCO 943c5edad96496dd2ca78f468c15c5da [0,1,0,0,0,0|2,0,0]=3 925 B12R1.1 Cc1ccc(nc1)NCCCS 7f1bb50b9c48357814e0c7ef4a440200 [0,1,0,0,0,0|2,0,0]=3 926 B12R1.1 Cc1ccc(nc1)NCCON 417657a818a5d60d713b77dea8ad331f [0,1,0,0,0,0|3,0,0]=4 927 B12R1.1 Cc1ccc(nc1)OCCC#N b71fa84d8c5ce157fa6b2b15f8637c7b [0,1,0,0,0,0|2,0,1]=4 928 B12R1.1 Cc1ccc(nc1)OCCC=O c93dc9ad09512cd6bd6790b07764bbde [0,1,0,0,0,0|2,0,1]=4 929 B12R1.1 Cc1ccc(nc1)OCCCF 8f97812529c422bfee9076081c1896dc [0,1,0,0,0,0|2,0,0]=3 930 B12R1.1 Cc1ccc(nc1)OCCCS a6c9ad0a5e6f7753c4b28479e9121884 [0,1,0,0,0,0|2,0,0]=3 931 B12R1.1 Cc1ccc(nn1)CNCCF 0e12a0e2ff72681162c856d415a66091 [0,1,0,0,0,0|3,0,0]=4 932 B12R1.1 Cc1ccc(nn1)CNCCO 4f1c169f55afafef17cc7104c5ecd55e [0,1,0,0,0,0|3,0,0]=4 933 B12R1.1 Cc1ccc(nn1)CNCCS b16ed4261f7a297698cca8a9f165d5d6 [0,1,0,0,0,0|3,0,0]=4 934 B12R1.1 Cc1ccc(nn1)COCCF 32c239c09c1520d1a56ced399e2cd246 [0,1,0,0,0,0|3,0,0]=4 935 B12R1.1 Cc1ccc(nn1)COCCS 675f06108a8ba214d14423c42bf42efe [0,1,0,0,0,0|3,0,0]=4 936 B12R1.1 Cc1ccc(nn1)NCCCCl e090a9139c1db26f003f66c8fed07b23 [0,1,0,0,0,0|3,0,0]=4 937 B12R1.1 Cc1ccc(nn1)NCCCF 7f88845286bb845f02c3f4da7132fe5b [0,1,0,0,0,0|3,0,0]=4 938 B12R1.1 Cc1ccc(nn1)NCCCO bf49a89ebbc3cda08b971331770a0d9f [0,1,0,0,0,0|3,0,0]=4 939 B12R1.1 Cc1ccc(nn1)NCCCS c0fbcdba84cdb5b0c36d3f5fedaf9073 [0,1,0,0,0,0|3,0,0]=4 940 B12R1.1 Cc1ccc(nn1)OCCCF 4220f6957d12a9923dfe17bd9bb5d392 [0,1,0,0,0,0|3,0,0]=4 941 B12R1.1 Cc1ccc(nn1)OCCCS b20271a467b0ac22fce7a06dec4f3607 [0,1,0,0,0,0|3,0,0]=4 942 B12R1.1 Cc1cnc(cn1)CNCCF 198e59cb74a1207511991f5bdccfb40f [0,1,0,0,0,0|3,0,0]=4 943 B12R1.1 Cc1cnc(cn1)CNCCO 040d0018cee6c0480fef9797a4a0b225 [0,1,0,0,0,0|3,0,0]=4 944 B12R1.1 Cc1cnc(cn1)CNCCS fd494d1c82d4272f1da880d735ff4a50 [0,1,0,0,0,0|3,0,0]=4 945 B12R1.1 Cc1cnc(cn1)COCCF 1bdd4950ce5ac544f5203afec3124908 [0,1,0,0,0,0|3,0,0]=4 946 B12R1.1 Cc1cnc(cn1)COCCS 993872a2c314e6fd2572eab99fea7bad [0,1,0,0,0,0|3,0,0]=4 947 B12R1.1 Cc1cnc(cn1)NCCCF 9a990592f629d464f2aecdb6a3c3085e [0,1,0,0,0,0|3,0,0]=4 948 B12R1.1 Cc1cnc(cn1)NCCCO 1c7c6ca89ae10d6667d1c4248c23e16b [0,1,0,0,0,0|3,0,0]=4 949 B12R1.1 Cc1cnc(cn1)NCCCS e007be7016fc89f5032489ecef3d93f5 [0,1,0,0,0,0|3,0,0]=4 950 B12R1.1 Cc1cnc(cn1)OCCCF 4d923c2fd1c2c611383eba896946b9a1 [0,1,0,0,0,0|3,0,0]=4 951 B12R1.1 Cc1cnc(cn1)OCCCS bf3623045ea810011c92005f0143799b [0,1,0,0,0,0|3,0,0]=4 952 B12R1.1 Cc1cnc(nc1)CNCCBr 19421542cfc9467a0c6017c53c517902 [0,1,0,0,0,0|3,0,0]=4 953 B12R1.1 Cc1cnc(nc1)CNCCF 8405b590436725763f9c5b0f5e38e370 [0,1,0,0,0,0|3,0,0]=4 954 B12R1.1 Cc1cnc(nc1)CNCCI b6af17ffd3a94709fe6927f5b996e6ee [0,1,0,0,0,0|3,0,0]=4 955 B12R1.1 Cc1cnc(nc1)CNCCO 103de006459b6b169063597a299c2107 [0,1,0,0,0,0|3,0,0]=4 956 B12R1.1 Cc1cnc(nc1)CNCCS c2218869b15ce2d7e8a1beb656d9caa5 [0,1,0,0,0,0|3,0,0]=4 957 B12R1.1 Cc1cnc(nc1)COCCF bbd259d9673bdc9b43ded1dffef8ccb4 [0,1,0,0,0,0|3,0,0]=4 958 B12R1.1 Cc1cnc(nc1)COCCS 1e0a300e7dae1ce2bafac493e697ddca [0,1,0,0,0,0|3,0,0]=4 959 B12R1.1 Cc1cnc(nc1)NCCCF c41616f73340a8fc511e9f3c2f835b34 [0,1,0,0,0,0|3,0,0]=4 960 B12R1.1 Cc1cnc(nc1)NCCCO 9fc8c4aa63c240282757cf67d6de7780 [0,1,0,0,0,0|3,0,0]=4 961 B12R1.1 Cc1cnc(nc1)NCCCS 540cace064cccc417d33d11d9d5ff804 [0,1,0,0,0,0|3,0,0]=4 962 B12R1.1 Cc1cnc(nc1)OCCCF 677899497f3e6449c8d9ef907efffcf0 [0,1,0,0,0,0|3,0,0]=4 963 B12R1.1 Cc1cnc(nc1)OCCCS 76fd7536ff5c3fa574394e41c668e6de [0,1,0,0,0,0|3,0,0]=4 964 B12R1.1 Clc1ccc(cc1)CNCCBr c65ca8fd38a5e054055efe4671ab857e [0,1,0,0,0,0|3,0,0]=4 965 B12R1.1 Clc1ccc(cc1)CNCCI 8c14ff739e3e87d5f74de98bc200ad53 [0,1,0,0,0,0|3,0,0]=4 966 B12R1.1 Clc1ccc(nc1)CNCCBr 98c9a459451c0dd316a5d9c2ab75e125 [0,1,0,0,0,0|2,0,0]=3 967 B12R1.1 Clc1ccc(nc1)CNCCI b54a2e7782ae7d80f0f49dedc20f86bc [0,1,0,0,0,0|2,0,0]=3 968 B12R1.1 Clc1cnc(nc1)CNCCBr 5eb459ec909dcd4eea8c374a0a548961 [0,1,0,0,0,0|3,0,0]=4 969 B12R1.1 Clc1cnc(nc1)CNCCI 3fbfe44828ceb319f43b5c1996858552 [0,1,0,0,0,0|3,0,0]=4 970 B12R1.1 FCCCNc1ccc(cc1)Br 2bb0b8b5de9be84e6aa954805b9bdc6f [0,1,0,0,0,0|3,0,0]=4 971 B12R1.1 FCCCNc1ccc(cc1)Cl 3bac999676431694f615544eac89e910 [0,1,0,0,0,0|3,0,0]=4 972 B12R1.1 FCCCNc1ccc(cc1)F 79d6de3a9c368c231cd818521f7ebf62 [0,1,0,0,0,0|3,0,0]=4 973 B12R1.1 FCCCNc1ccc(cc1)I 9c99a2b01242c00192aedbe231fc2bd2 [0,1,0,0,0,0|3,0,0]=4 974 B12R1.1 FCCCNc1ccc(cc1)S ad5b6b8a015045fcbbb030babf864b53 [0,1,0,0,0,0|3,0,0]=4 975 B12R1.1 FCCCNc1ccc(cn1)Br c2c5771f28891b911255f2f9c2c67e77 [0,1,0,0,0,0|2,0,0]=3 976 B12R1.1 FCCCNc1ccc(cn1)Cl 01831f630fc3a4fe81b08eea6a157ac7 [0,1,0,0,0,0|2,0,0]=3 977 B12R1.1 FCCCNc1ccc(cn1)F aff6d69a57a3c54e31eb7338c2332556 [0,1,0,0,0,0|2,0,0]=3 978 B12R1.1 FCCCNc1ccc(cn1)I 87e1de9d012faa35a96a7b709e7d0987 [0,1,0,0,0,0|2,0,0]=3 979 B12R1.1 FCCCNc1ccc(nn1)Br cd64856f50974c3789c1278762d86bb1 [0,1,0,0,0,0|3,0,0]=4 980 B12R1.1 FCCCNc1ccc(nn1)Cl 602951a39056a5ccb4056b24a7657ca1 [0,1,0,0,0,0|3,0,0]=4 981 B12R1.1 FCCCNc1ccc(nn1)F 13931d31f847125f5936031a3a29ac8f [0,1,0,0,0,0|3,0,0]=4 982 B12R1.1 FCCCNc1ccc(nn1)I a6ff635164701facf16a32beb1b1992c [0,1,0,0,0,0|3,0,0]=4 983 B12R1.1 FCCCNc1cnc(cn1)Br daec76b627d37402e2c3aecabe3c885c [0,1,0,0,0,0|3,0,0]=4 984 B12R1.1 FCCCNc1cnc(cn1)Cl af28ca47b9527ea65a249ecfc8fe82c8 [0,1,0,0,0,0|3,0,0]=4 985 B12R1.1 FCCCNc1cnc(cn1)I 56405b246f5a1037d2fbb0e95c64fa28 [0,1,0,0,0,0|3,0,0]=4 986 B12R1.1 FCCCNc1ncc(cn1)Br 3587721505ee3d1302190377d36826f3 [0,1,0,0,0,0|3,0,0]=4 987 B12R1.1 FCCCNc1ncc(cn1)Cl 6fe1622d0f6c7ea582464bf07de347e3 [0,1,0,0,0,0|3,0,0]=4 988 B12R1.1 FCCCNc1ncc(cn1)F e7fcfac710dc78ee1be5c24f71ce86cd [0,1,0,0,0,0|3,0,0]=4 989 B12R1.1 FCCCNc1ncc(cn1)I dfe669d3ab9251e4d9c47c68cc7a3d59 [0,1,0,0,0,0|3,0,0]=4 990 B12R1.1 FCCCOc1ccc(cc1)Br 475788e0200e75281ddc0e6025f8bdff [0,1,0,0,0,0|3,0,0]=4 991 B12R1.1 FCCCOc1ccc(cc1)Cl 139fdae034a870836c2920fee7b7b718 [0,1,0,0,0,0|3,0,0]=4 992 B12R1.1 FCCCOc1ccc(cc1)F 9be3c4201031cb2036b0bb1acb87a0c4 [0,1,0,0,0,0|3,0,0]=4 993 B12R1.1 FCCCOc1ccc(cc1)I 1fe701e7027f1edb027816d43c4777ec [0,1,0,0,0,0|3,0,0]=4 994 B12R1.1 FCCCOc1ccc(cc1)S bbb5166fd0fd5ed564b64a2107cb5fc0 [0,1,0,0,0,0|3,0,0]=4 995 B12R1.1 FCCCOc1ccc(cn1)Cl e170fd4c227b9d26bec44218539fbfa8 [0,1,0,0,0,0|2,0,0]=3 996 B12R1.1 FCCCOc1ccc(cn1)F 995886d997ccc0346446951a15a69a4c [0,1,0,0,0,0|2,0,0]=3 997 B12R1.1 FCCCOc1ccc(cn1)I 2234599caacbf4298b8fd11ca9739e2c [0,1,0,0,0,0|2,0,0]=3 998 B12R1.1 FCCCOc1ccc(nn1)Br 52f9198c9ae40189af4a3f0cbc4d7b35 [0,1,0,0,0,0|3,0,0]=4 999 B12R1.1 FCCCOc1ccc(nn1)Cl 7c912f636256c917942ee2ab751d6cd9 [0,1,0,0,0,0|3,0,0]=4 1000 B12R1.1 FCCCOc1cnc(cn1)Br 55c92bc1c5962db0df789b0cb793eb62 [0,1,0,0,0,0|3,0,0]=4 1001 B12R1.1 FCCCOc1cnc(cn1)Cl c03d01034f33306cff584164de8f930f [0,1,0,0,0,0|3,0,0]=4 1002 B12R1.1 FCCCOc1cnc(cn1)I 975f5ed32618ec857be05deb7925764f [0,1,0,0,0,0|3,0,0]=4 1003 B12R1.1 FCCCOc1ncc(cn1)Br ee7f841cbc3f00d34228fde5a72520b6 [0,1,0,0,0,0|3,0,0]=4 1004 B12R1.1 FCCCOc1ncc(cn1)F f2d4175269f491f12687e14bf1d5154b [0,1,0,0,0,0|3,0,0]=4 1005 B12R1.1 FCCCOc1ncc(cn1)I 5841c7d90a869fd955750ef10de769d7 [0,1,0,0,0,0|3,0,0]=4 1006 B12R1.1 FCCNCc1ccc(cc1)Br 65d8c489335e2e57798d1d4248bd2ae5 [0,1,0,0,0,0|3,0,0]=4 1007 B12R1.1 FCCNCc1ccc(cc1)Cl 55328c35608650689df7bcb63925e617 [0,1,0,0,0,0|3,0,0]=4 1008 B12R1.1 FCCNCc1ccc(cc1)F 3eacca31e9c8a1445938595857c2b92a [0,1,0,0,0,0|3,0,0]=4 1009 B12R1.1 FCCNCc1ccc(cc1)I d63e3036898d8ab0af6d516afab80e3f [0,1,0,0,0,0|3,0,0]=4 1010 B12R1.1 FCCNCc1ccc(cn1)Br fb84b64137995a24b2c9c2d6a8f3923e [0,1,0,0,0,0|2,0,0]=3 1011 B12R1.1 FCCNCc1ccc(cn1)Cl 9b6d6a203e6ca279d7df0a792ce76275 [0,1,0,0,0,0|2,0,0]=3 1012 B12R1.1 FCCNCc1ccc(cn1)F 81503aad91b1062ee658cc08c3505583 [0,1,0,0,0,0|2,0,0]=3 1013 B12R1.1 FCCNCc1ccc(nn1)Cl 48e61597b6fb5913e8310d5b8cc12d21 [0,1,0,0,0,0|3,0,0]=4 1014 B12R1.1 FCCNCc1cnc(cn1)Br bef9a9e076a157e598780e67a9fc9512 [0,1,0,0,0,0|3,0,0]=4 1015 B12R1.1 FCCNCc1cnc(cn1)Cl ce51070052562236a8ba6ac9755d403c [0,1,0,0,0,0|3,0,0]=4 1016 B12R1.1 FCCNCc1ncc(cn1)Br e976e7f1625f562ceb4d20ab6924e624 [0,1,0,0,0,0|3,0,0]=4 1017 B12R1.1 FCCNCc1ncc(cn1)Cl 8ee437a2a3240f925c335d340e855077 [0,1,0,0,0,0|3,0,0]=4 1018 B12R1.1 FCCNCc1ncc(cn1)F d5d311f31ad705e9d634aacd457b48fc [0,1,0,0,0,0|3,0,0]=4 1019 B12R1.1 FCCOCc1ccc(cc1)Br 92495eb32b3f433b2bab7c5380980e79 [0,1,0,0,0,0|3,0,0]=4 1020 B12R1.1 FCCOCc1ccc(cc1)Cl f2abd9f5353336c91b3534a565e7e4bc [0,1,0,0,0,0|3,0,0]=4 1021 B12R1.1 FCCOCc1ccc(cc1)F 14e4a988dfdb52dc5cdd6f42bb1b065c [0,1,0,0,0,0|3,0,0]=4 1022 B12R1.1 FCCOCc1ccc(cc1)I c4f71ecd033c4f8ae03483191d011e18 [0,1,0,0,0,0|3,0,0]=4 1023 B12R1.1 FCCOCc1ccc(cc1)S af1a831e53f70462c0b307028f23b689 [0,1,0,0,0,0|3,0,0]=4 1024 B12R1.1 FCCOCc1ccc(cn1)Br 8cde46053e8fadf08d03a1c582249848 [0,1,0,0,0,0|2,0,0]=3 1025 B12R1.1 FCCOCc1ccc(cn1)Cl 0d54c1a0837b335d003f13741e14b6db [0,1,0,0,0,0|2,0,0]=3 1026 B12R1.1 FCCOCc1ccc(cn1)F fe5f15e8f299f886b268011c4a761817 [0,1,0,0,0,0|2,0,0]=3 1027 B12R1.1 FCCOCc1ccc(cn1)I e59d69c3441e94bde0b5ba7ce2388849 [0,1,0,0,0,0|2,0,0]=3 1028 B12R1.1 FCCOCc1ccc(nn1)Cl 62cb125b01ae664126d1ce76f07dfac5 [0,1,0,0,0,0|3,0,0]=4 1029 B12R1.1 FCCOCc1cnc(cn1)Br 6191e6e72b6b467060cbc272727bac04 [0,1,0,0,0,0|3,0,0]=4 1030 B12R1.1 FCCOCc1cnc(cn1)Cl 6c4927999085b806af3b3af16e80bc20 [0,1,0,0,0,0|3,0,0]=4 1031 B12R1.1 FCCOCc1ncc(cn1)Br 0056ab10608af454e709e61db299e5f8 [0,1,0,0,0,0|3,0,0]=4 1032 B12R1.1 FCCOCc1ncc(cn1)Cl 07a0b23d28973b4395ffe9024fb88dc4 [0,1,0,0,0,0|3,0,0]=4 1033 B12R1.1 FCCOCc1ncc(cn1)F 3ac194eb88d34c80a5d2ecbc17a88757 [0,1,0,0,0,0|3,0,0]=4 1034 B12R1.1 FCNCCc1ccc(cc1)Br 8638beffc47a42ce959ab1c0805990f5 [0,1,0,0,0,0|3,0,0]=4 1035 B12R1.1 FCNCCc1ccc(cc1)Cl 70d590d4b56811c02c2e304f3cf87f38 [0,1,0,0,0,0|3,0,0]=4 1036 B12R1.1 FCNCCc1ccc(cc1)F c5cbf3f1d30444969ee6f1c3b2a29381 [0,1,0,0,0,0|3,0,0]=4 1037 B12R1.1 FCNCCc1ccc(cc1)I cc57343573354e520cfcdabf8150e29c [0,1,0,0,0,0|3,0,0]=4 1038 B12R1.1 FCOCCc1ccc(cc1)Br 3d5bf9390babc43444cfa414157b2f9a [0,1,0,0,0,0|3,0,0]=4 1039 B12R1.1 FCOCCc1ccc(cc1)Cl c19707c796ee492aada5636e67f70282 [0,1,0,0,0,0|3,0,0]=4 1040 B12R1.1 FCOCCc1ccc(cc1)F ccdf7834bb3ad7b62c366a300838c3f0 [0,1,0,0,0,0|3,0,0]=4 1041 B12R1.1 FCOCCc1ccc(cc1)I ac6c9e6f007389bdbaa2b46b1b627f52 [0,1,0,0,0,0|3,0,0]=4 1042 B12R1.1 FCOCCc1ccc(cn1)Br 87a383c5bca931871672fa4519a9dcee [0,1,0,0,0,0|2,0,0]=3 1043 B12R1.1 FCOCCc1ccc(cn1)F 50cfde45d8f1f3102e39e67c980e33c8 [0,1,0,0,0,0|2,0,0]=3 1044 B12R1.1 FCOCCc1ncc(cn1)Br 648630d7453469e5c5e54e9d076e720c [0,1,0,0,0,0|3,0,0]=4 1045 B12R1.1 Fc1ccc(cc1)CNCCBr 072eab35a0497e904436919e1fef6884 [0,1,0,0,0,0|3,0,0]=4 1046 B12R1.1 Fc1ccc(cc1)CNCCI 2873609fdbac0a9541e33e6ac7c1cb32 [0,1,0,0,0,0|3,0,0]=4 1047 B12R1.1 Fc1ccc(cc1)CNCCS 88ed63e95aaf218af2a93443072e06ef [0,1,0,0,0,0|3,0,0]=4 1048 B12R1.1 Fc1ccc(cc1)COCCS 86c8939ca17403844281e346ea792870 [0,1,0,0,0,0|3,0,0]=4 1049 B12R1.1 Fc1ccc(cc1)NCCCCl 9a2f2f4691174593f4155dfa4b67c91f [0,1,0,0,0,0|3,0,0]=4 1050 B12R1.1 Fc1ccc(cc1)NCCCS 7e053f391e122f52af50e8234f5dc2e0 [0,1,0,0,0,0|3,0,0]=4 1051 B12R1.1 Fc1ccc(cc1)OCCCS ae2c14497042619ab205edaf6d20d829 [0,1,0,0,0,0|3,0,0]=4 1052 B12R1.1 Fc1ccc(nc1)CNCCBr bef37b0ab360cbd9ab380c059ed56211 [0,1,0,0,0,0|2,0,0]=3 1053 B12R1.1 Fc1ccc(nc1)CNCCI 7e99eba8e51a0af5b68fde1f0e685999 [0,1,0,0,0,0|2,0,0]=3 1054 B12R1.1 Fc1ccc(nc1)CNCCS dc89db61e5fd88292467a871b70625c1 [0,1,0,0,0,0|2,0,0]=3 1055 B12R1.1 Fc1ccc(nc1)COCCS 2b6fc49dde03b616cdb76c160410a222 [0,1,0,0,0,0|2,0,0]=3 1056 B12R1.1 Fc1ccc(nc1)NCCCCl 5268c7dbed25c933beb54fa50d40dcd8 [0,1,0,0,0,0|2,0,0]=3 1057 B12R1.1 Fc1ccc(nc1)NCCCS c6ed71ef1e78a3b3cd292c35e4996e8e [0,1,0,0,0,0|2,0,0]=3 1058 B12R1.1 Fc1ccc(nc1)OCCCS aca8511ecc99507fd51ace6936ff8c09 [0,1,0,0,0,0|2,0,0]=3 1059 B12R1.1 Fc1ccc(nn1)NCCCCl 7b87fbbe44584b10310767975a13b155 [0,1,0,0,0,0|3,0,0]=4 1060 B12R1.1 Fc1ccc(nn1)NCCCS ac8361ce9b59894374d394ed8165b9f7 [0,1,0,0,0,0|3,0,0]=4 1061 B12R1.1 Fc1cnc(nc1)CNCCBr aea859afb26333bea7d1fdfb849069f5 [0,1,0,0,0,0|3,0,0]=4 1062 B12R1.1 Fc1cnc(nc1)CNCCI e341605cd8acab0c84461c7f91f0c360 [0,1,0,0,0,0|3,0,0]=4 1063 B12R1.1 Fc1cnc(nc1)CNCCS 9e531cc50e46afaee49c71c91773f833 [0,1,0,0,0,0|3,0,0]=4 1064 B12R1.1 Fc1cnc(nc1)COCCS 697bd330130c283a0acc3bc219204660 [0,1,0,0,0,0|3,0,0]=4 1065 B12R1.1 Fc1cnc(nc1)NCCCCl 5789c20e62b76d9813592cd0117f0253 [0,1,0,0,0,0|3,0,0]=4 1066 B12R1.1 Fc1cnc(nc1)NCCCS c1b9960ac55123b9d2a454a7fafec526 [0,1,0,0,0,0|3,0,0]=4 1067 B12R1.1 Fc1cnc(nc1)OCCCS febd32e0dc169ca3fe1bb3ffd3f7af7f [0,1,0,0,0,0|3,0,0]=4 1068 B12R1.1 ICCNCc1ccc(cc1)I 29f1572640797dc773f75c818257fe5a [0,1,0,0,0,0|3,0,0]=4 1069 B12R1.1 N#CCCNc1ccc(cn1)Br 4d039ee93bb0b1ac9adb2b2ae52c6293 [0,1,0,0,0,0|2,0,1]=4 1070 B12R1.1 N#CCCNc1ccc(cn1)Cl 022039cc1cc4e2fd0ac33c8c55eca300 [0,1,0,0,0,0|2,0,1]=4 1071 B12R1.1 N#CCCNc1ccc(cn1)F 4ab824e67815fcbaceb77550d80b0098 [0,1,0,0,0,0|2,0,1]=4 1072 B12R1.1 N#CCCNc1ccc(cn1)I b6ad921a6ed8a493b542bdb355dd0ae0 [0,1,0,0,0,0|2,0,1]=4 1073 B12R1.1 N#CCCOc1ccc(cn1)Cl 42bc84b9ce5e4941520c1d20fe1fe4cb [0,1,0,0,0,0|2,0,1]=4 1074 B12R1.1 N#CCCOc1ccc(cn1)F 20e895ec36a243e1d6fcd204aff392dd [0,1,0,0,0,0|2,0,1]=4 1075 B12R1.1 N#CCCOc1ccc(cn1)I beaf6205b57fe0d55eb699d8bf8f7708 [0,1,0,0,0,0|2,0,1]=4 1076 B12R1.1 N#CCNCc1ccc(cn1)Br 8835dd699f2bd05ad6a96c67b9c92373 [0,1,0,0,0,0|2,0,1]=4 1077 B12R1.1 N#CCNCc1ccc(cn1)Cl cf1b785439b59a9de1bb190e85a84c54 [0,1,0,0,0,0|2,0,1]=4 1078 B12R1.1 N#CCNCc1ccc(cn1)F 918cf150e206165009bc55ae882edd27 [0,1,0,0,0,0|2,0,1]=4 1079 B12R1.1 N#CCOCc1ccc(cn1)Br 2fd8bc67059248cc97de8e833f353f59 [0,1,0,0,0,0|2,0,1]=4 1080 B12R1.1 N#CCOCc1ccc(cn1)Cl 56d3360f8bc04d900087972fcdf63a25 [0,1,0,0,0,0|2,0,1]=4 1081 B12R1.1 N#CCOCc1ccc(cn1)F 9cef320348624e1741ecc029d1c89393 [0,1,0,0,0,0|2,0,1]=4 1082 B12R1.1 N#CCOCc1ccc(cn1)I 90d2cd4aa83c9392115fd03239489a69 [0,1,0,0,0,0|2,0,1]=4 1083 B12R1.1 NOCCNc1ccc(cn1)F d893ebed037d683885807ce6ec55ee2e [0,1,0,0,0,0|3,0,0]=4 1084 B12R1.1 NOCCNc1ccc(cn1)O b75be59848970717b1d60d245135ef5a [0,1,0,0,0,0|3,0,0]=4 1085 B12R1.1 NOCCNc1ccc(cn1)S 6ae7213432f972b499d21580f1252f7f [0,1,0,0,0,0|3,0,0]=4 1086 B12R1.1 O=CCCNc1ccc(cn1)Br 61556c261a4049f3e8c604c6f20c7c3a [0,1,0,0,0,0|2,0,1]=4 1087 B12R1.1 O=CCCNc1ccc(cn1)Cl c61b6ce6513271fe584a74cf0b1e47e7 [0,1,0,0,0,0|2,0,1]=4 1088 B12R1.1 O=CCCNc1ccc(cn1)F 4e2c3bc02501b520b1929404dc331e75 [0,1,0,0,0,0|2,0,1]=4 1089 B12R1.1 O=CCCNc1ccc(cn1)I 60aeae851908b1fd2c0c3aeb173c8819 [0,1,0,0,0,0|2,0,1]=4 1090 B12R1.1 O=CCCOc1ccc(cn1)Cl 4631398acb434734d57618ddbdb365aa [0,1,0,0,0,0|2,0,1]=4 1091 B12R1.1 O=CCCOc1ccc(cn1)F 4377eb14e370878eec0db099b711e66e [0,1,0,0,0,0|2,0,1]=4 1092 B12R1.1 O=CCCOc1ccc(cn1)I 50a1ad71ac71d0d7a259adab63038786 [0,1,0,0,0,0|2,0,1]=4 1093 B12R1.1 O=CCNCc1ccc(cn1)Br df59786400a3f7219d7449408db6d103 [0,1,0,0,0,0|2,0,1]=4 1094 B12R1.1 O=CCNCc1ccc(cn1)Cl b0eddc434372507a35f5b14b76a4c329 [0,1,0,0,0,0|2,0,1]=4 1095 B12R1.1 O=CCNCc1ccc(cn1)F be169d6dd50f58233c62d0db4a37a32a [0,1,0,0,0,0|2,0,1]=4 1096 B12R1.1 O=CCOCc1ccc(cn1)Br b33c9a5829f9d0acc87489425b6e90c0 [0,1,0,0,0,0|2,0,1]=4 1097 B12R1.1 O=CCOCc1ccc(cn1)Cl 6453d5b8f24d7055cbea11e6f311b206 [0,1,0,0,0,0|2,0,1]=4 1098 B12R1.1 O=CCOCc1ccc(cn1)F cbf5a1767f4d3ed578c1be6ba9614bdd [0,1,0,0,0,0|2,0,1]=4 1099 B12R1.1 O=CCOCc1ccc(cn1)I c56e4f9edc9f8738fa22a4fe89f834fd [0,1,0,0,0,0|2,0,1]=4 1100 B12R1.1 O=CNCCc1ccc(cn1)Br 04a338726e325432f2f82710f933823f [0,1,0,0,0,0|2,0,1]=4 1101 B12R1.1 O=c1ccc(n[nH]1)NCCCCl 477f00b1b9904fb201b5a7014056ddce [0,1,0,0,0,0|3,0,0]=4 1102 B12R1.1 O=c1ccc(n[nH]1)NCCCO d9161ec897215a964d64786935a63408 [0,1,0,0,0,0|3,0,0]=4 1103 B12R1.1 OCCCNc1c[nH]c(=S)cn1 03009a8a8e004de746d26a6ca99b84c8 [0,1,0,0,0,0|3,0,0]=4 1104 B12R1.1 OCCCNc1ccc(cc1)Br c7951d3f685379f9502fe06476a8a338 [0,1,0,0,0,0|3,0,0]=4 1105 B12R1.1 OCCCNc1ccc(cc1)Cl daf88a5c918ec152659114da1e30ab3c [0,1,0,0,0,0|3,0,0]=4 1106 B12R1.1 OCCCNc1ccc(cc1)F f5c38cbd68e54fb5a6696dcdebb82fdd [0,1,0,0,0,0|3,0,0]=4 1107 B12R1.1 OCCCNc1ccc(cc1)I 4f547e26d083aba907ed147824b03f37 [0,1,0,0,0,0|3,0,0]=4 1108 B12R1.1 OCCCNc1ccc(cc1)S ed2c306a27bfa097af4b417d17f2c1d8 [0,1,0,0,0,0|3,0,0]=4 1109 B12R1.1 OCCCNc1ccc(cn1)Br 3890a2bf5b58d90f9a0e66930acdf4a5 [0,1,0,0,0,0|2,0,0]=3 1110 B12R1.1 OCCCNc1ccc(cn1)Cl c08db83bf75dba2ddb313a7d75c46791 [0,1,0,0,0,0|2,0,0]=3 1111 B12R1.1 OCCCNc1ccc(cn1)F 22e07c7b8154e35c5505a5b83ca26ab7 [0,1,0,0,0,0|2,0,0]=3 1112 B12R1.1 OCCCNc1ccc(cn1)I e42bacfb17ecc4958004b22c9dd473c1 [0,1,0,0,0,0|2,0,0]=3 1113 B12R1.1 OCCCNc1ccc(nn1)Br db83a496225a6eba01d109334c4076b5 [0,1,0,0,0,0|3,0,0]=4 1114 B12R1.1 OCCCNc1ccc(nn1)Cl c5e90cf3ea918b2105765237cae63754 [0,1,0,0,0,0|3,0,0]=4 1115 B12R1.1 OCCCNc1ccc(nn1)F 672b505bbd911e7dd20a6af0b3471bc2 [0,1,0,0,0,0|3,0,0]=4 1116 B12R1.1 OCCCNc1ccc(nn1)I 9b480919df22b10dfa06312080c34e74 [0,1,0,0,0,0|3,0,0]=4 1117 B12R1.1 OCCCNc1cnc(cn1)Br 136df2dfa491bce12bb2ca42f7dc2c93 [0,1,0,0,0,0|3,0,0]=4 1118 B12R1.1 OCCCNc1cnc(cn1)Cl 2d22f4a4e63ce6e757123106302e1404 [0,1,0,0,0,0|3,0,0]=4 1119 B12R1.1 OCCCNc1cnc(cn1)I b67cde0b8cd0694fb52cd1ec4e1db2c1 [0,1,0,0,0,0|3,0,0]=4 1120 B12R1.1 OCCCNc1ncc(cn1)Br e3c35dc2442fec326c92fac5d18cb26c [0,1,0,0,0,0|3,0,0]=4 1121 B12R1.1 OCCCNc1ncc(cn1)Cl 92d1e30d0a016c1eeda15141b2aa545a [0,1,0,0,0,0|3,0,0]=4 1122 B12R1.1 OCCCNc1ncc(cn1)F 5f45d910a63aad2bc2fa2ca786ea5367 [0,1,0,0,0,0|3,0,0]=4 1123 B12R1.1 OCCCNc1ncc(cn1)I c50ec3901957a76efebbd2adea57b99c [0,1,0,0,0,0|3,0,0]=4 1124 B12R1.1 OCCNCc1ccc(cc1)Br ef6e3fa863da8b0ba7364e1e488bf0ff [0,1,0,0,0,0|3,0,0]=4 1125 B12R1.1 OCCNCc1ccc(cc1)Cl 6c37f4b1fbba8d005a13e10baf3e7b47 [0,1,0,0,0,0|3,0,0]=4 1126 B12R1.1 OCCNCc1ccc(cc1)F 50a3277b116202ff95f82e2866b4ac22 [0,1,0,0,0,0|3,0,0]=4 1127 B12R1.1 OCCNCc1ccc(cc1)I 458e55b24e97288bd9d15144f3597933 [0,1,0,0,0,0|3,0,0]=4 1128 B12R1.1 OCCNCc1ccc(cn1)Br 31bc0c03031bd5ed923ca056c2c81ef0 [0,1,0,0,0,0|2,0,0]=3 1129 B12R1.1 OCCNCc1ccc(cn1)Cl 9bed1cceea86d0a5ac7d7e763a3fb59e [0,1,0,0,0,0|2,0,0]=3 1130 B12R1.1 OCCNCc1ccc(cn1)F c29b282007e11cc2345788493921a8f3 [0,1,0,0,0,0|2,0,0]=3 1131 B12R1.1 OCCNCc1ccc(nn1)Cl 6a0c82747eccae40e12d3bd8cc135e83 [0,1,0,0,0,0|3,0,0]=4 1132 B12R1.1 OCCNCc1cnc(cn1)Br e5d5f556055f3d1d10a91969a322075e [0,1,0,0,0,0|3,0,0]=4 1133 B12R1.1 OCCNCc1cnc(cn1)Cl a6cd5545986f0d59101b5fbcedf17db0 [0,1,0,0,0,0|3,0,0]=4 1134 B12R1.1 OCCNCc1ncc(cn1)Br da22f651e1f53c40eeea0b9a6e54dadb [0,1,0,0,0,0|3,0,0]=4 1135 B12R1.1 OCCNCc1ncc(cn1)Cl 97b308c93ea59dc6c9ff7f468459f8c0 [0,1,0,0,0,0|3,0,0]=4 1136 B12R1.1 OCCNCc1ncc(cn1)F 15b742bbf6390e0a059c84104ff2298d [0,1,0,0,0,0|3,0,0]=4 1137 B12R1.1 OCNCCc1ccc(cc1)Br 5002fae370904c851fcde267599347c5 [0,1,0,0,0,0|3,0,0]=4 1138 B12R1.1 OCNCCc1ccc(cc1)Cl b2f32d28efbf4a7328eb35278d7709ed [0,1,0,0,0,0|3,0,0]=4 1139 B12R1.1 OCNCCc1ccc(cc1)F acbd4fb4b98e7917bf59751c1a5767da [0,1,0,0,0,0|3,0,0]=4 1140 B12R1.1 OCNCCc1ccc(cc1)I 5ed81d2dff56905aa39a602a1ea05bf7 [0,1,0,0,0,0|3,0,0]=4 1141 B12R1.1 OCNCCc1ccc(cn1)Br 4d5386d701019a26c592831438abdd7d [0,1,0,0,0,0|2,0,0]=3 1142 B12R1.1 S=c1cnc(c[nH]1)NCCCCl 2d4713f0a71020bc4ad197e54ad593f1 [0,1,0,0,0,0|3,0,0]=4 1143 B12R1.1 SCCCNc1ccc(cc1)Br 673d1851b71367718c45adf05845ceaa [0,1,0,0,0,0|3,0,0]=4 1144 B12R1.1 SCCCNc1ccc(cc1)Cl 48cecf77a4174329c4700db38a4923fa [0,1,0,0,0,0|3,0,0]=4 1145 B12R1.1 SCCCNc1ccc(cc1)I fc13b5f65462ddc42440f3d14018bcf0 [0,1,0,0,0,0|3,0,0]=4 1146 B12R1.1 SCCCNc1ccc(cc1)S 77f3bacf148ffbd8fcb02f2c9febd22f [0,1,0,0,0,0|3,0,0]=4 1147 B12R1.1 SCCCNc1ccc(cn1)Br e063d7991a0f1e8d1c2237d2ac0f1cce [0,1,0,0,0,0|2,0,0]=3 1148 B12R1.1 SCCCNc1ccc(cn1)Cl 1ab5a244118d69384daf2e9beb0d8a84 [0,1,0,0,0,0|2,0,0]=3 1149 B12R1.1 SCCCNc1ccc(cn1)I 1c4d2b20af84237ab0b3c97afe8fe4ba [0,1,0,0,0,0|2,0,0]=3 1150 B12R1.1 SCCCNc1ccc(nn1)Br 6880be0b39318a39317eb64edc3adb20 [0,1,0,0,0,0|3,0,0]=4 1151 B12R1.1 SCCCNc1ccc(nn1)Cl dd00001df3cb98ebe018a4012d559207 [0,1,0,0,0,0|3,0,0]=4 1152 B12R1.1 SCCCNc1ccc(nn1)I 2a6803963c4876ced1f44c8581c8d4c8 [0,1,0,0,0,0|3,0,0]=4 1153 B12R1.1 SCCCNc1cnc(cn1)Br e3768f386e7553ae6b21772b6d21fbc4 [0,1,0,0,0,0|3,0,0]=4 1154 B12R1.1 SCCCNc1cnc(cn1)Cl 055e34168b18e7a342bfc41e97caab25 [0,1,0,0,0,0|3,0,0]=4 1155 B12R1.1 SCCCNc1cnc(cn1)I be0906079e667a91ba1a1a171e53ae8a [0,1,0,0,0,0|3,0,0]=4 1156 B12R1.1 SCCCNc1ncc(cn1)Br f8e06d8b574a13d72cef5e9ac9f6896c [0,1,0,0,0,0|3,0,0]=4 1157 B12R1.1 SCCCNc1ncc(cn1)Cl 3a5f38e2c899f3c54f1cd002fe2cb816 [0,1,0,0,0,0|3,0,0]=4 1158 B12R1.1 SCCCNc1ncc(cn1)I af7912c5d460c75ae1b746ba249a8f92 [0,1,0,0,0,0|3,0,0]=4 1159 B12R1.1 SCCCOc1ccc(cc1)Br 7ca5bad08bfa0faf908f2dd33e57fbf2 [0,1,0,0,0,0|3,0,0]=4 1160 B12R1.1 SCCCOc1ccc(cc1)Cl e7e571903ae970359ea1c0b405e7c866 [0,1,0,0,0,0|3,0,0]=4 1161 B12R1.1 SCCCOc1ccc(cc1)I bb2c23c36e855dc46050222cfb9e48f6 [0,1,0,0,0,0|3,0,0]=4 1162 B12R1.1 SCCCOc1ccc(cc1)S 8bb8c6d061913fa2e38214e821fbd3fe [0,1,0,0,0,0|3,0,0]=4 1163 B12R1.1 SCCCOc1ccc(cn1)Cl d1ae51b588151634b7af120c26e2d6bd [0,1,0,0,0,0|2,0,0]=3 1164 B12R1.1 SCCCOc1ccc(cn1)I ca22edb0573dd3a7915796653389a782 [0,1,0,0,0,0|2,0,0]=3 1165 B12R1.1 SCCCOc1ccc(nn1)Br 2fd19fe62ef193b4db1d559164f44937 [0,1,0,0,0,0|3,0,0]=4 1166 B12R1.1 SCCCOc1ccc(nn1)Cl 95e66eabed8fee509b02f5fa8eb042b9 [0,1,0,0,0,0|3,0,0]=4 1167 B12R1.1 SCCCOc1cnc(cn1)Br 15663a3fb24de452c4cf8d54567d9a8f [0,1,0,0,0,0|3,0,0]=4 1168 B12R1.1 SCCCOc1cnc(cn1)Cl faa2db752e92a47b9df2bc66b9258416 [0,1,0,0,0,0|3,0,0]=4 1169 B12R1.1 SCCCOc1cnc(cn1)I 40fd07caba2386801d0c89ada59e6e14 [0,1,0,0,0,0|3,0,0]=4 1170 B12R1.1 SCCCOc1ncc(cn1)Br 5d2792d80f0760db22b0e3b3dc950e38 [0,1,0,0,0,0|3,0,0]=4 1171 B12R1.1 SCCCOc1ncc(cn1)I 6c07c01aa4f79904f1e3f1e3363ea3b4 [0,1,0,0,0,0|3,0,0]=4 1172 B12R1.1 SCCNCc1ccc(cc1)Br 824fa5cab6b3a6974481f539afbe2bf5 [0,1,0,0,0,0|3,0,0]=4 1173 B12R1.1 SCCNCc1ccc(cc1)Cl f3086d3f6a4f0ccf5a4881ad8509ed8c [0,1,0,0,0,0|3,0,0]=4 1174 B12R1.1 SCCNCc1ccc(cc1)I b9abcd8140e30ab1ff59b2cb841a7fd1 [0,1,0,0,0,0|3,0,0]=4 1175 B12R1.1 SCCNCc1ccc(cn1)Br 56cbb4a5727254a9dfeec19d5a82d5c1 [0,1,0,0,0,0|2,0,0]=3 1176 B12R1.1 SCCNCc1ccc(cn1)Cl 4cc9633c4ba698ce6d11ab5d6d65403c [0,1,0,0,0,0|2,0,0]=3 1177 B12R1.1 SCCNCc1ccc(nn1)Cl 495548747bd10dec42ba1a847ec040c4 [0,1,0,0,0,0|3,0,0]=4 1178 B12R1.1 SCCNCc1cnc(cn1)Br 1392cc0b0215f37d7eb67dabc9d00fa7 [0,1,0,0,0,0|3,0,0]=4 1179 B12R1.1 SCCNCc1cnc(cn1)Cl f8526785a91e1f309a96dfc0da0eea9e [0,1,0,0,0,0|3,0,0]=4 1180 B12R1.1 SCCNCc1ncc(cn1)Br 6934db270ca4af22eca3359827b0a36b [0,1,0,0,0,0|3,0,0]=4 1181 B12R1.1 SCCNCc1ncc(cn1)Cl ebf2678bbeee1417d7ab9882e3206a28 [0,1,0,0,0,0|3,0,0]=4 1182 B12R1.1 SCCOCc1ccc(cc1)Br 2cf76b2330f709226506aa2b36f077ca [0,1,0,0,0,0|3,0,0]=4 1183 B12R1.1 SCCOCc1ccc(cc1)Cl baca89a988859fc7b8aeb01fb3e1a1bf [0,1,0,0,0,0|3,0,0]=4 1184 B12R1.1 SCCOCc1ccc(cc1)I ab7879817cec768a48a5852d80ffb645 [0,1,0,0,0,0|3,0,0]=4 1185 B12R1.1 SCCOCc1ccc(cc1)S 5ec6089e109e3d3e513687503d2120da [0,1,0,0,0,0|3,0,0]=4 1186 B12R1.1 SCCOCc1ccc(cn1)Br 32b8b6bcd508961d911dc7db985faa2b [0,1,0,0,0,0|2,0,0]=3 1187 B12R1.1 SCCOCc1ccc(cn1)Cl 86816919f44bd10f210bd0756c250875 [0,1,0,0,0,0|2,0,0]=3 1188 B12R1.1 SCCOCc1ccc(cn1)I 120c08bb2db16bac64fed75b0e9ef8d9 [0,1,0,0,0,0|2,0,0]=3 1189 B12R1.1 SCCOCc1ccc(nn1)Cl 9b1251eb01ecda0261789aaa1a99cbdb [0,1,0,0,0,0|3,0,0]=4 1190 B12R1.1 SCCOCc1cnc(cn1)Br 1b9bd5987a3254c22cb0d39310e520f0 [0,1,0,0,0,0|3,0,0]=4 1191 B12R1.1 SCCOCc1cnc(cn1)Cl e7a3e3a677eb0708c21415ace5de3f44 [0,1,0,0,0,0|3,0,0]=4 1192 B12R1.1 SCCOCc1ncc(cn1)Br e51792e3c8c53cca7f0d533f7c5a11b2 [0,1,0,0,0,0|3,0,0]=4 1193 B12R1.1 SCCOCc1ncc(cn1)Cl cfb4124abeffde260aaf620935c036ef [0,1,0,0,0,0|3,0,0]=4 1194 B12R1.1 Sc1ccc(cc1)NCCCCl e2d433918759b3bb6ce75d96391dcab0 [0,1,0,0,0,0|3,0,0]=4 1195 B12R1.8 BrCCNCCc1ccccc1 44438bbdc203ba2a96e00daceba19cdb [0,1,0,0,0,0|2,0,0]=3 1196 B12R1.8 BrCCNCCc1ccccn1 9a06bde2821ec808c3f7baa49dbbb136 [0,1,0,0,0,0|1,0,0]=2 1197 B12R1.8 BrCCNCCc1cccnc1 d7f4e91980611b9c6a9d67fde3f5b289 [0,1,0,0,0,0|3,0,0]=4 1198 B12R1.8 BrCCNCCc1ccncc1 ba1243a8e4e9a5eab4ccd20a3c98cc85 [0,1,0,0,0,0|3,0,0]=4 1199 B12R1.8 BrCCNCSc1ccccc1 b2e3f633ef77399c1c780c49854458d2 [0,1,0,0,0,0|3,0,0]=4 1200 B12R1.8 C#CCCCNc1ccccc1 74fc175421dbc3b424699e770c0c2fc6 [0,1,0,0,0,0|1,0,2]=4 1201 B12R1.8 C#CCCCNc1ccccn1 f74918c9b775b912144ccd5ebf7491f1 [0,1,0,0,0,0|0,0,2]=3 1202 B12R1.8 C#CCCCNc1cccnn1 76286723d2d59074b8e520f6b9d5be8f [0,1,0,0,0,0|1,0,2]=4 1203 B12R1.8 C#CCCCNc1ccncn1 bf5830844b8ad1e295ce40b68bef1450 [0,1,0,0,0,0|1,0,2]=4 1204 B12R1.8 C#CCCCNc1cnccn1 6416c5f60eda14b12590176b18979b3e [0,1,0,0,0,0|1,0,2]=4 1205 B12R1.8 C#CCCCNc1ncccn1 4f6402023624168102f748f7bf77fa36 [0,1,0,0,0,0|1,0,2]=4 1206 B12R1.8 C#CCCCOc1ccccn1 ca998b2f242d93f6215c87905ac5ff4d [0,1,0,0,0,0|0,0,2]=3 1207 B12R1.8 C#CCCCOc1cnccn1 c4c1ef7ec0633123a31b46143711a2e1 [0,1,0,0,0,0|1,0,2]=4 1208 B12R1.8 C#CCCCOc1ncccn1 bc74863d2f5c3d440a3c2b6fbc756608 [0,1,0,0,0,0|1,0,2]=4 1209 B12R1.8 C#CCCNCc1ccccc1 9efcf95ab875a3743cf2704fb10ab2d7 [0,1,0,0,0,0|1,0,2]=4 1210 B12R1.8 C#CCCNCc1ccccn1 59d980bd17be4025beef06b5145435ba [0,1,0,0,0,0|0,0,2]=3 1211 B12R1.8 C#CCCNCc1cccnn1 0346294546c5b9efb16c9907491b73e6 [0,1,0,0,0,0|1,0,2]=4 1212 B12R1.8 C#CCCNCc1ccncn1 5f9144d098667c8db817106dee0cf123 [0,1,0,0,0,0|1,0,2]=4 1213 B12R1.8 C#CCCNCc1cnccn1 a0f7ebf27c6d1f9b59a52bf2a90b54bb [0,1,0,0,0,0|1,0,2]=4 1214 B12R1.8 C#CCCNCc1ncccn1 54a8940595cb35e709198af8e994b41c [0,1,0,0,0,0|1,0,2]=4 1215 B12R1.8 C#CCCOCc1ccccc1 97bbe114df19205ca39f984806a809da [0,1,0,0,0,0|1,0,2]=4 1216 B12R1.8 C#CCCOCc1ccccn1 36747d1196f3892bc1aba905204206de [0,1,0,0,0,0|0,0,2]=3 1217 B12R1.8 C#CCCOCc1cccnn1 4f4f9f0c32ac083c8fb9d884abaa05b1 [0,1,0,0,0,0|1,0,2]=4 1218 B12R1.8 C#CCCOCc1ccncn1 e82f526df0ff049f2d1c2214ced4d38b [0,1,0,0,0,0|1,0,2]=4 1219 B12R1.8 C#CCCOCc1cnccn1 a46a43f89cfc4a87d9ae6c0bcf337522 [0,1,0,0,0,0|1,0,2]=4 1220 B12R1.8 C#CCCOCc1ncccn1 3255fc18927b48afec86c0569bb950bc [0,1,0,0,0,0|1,0,2]=4 1221 B12R1.8 C#CCNCCc1ccccc1 92e5ef2f7dd8ca50296fc5c10a5e2140 [0,1,0,0,0,0|1,0,2]=4 1222 B12R1.8 C#CCNCCc1ccccn1 e1cf6dd033aadde6da07434202745395 [0,1,0,0,0,0|0,0,2]=3 1223 B12R1.8 C#CCNCCc1ccncn1 f2e94ad7ac8da7a87b357b1bd3423161 [0,1,0,0,0,0|1,0,2]=4 1224 B12R1.8 C#CCNCCc1cnccn1 63aaba78d37ccba31c11b968d1aeade4 [0,1,0,0,0,0|1,0,2]=4 1225 B12R1.8 C#CCNCCc1ncccn1 7d6aa83eaba903818f0de22466067e77 [0,1,0,0,0,0|1,0,2]=4 1226 B12R1.8 C#CCOCCc1ccccc1 1e82b640f7f45e3a6d3d3fcd5bd127f6 [0,1,0,0,0,0|1,0,2]=4 1227 B12R1.8 C#CCOCCc1ccccn1 9893f75bd965843947744e3b27cc7da1 [0,1,0,0,0,0|0,0,2]=3 1228 B12R1.8 C#CCOCCc1ccncn1 87b3a8a13c87a922e679fc14528dff24 [0,1,0,0,0,0|1,0,2]=4 1229 B12R1.8 C#CCOCCc1cnccn1 c48b6a2cc36801d1d3d27a27fcc9f75d [0,1,0,0,0,0|1,0,2]=4 1230 B12R1.8 C#CCOCCc1ncccn1 a4d7a429f2d51d242dad9b390799705a [0,1,0,0,0,0|1,0,2]=4 1231 B12R1.8 C/C=C/CNCc1ccccc1 696910dabaeed0573317ce9dc7d987f1 [0,1,0,0,0,0|1,0,2]=4 1232 B12R1.8 C/C=C/CNCc1ccccn1 65bbf7422c72780ea452fbab5779da40 [0,1,0,0,0,0|0,0,2]=3 1233 B12R1.8 C/C=C/CNCc1cccnn1 f2d9bf40903b320d65365150ec36d59d [0,1,0,0,0,0|1,0,2]=4 1234 B12R1.8 C/C=C/CNCc1ccncn1 88cec39012190ab3ab70dea956b802d0 [0,1,0,0,0,0|1,0,2]=4 1235 B12R1.8 C/C=C/CNCc1cnccn1 bc37e6988f58e50df247b59a4901a4ad [0,1,0,0,0,0|1,0,2]=4 1236 B12R1.8 C/C=C/CNCc1ncccn1 902b172cc086cca52bfdddf39dc14522 [0,1,0,0,0,0|1,0,2]=4 1237 B12R1.8 C/C=C/COCc1ccccc1 bedaf623f7df2efe6975ff88cd723c7c [0,1,0,0,0,0|1,0,2]=4 1238 B12R1.8 C/C=C/COCc1ccccn1 c318922f83e5d7127687e5bc80479da0 [0,1,0,0,0,0|0,0,2]=3 1239 B12R1.8 C/C=C/COCc1cccnn1 0dc340935c982981e5d04c2e487e7e0a [0,1,0,0,0,0|1,0,2]=4 1240 B12R1.8 C/C=C/COCc1ccncn1 5a06a7c04216d6423c29bb47935650b4 [0,1,0,0,0,0|1,0,2]=4 1241 B12R1.8 C/C=C/COCc1cnccn1 7f70b85635db06ccdcd0b37ae0b4ba8f [0,1,0,0,0,0|1,0,2]=4 1242 B12R1.8 C/C=C/COCc1ncccn1 bbd5c9f176f85f032389d2e35fa278fc [0,1,0,0,0,0|1,0,2]=4 1243 B12R1.8 C/C=C\CNCc1ccccc1 fd8d6b82f6381d759806df05cfd6b008 [0,1,0,0,0,0|1,0,2]=4 1244 B12R1.8 C/C=C\CNCc1ccccn1 410751982b21beea4a6a179c42faf08f [0,1,0,0,0,0|0,0,2]=3 1245 B12R1.8 C/C=C\CNCc1cccnn1 d43b36c7424be2560bfbe06aff2dce2e [0,1,0,0,0,0|1,0,2]=4 1246 B12R1.8 C/C=C\CNCc1ccncn1 2f8e43edbdfd1b0b0c389232912f387f [0,1,0,0,0,0|1,0,2]=4 1247 B12R1.8 C/C=C\CNCc1cnccn1 6e636615f0edab030e79013230f65e73 [0,1,0,0,0,0|1,0,2]=4 1248 B12R1.8 C/C=C\CNCc1ncccn1 84555b4412ffe39c8414f1c82dd59efb [0,1,0,0,0,0|1,0,2]=4 1249 B12R1.8 C/C=C\COCc1ccccc1 bb9ff25480a2f7ddd7050e8b042c0009 [0,1,0,0,0,0|1,0,2]=4 1250 B12R1.8 C/C=C\COCc1ccccn1 6d3bdb5e61e8c1aff7e72df2faab90c1 [0,1,0,0,0,0|0,0,2]=3 1251 B12R1.8 C/C=C\COCc1cccnn1 26d1d629d045d938b3f04b7ad4acd41c [0,1,0,0,0,0|1,0,2]=4 1252 B12R1.8 C/C=C\COCc1ccncn1 a89c46e5dfe6b064abdb929ed4f1a593 [0,1,0,0,0,0|1,0,2]=4 1253 B12R1.8 C/C=C\COCc1cnccn1 ea3c80b2a3c08d276c3f998ca6b9464a [0,1,0,0,0,0|1,0,2]=4 1254 B12R1.8 C/C=C\COCc1ncccn1 8c2dad11ffbf989998b5df2c13db48ba [0,1,0,0,0,0|1,0,2]=4 1255 B12R1.8 C=CCCCNc1ccccc1 1d0bca19d381bcc4d59024edc1b06712 [0,1,0,0,0,0|1,0,2]=4 1256 B12R1.8 C=CCCCNc1ccccn1 e5808d19518398a1ac1fb2845617301a [0,1,0,0,0,0|0,0,2]=3 1257 B12R1.8 C=CCCCNc1cccnn1 1e34b8f65a45d8697d6ab306650a6f1e [0,1,0,0,0,0|1,0,2]=4 1258 B12R1.8 C=CCCCNc1ccncn1 67076b4367c8e1ece8e2907aa62bf278 [0,1,0,0,0,0|1,0,2]=4 1259 B12R1.8 C=CCCCNc1cnccn1 e1237591913ac43a2cd76d49ce9d7752 [0,1,0,0,0,0|1,0,2]=4 1260 B12R1.8 C=CCCCNc1ncccn1 109d3568673c6662883c06fc064654e8 [0,1,0,0,0,0|1,0,2]=4 1261 B12R1.8 C=CCCCOc1ccccn1 b12ceda17d9a41bf4b369bab098a20b1 [0,1,0,0,0,0|0,0,2]=3 1262 B12R1.8 C=CCCCOc1cnccn1 d4f289e223e1c9c07a522b4f687531a2 [0,1,0,0,0,0|1,0,2]=4 1263 B12R1.8 C=CCCCOc1ncccn1 c16b1035ed895dd0af78f0f1b2228fe9 [0,1,0,0,0,0|1,0,2]=4 1264 B12R1.8 C=CCCNCc1ccccc1 7be44c4294c0af7fca2ca0fbee344b88 [0,1,0,0,0,0|1,0,2]=4 1265 B12R1.8 C=CCCNCc1ccccn1 b22afe97d1e37a0dc13465eb79fd6586 [0,1,0,0,0,0|0,0,2]=3 1266 B12R1.8 C=CCCNCc1cccnn1 584ff1c1eea5d6c919b97a8bd4925025 [0,1,0,0,0,0|1,0,2]=4 1267 B12R1.8 C=CCCNCc1ccncn1 45c0d7f55a2b1f08584f2364fb5679b2 [0,1,0,0,0,0|1,0,2]=4 1268 B12R1.8 C=CCCNCc1cnccn1 febe5d272658384348f2354c39110c30 [0,1,0,0,0,0|1,0,2]=4 1269 B12R1.8 C=CCCNCc1ncccn1 60cc480e263eb08812e0f390b88e4c76 [0,1,0,0,0,0|1,0,2]=4 1270 B12R1.8 C=CCCOCc1ccccc1 000cda704ecf3c98644bbc2e7f9bf607 [0,1,0,0,0,0|1,0,2]=4 1271 B12R1.8 C=CCCOCc1ccccn1 47e99f56f368e6a19737a4a3f652cca6 [0,1,0,0,0,0|0,0,2]=3 1272 B12R1.8 C=CCCOCc1cccnn1 04ef8e459bbbb4f06e1e0e755eabdc10 [0,1,0,0,0,0|1,0,2]=4 1273 B12R1.8 C=CCCOCc1ccncn1 1d07b41737da7303c8698950c9ea72e9 [0,1,0,0,0,0|1,0,2]=4 1274 B12R1.8 C=CCCOCc1cnccn1 83cff5fe87659b83e9b3e0dd453406c0 [0,1,0,0,0,0|1,0,2]=4 1275 B12R1.8 C=CCCOCc1ncccn1 c7089fc1817281bb751f290557726d51 [0,1,0,0,0,0|1,0,2]=4 1276 B12R1.8 C=CCNCCc1ccccc1 e4db187976e48a8658dbc174b43f52d7 [0,1,0,0,0,0|1,0,2]=4 1277 B12R1.8 C=CCNCCc1ccccn1 550ce1388b16ef35cb65525117331fc9 [0,1,0,0,0,0|0,0,2]=3 1278 B12R1.8 C=CCNCCc1ccncn1 98ad5e0d34a5df594f715e4d6ac849d3 [0,1,0,0,0,0|1,0,2]=4 1279 B12R1.8 C=CCNCCc1cnccn1 40962a87673d4ba84893ceb33c71ef29 [0,1,0,0,0,0|1,0,2]=4 1280 B12R1.8 C=CCNCCc1ncccn1 39c2e49a728bd002b5aa035ed8be1d65 [0,1,0,0,0,0|1,0,2]=4 1281 B12R1.8 C=CCOCCc1ccccc1 173678d3e3d21c00d8c7f5a8565ba584 [0,1,0,0,0,0|1,0,2]=4 1282 B12R1.8 C=CCOCCc1ccccn1 28adb9ab585b603d110dbc02f096f29c [0,1,0,0,0,0|0,0,2]=3 1283 B12R1.8 C=CCOCCc1ccncn1 3601f2d70ede18d72f99dfee8d5e326c [0,1,0,0,0,0|1,0,2]=4 1284 B12R1.8 C=CCOCCc1cnccn1 48677f9500929073e7f80e4a5af2e579 [0,1,0,0,0,0|1,0,2]=4 1285 B12R1.8 C=CCOCCc1ncccn1 4c2b75a29ef54d4e86e249391fec465c [0,1,0,0,0,0|1,0,2]=4 1286 B12R1.8 C=COCCNc1ccccn1 d058c97108c98511d70ae23f12f7359e [0,1,0,0,0,0|1,0,2]=4 1287 B12R1.8 CC#CCNCc1ccccc1 8c1f08f42380d385ee55fb616f0806b5 [0,1,0,0,0,0|1,0,2]=4 1288 B12R1.8 CC#CCNCc1ccccn1 8a8af7603e8e7a621462b7ac30be28b6 [0,1,0,0,0,0|0,0,2]=3 1289 B12R1.8 CC#CCNCc1cccnn1 1062ee43ea70cc51aa27e9de8cff2e3c [0,1,0,0,0,0|1,0,2]=4 1290 B12R1.8 CC#CCNCc1ccncn1 d4fab062e0821d23b3bf26e7313fd870 [0,1,0,0,0,0|1,0,2]=4 1291 B12R1.8 CC#CCNCc1ncccn1 f57ccf56b1bbf7c2ea422871f5602c07 [0,1,0,0,0,0|1,0,2]=4 1292 B12R1.8 CC#CCOCc1ccccc1 2b91241b0f7d27af23601ef3b65fea8e [0,1,0,0,0,0|1,0,2]=4 1293 B12R1.8 CC#CCOCc1ccccn1 04d64074535ea808a208cc29a543808a [0,1,0,0,0,0|0,0,2]=3 1294 B12R1.8 CC#CCOCc1cccnn1 1a418c57d1a7f73ff013ffcffadb7c35 [0,1,0,0,0,0|1,0,2]=4 1295 B12R1.8 CC#CCOCc1ccncn1 a6e7edf88cc9939fa3dc6deb065c005c [0,1,0,0,0,0|1,0,2]=4 1296 B12R1.8 CC#CCOCc1ncccn1 19480e4cf0d0ec9a6f8d7fc35f1c64a8 [0,1,0,0,0,0|1,0,2]=4 1297 B12R1.8 CC/C=C/CNc1ccccc1 ae4615a47949f31d5764aa26c0be3c5c [0,1,0,0,0,0|1,0,2]=4 1298 B12R1.8 CC/C=C/CNc1ccccn1 24ab92633738234b1891b610709451e3 [0,1,0,0,0,0|0,0,2]=3 1299 B12R1.8 CC/C=C/CNc1cccnn1 d3f8a3260b629c789898fa93041cbf07 [0,1,0,0,0,0|1,0,2]=4 1300 B12R1.8 CC/C=C/CNc1ccncn1 2d1e2288491a8e6e2ba0e3bdda746fa1 [0,1,0,0,0,0|1,0,2]=4 1301 B12R1.8 CC/C=C/CNc1cnccn1 1c624a9557cb3232a4ec125302039eaf [0,1,0,0,0,0|1,0,2]=4 1302 B12R1.8 CC/C=C/CNc1ncccn1 3c65ea96f0a103580a67f5339990c9c5 [0,1,0,0,0,0|1,0,2]=4 1303 B12R1.8 CC/C=C/COc1ccccn1 105fe30c6f6eddb2c32e06e634f46c4d [0,1,0,0,0,0|0,0,2]=3 1304 B12R1.8 CC/C=C/COc1cnccn1 d6fd5361fa1d59a46f726dfab945fb55 [0,1,0,0,0,0|1,0,2]=4 1305 B12R1.8 CC/C=C/COc1ncccn1 02db1fd9639983a4a561a46ead740459 [0,1,0,0,0,0|1,0,2]=4 1306 B12R1.8 CC=CCNCc1ccccc1 ccb966671e75f827f9356a0f248353fa [0,1,0,0,0,0|1,0,2]=4 1307 B12R1.8 CC=CCNCc1ccccn1 52a404d965cda1a058976d3644d6610b [0,1,0,0,0,0|0,0,2]=3 1308 B12R1.8 CC=CCNCc1cccnn1 1e0c6eef3f730f3d7918806c3942cb12 [0,1,0,0,0,0|1,0,2]=4 1309 B12R1.8 CC=CCNCc1ccncn1 d9dbca59d74b77d1cb142a62c036e30b [0,1,0,0,0,0|1,0,2]=4 1310 B12R1.8 CC=CCNCc1ncccn1 4d8577d2efde5365d743e932e5c9e7ff [0,1,0,0,0,0|1,0,2]=4 1311 B12R1.8 CC=CCOCc1ccccc1 dcaa6de30aada804690dc36fa942dd3d [0,1,0,0,0,0|1,0,2]=4 1312 B12R1.8 CC=CCOCc1ccccn1 01d3b11f6fb9777af0814506ac5db2f3 [0,1,0,0,0,0|0,0,2]=3 1313 B12R1.8 CC=CCOCc1cccnn1 b9658d8aeb970f5ce22b4d2c776c946c [0,1,0,0,0,0|1,0,2]=4 1314 B12R1.8 CC=CCOCc1ccncn1 92c620dff397a94d731d4f42d5871b58 [0,1,0,0,0,0|1,0,2]=4 1315 B12R1.8 CC=CCOCc1ncccn1 eda8c0ded6c43a069c284b7ec67b94eb [0,1,0,0,0,0|1,0,2]=4 1316 B12R1.8 CCC#CCNc1cnccn1 cb87ea1349e78d23fb47ae654d7be1fe [0,1,0,0,0,0|1,0,2]=4 1317 B12R1.8 CCCCCNc1ccccc1 91c03911249f1a729a636c2485e854e3 [0,1,0,0,0,0|1,0,0]=2 1318 B12R1.8 CCCCCNc1ccccn1 585f24212680e3bfc425e0aec0b439c2 [0,1,0,0,0,0|0,0,0]=1 1319 B12R1.8 CCCCCNc1cccnc1 5fa826aa2d84f836457483e84a27413b [0,1,0,0,0,0|2,0,0]=3 1320 B12R1.8 CCCCCNc1cccnn1 c04864b1ce8895901d55c47773f3319e [0,1,0,0,0,0|1,0,0]=2 1321 B12R1.8 CCCCCNc1ccncc1 c8c0d07b57d58f944b73cd42db77f640 [0,1,0,0,0,0|2,0,0]=3 1322 B12R1.8 CCCCCNc1ccncn1 25a4c4b291ffefde654816646b35739d [0,1,0,0,0,0|1,0,0]=2 1323 B12R1.8 CCCCCNc1ccnnc1 177544b24d5735a27cf22c7d659dd25c [0,1,0,0,0,0|3,0,0]=4 1324 B12R1.8 CCCCCNc1cnccn1 fa0b9188f3e56ceefce39ee8b4a03fc8 [0,1,0,0,0,0|1,0,0]=2 1325 B12R1.8 CCCCCNc1cncnc1 ada64334852c3b8ffd6fb5196571c237 [0,1,0,0,0,0|3,0,0]=4 1326 B12R1.8 CCCCCNc1cnncn1 3e72dc1670ecc735032a5dea11eb470b [0,1,0,0,0,0|2,0,0]=3 1327 B12R1.8 CCCCCNc1ncccn1 e8af30be246b0d8d027630c093836115 [0,1,0,0,0,0|1,0,0]=2 1328 B12R1.8 CCCCCNc1nccnn1 d5fb0c6161b9b6f48e85a4ef1ddc85d5 [0,1,0,0,0,0|2,0,0]=3 1329 B12R1.8 CCCCCNc1ncncn1 0f57fb81fa8194b2d7ce75fb6c5842bc [0,1,0,0,0,0|2,0,0]=3 1330 B12R1.8 CCCCCOc1ccccn1 c51e7a702fec97dea4ed5e55e57ef936 [0,1,0,0,0,0|0,0,0]=1 1331 B12R1.8 CCCCCOc1cccnc1 42835187bb2a96f147e75f8d7bf5c0be [0,1,0,0,0,0|2,0,0]=3 1332 B12R1.8 CCCCCOc1ccncc1 3d667a33e0f6f9349f26cd5c20bf8187 [0,1,0,0,0,0|2,0,0]=3 1333 B12R1.8 CCCCCOc1ccnnc1 630f1b539210e22d43fc0986aed453c2 [0,1,0,0,0,0|3,0,0]=4 1334 B12R1.8 CCCCCOc1cnccn1 d214fa01f0695c1984dcab91b41605a8 [0,1,0,0,0,0|1,0,0]=2 1335 B12R1.8 CCCCCOc1cncnc1 ca7024fa7daef3d6bca4132332739d86 [0,1,0,0,0,0|3,0,0]=4 1336 B12R1.8 CCCCCOc1cncnn1 3aec1d7a8613562d238822211b462dac [0,1,0,0,0,0|2,0,0]=3 1337 B12R1.8 CCCCCOc1ncccn1 e92c8dad1a3a03f4becf613ffbcc2b29 [0,1,0,0,0,0|1,0,0]=2 1338 B12R1.8 CCCCNCc1ccccc1 0ab7d34979c69bc4acd6ef46bb666f9a [0,1,0,0,0,0|1,0,0]=2 1339 B12R1.8 CCCCNCc1ccccn1 1dacaf15214ef41cb3c2f1c9818fbd94 [0,1,0,0,0,0|0,0,0]=1 1340 B12R1.8 CCCCNCc1cccnc1 f62a7991eabce63e2457be2a93ae29e8 [0,1,0,0,0,0|2,0,0]=3 1341 B12R1.8 CCCCNCc1cccnn1 e85972a339996fbc97bd1ba24951499a [0,1,0,0,0,0|1,0,0]=2 1342 B12R1.8 CCCCNCc1ccncc1 d7fdf09c2c934be58dbd6e9ec30494ab [0,1,0,0,0,0|2,0,0]=3 1343 B12R1.8 CCCCNCc1ccncn1 ab29aa919644ad68fa1a0cb61b11887a [0,1,0,0,0,0|1,0,0]=2 1344 B12R1.8 CCCCNCc1ccnnc1 73b387e139c6f8ec54d0001299843425 [0,1,0,0,0,0|3,0,0]=4 1345 B12R1.8 CCCCNCc1cnccn1 f13b8a1b0467e90a5ff165ce794eb30c [0,1,0,0,0,0|1,0,0]=2 1346 B12R1.8 CCCCNCc1cncnc1 2f95e3d9b8358a3f654661631e667b12 [0,1,0,0,0,0|3,0,0]=4 1347 B12R1.8 CCCCNCc1ncccn1 c2fa2e4a793322875ed2fd9d8bae77b5 [0,1,0,0,0,0|1,0,0]=2 1348 B12R1.8 CCCCOCc1ccccc1 e7a2ea9d8e76018a19cac6b1863869f7 [0,1,0,0,0,0|1,0,0]=2 1349 B12R1.8 CCCCOCc1ccccn1 bdbee8dba51183bb4dac05ec623e6fd7 [0,1,0,0,0,0|0,0,0]=1 1350 B12R1.8 CCCCOCc1cccnc1 e919bcaf101899d0377d8f05c8edc329 [0,1,0,0,0,0|2,0,0]=3 1351 B12R1.8 CCCCOCc1cccnn1 f5a5f583818e14143d6d5833cfd5183e [0,1,0,0,0,0|1,0,0]=2 1352 B12R1.8 CCCCOCc1ccncc1 5c9bdd1b1ccd1eb8838682c13573b707 [0,1,0,0,0,0|2,0,0]=3 1353 B12R1.8 CCCCOCc1ccncn1 49d4dcde88a50eb116064e31a63e0c64 [0,1,0,0,0,0|1,0,0]=2 1354 B12R1.8 CCCCOCc1ccnnc1 5b7a204d8427a1dd454ca7e1aa0fd0da [0,1,0,0,0,0|3,0,0]=4 1355 B12R1.8 CCCCOCc1cnccn1 69fb81e73c3c77d45793c9f184672475 [0,1,0,0,0,0|1,0,0]=2 1356 B12R1.8 CCCCOCc1cncnc1 3a2abab065573cb01ee29d59d6ff2fa0 [0,1,0,0,0,0|3,0,0]=4 1357 B12R1.8 CCCCOCc1ncccn1 b00a823080e8e499b38e48274716d854 [0,1,0,0,0,0|1,0,0]=2 1358 B12R1.8 CCCNCCc1ccccc1 de4634a5b10be0583379bf36a55fd975 [0,1,0,0,0,0|1,0,0]=2 1359 B12R1.8 CCCNCCc1ccccn1 db4179a8136b988593f56bef0e41421d [0,1,0,0,0,0|0,0,0]=1 1360 B12R1.8 CCCNCCc1cccnc1 1e462df2b0ae672e64302eccd1ccbf55 [0,1,0,0,0,0|2,0,0]=3 1361 B12R1.8 CCCNCCc1ccncc1 75fa7087d9d322d4fb962981385838e0 [0,1,0,0,0,0|2,0,0]=3 1362 B12R1.8 CCCNCCc1ccncn1 e758da57ce29f5c1f792d4970f454fad [0,1,0,0,0,0|1,0,0]=2 1363 B12R1.8 CCCNCCc1cnccn1 ffa55421166b44bca7b5c68aaafc31c1 [0,1,0,0,0,0|1,0,0]=2 1364 B12R1.8 CCCNCCc1ncccn1 268215bde8206e9e70d75eb004cae6ad [0,1,0,0,0,0|1,0,0]=2 1365 B12R1.8 CCCOCCc1ccccc1 6ff048bac0fc069e37a7f6359e53917a [0,1,0,0,0,0|1,0,0]=2 1366 B12R1.8 CCCOCCc1ccccn1 495b2e5857432868e8dc4db07751a420 [0,1,0,0,0,0|0,0,0]=1 1367 B12R1.8 CCCOCCc1cccnc1 04113a7c0c0fc7a249f8441dcdeb4b99 [0,1,0,0,0,0|2,0,0]=3 1368 B12R1.8 CCCOCCc1ccncc1 528887ae5600fb3f47428d9b5b2b2fc5 [0,1,0,0,0,0|2,0,0]=3 1369 B12R1.8 CCCOCCc1ccncn1 72928c6fa0d97cd8b24b7c5567183baa [0,1,0,0,0,0|1,0,0]=2 1370 B12R1.8 CCCOCCc1cnccn1 00b7a2df7c13ee5b18982acf7edc2094 [0,1,0,0,0,0|1,0,0]=2 1371 B12R1.8 CCCOCCc1cncnc1 353c17e7bf9336b34e387d6c94e762da [0,1,0,0,0,0|3,0,0]=4 1372 B12R1.8 CCCOCCc1ncccn1 85b59f6e28cb48774a8562b89a016222 [0,1,0,0,0,0|1,0,0]=2 1373 B12R1.8 CCNC/C=C/c1ccccc1 c4e37c1c9c7a04432ce233e4ac762fd0 [0,1,0,0,0,0|1,0,2]=4 1374 B12R1.8 CCNCCCc1ccccc1 b7715a69dd85035a729bcc3298689ab5 [0,1,0,0,0,0|1,0,0]=2 1375 B12R1.8 CCNCCCc1ccccn1 048a807537b42fb54187509210f6e12c [0,1,0,0,0,0|0,0,0]=1 1376 B12R1.8 CCNCCCc1cccnc1 3373f8695160430ad61e1df554bf48e4 [0,1,0,0,0,0|2,0,0]=3 1377 B12R1.8 CCNCCCc1ccncc1 1312ae4c95d1a1c5d3e95a7869565a5a [0,1,0,0,0,0|2,0,0]=3 1378 B12R1.8 CCNCCOc1ccccc1 d5ddae3ded59ed35e9c0403b52d833f2 [0,1,0,0,0,0|2,0,0]=3 1379 B12R1.8 CCNCCOc1ccccn1 f517badbab06764c0d778d5166959ef7 [0,1,0,0,0,0|1,0,0]=2 1380 B12R1.8 CCNCCOc1cccnc1 adb1131ba5508d4c001efaf388a270f7 [0,1,0,0,0,0|3,0,0]=4 1381 B12R1.8 CCOC/C=C/c1ccccc1 6f0f2808fd7750fbafef94eda36a57cc [0,1,0,0,0,0|1,0,2]=4 1382 B12R1.8 CCOC/C=C/c1ccccn1 cae7eddd94e24a2fc38c25988d14a995 [0,1,0,0,0,0|0,0,2]=3 1383 B12R1.8 CCOC/C=C\c1ccccc1 718b8db828f50aaf9df65554f6d18358 [0,1,0,0,0,0|1,0,2]=4 1384 B12R1.8 CCOCC#Cc1ccccc1 a3a92c3f297e8d8da3f37815c5bdf50e [0,1,0,0,0,0|1,0,2]=4 1385 B12R1.8 CCOCC#Cc1ccccn1 d099d7fcee7b6f886602239aa2c8b779 [0,1,0,0,0,0|0,0,2]=3 1386 B12R1.8 CCOCC=Cc1ccccc1 ea6af70ca1c55ffae7ca4fca9bfef55c [0,1,0,0,0,0|1,0,2]=4 1387 B12R1.8 CCOCCCC1=CCC=CC1 c736e524db2f6bc6d387404d01ab523e [0,1,0,0,0,0|1,0,1]=3 1388 B12R1.8 CCOCCCc1ccccc1 95c4d5e38aabc377fa248d955f0dc679 [0,1,0,0,0,0|1,0,0]=2 1389 B12R1.8 CCOCCCc1ccccn1 859085eeaedc4a3c650b307e46d76a73 [0,1,0,0,0,0|0,0,0]=1 1390 B12R1.8 CCOCCCc1cccnc1 5173637fbf4b8276cf79cd9d0837d422 [0,1,0,0,0,0|2,0,0]=3 1391 B12R1.8 CCOCCCc1ccncc1 48fe4d63de940c0c26169b537e6586f9 [0,1,0,0,0,0|2,0,0]=3 1392 B12R1.8 CCOCCCc1cnccn1 96377e577044f54d4eefcfd8ca347005 [0,1,0,0,0,0|1,0,0]=2 1393 B12R1.8 CCOCCCc1ncccn1 91b7e5dbb1003691bde7168b7868a4b2 [0,1,0,0,0,0|1,0,0]=2 1394 B12R1.8 CCOCCNc1ccccc1 d4241708f39fbdf3b0b47b3411df7d4e [0,1,0,0,0,0|2,0,0]=3 1395 B12R1.8 CCOCCNc1ccccn1 c924cdaad90ee79ffea92abd5325e8fd [0,1,0,0,0,0|1,0,0]=2 1396 B12R1.8 CCOCCNc1cccnc1 1e5823b67f834b1b6e334c78d0ca748a [0,1,0,0,0,0|3,0,0]=4 1397 B12R1.8 CCOCCNc1cccnn1 6e0438c3ae5589ce67ed194d095dd8ed [0,1,0,0,0,0|2,0,0]=3 1398 B12R1.8 CCOCCNc1ccncc1 260b7c9e21e5dbc4931cda801e5b3f25 [0,1,0,0,0,0|3,0,0]=4 1399 B12R1.8 CCOCCNc1ccncn1 cf3f60ddf1ebcd296dc9bfa8dbb85a0b [0,1,0,0,0,0|2,0,0]=3 1400 B12R1.8 CCOCCNc1cnccn1 7a3dbea716592a3e2f32a8bc18b0e703 [0,1,0,0,0,0|2,0,0]=3 1401 B12R1.8 CCOCCNc1cncnn1 d7c10718e5fe976bd76c9fb532d13bd1 [0,1,0,0,0,0|3,0,0]=4 1402 B12R1.8 CCOCCNc1cnncn1 9ac777c6e1c7836c2e45daea31c55460 [0,1,0,0,0,0|3,0,0]=4 1403 B12R1.8 CCOCCNc1ncccn1 f2cb7c887ea1a94a935bae6f924c81e6 [0,1,0,0,0,0|2,0,0]=3 1404 B12R1.8 CCOCCNc1nccnn1 abea9f0c4788ffd7a386bf4102b26570 [0,1,0,0,0,0|3,0,0]=4 1405 B12R1.8 CCOCCNc1ncncn1 776d6d4e4f64373461cd34f475bb99aa [0,1,0,0,0,0|3,0,0]=4 1406 B12R1.8 CCOCCOc1ccccc1 7cc50880b35d5d523b8ebe021571ca68 [0,1,0,0,0,0|2,0,0]=3 1407 B12R1.8 CCOCCOc1ccccn1 f5da0aa9fa2ad7dc4a95c1eb6c04963e [0,1,0,0,0,0|1,0,0]=2 1408 B12R1.8 CCOCCOc1cccnc1 90da2abbb29c3a2804fd3529fe27903c [0,1,0,0,0,0|3,0,0]=4 1409 B12R1.8 CCOCCOc1ccncc1 58cc63725af75927174d6514028cc9ba [0,1,0,0,0,0|3,0,0]=4 1410 B12R1.8 CCOCCOc1cnccn1 d992c38f9e68fc07ae1eee251c5f42fe [0,1,0,0,0,0|2,0,0]=3 1411 B12R1.8 CCOCCOc1cncnn1 b81355bb0870f2abb954c06ea0c90279 [0,1,0,0,0,0|3,0,0]=4 1412 B12R1.8 CCOCCOc1ncccn1 e689ee34ee6845bb24cf93548264b2e7 [0,1,0,0,0,0|2,0,0]=3 1413 B12R1.8 CCOCCSc1ccccc1 673ed7aececbd7276e2d946a99a864ba [0,1,0,0,0,0|2,0,0]=3 1414 B12R1.8 CCOCCSc1ccccn1 39f6195046a78c2bf820f28d6480fc87 [0,1,0,0,0,0|1,0,0]=2 1415 B12R1.8 CCOCNCc1ccccc1 ad1ac49e8362d6c3a7ef7f4bc168f4ac [0,1,0,0,0,0|2,0,0]=3 1416 B12R1.8 CCOCNCc1ccccn1 ee5ecc87187447710671c4e404ab5d67 [0,1,0,0,0,0|1,0,0]=2 1417 B12R1.8 CCOCNCc1cccnc1 77dc363b01d495a6518051d104958a2f [0,1,0,0,0,0|3,0,0]=4 1418 B12R1.8 CCOCNCc1cccnn1 ceaf7071dbc13f3f22d89fcf44347a7f [0,1,0,0,0,0|2,0,0]=3 1419 B12R1.8 CCOCNCc1ccncc1 030d2e2cead04e3196eb6c2ccd092890 [0,1,0,0,0,0|3,0,0]=4 1420 B12R1.8 CCOCNCc1ccncn1 b4cdb03b996166d4cdfca3eb0ed14ad5 [0,1,0,0,0,0|2,0,0]=3 1421 B12R1.8 CCOCNCc1cnccn1 ce2ae80bcbedd3c655264d5e80cfb517 [0,1,0,0,0,0|2,0,0]=3 1422 B12R1.8 CCOCNCc1ncccn1 4f5a83040c005533fe5709e2b55783f9 [0,1,0,0,0,0|2,0,0]=3 1423 B12R1.8 CCOCOCc1ccccn1 14f99fa0e6d24bdb50dcb8c7585da890 [0,1,0,0,0,0|1,0,0]=2 1424 B12R1.8 CCOCOCc1cccnn1 29e61339796337936c01d738db3a854b [0,1,0,0,0,0|2,0,0]=3 1425 B12R1.8 CCOCOCc1ccncn1 5011fe252b8e59d8a7e664705a511c68 [0,1,0,0,0,0|2,0,0]=3 1426 B12R1.8 CCOCOCc1ncccn1 d4558727a8361d465bbd3aba4eb55245 [0,1,0,0,0,0|2,0,0]=3 1427 B12R1.8 CCSCCNc1ccccc1 3aa28a6af03561c4dff60fa2d0f2630b [0,1,0,0,0,0|2,0,0]=3 1428 B12R1.8 CCSCCNc1ccccn1 9ac125fe19f7981ccaa6c3050039d522 [0,1,0,0,0,0|1,0,0]=2 1429 B12R1.8 CCSCCNc1cccnc1 a626c8afe0b69622b1713a0faff348bc [0,1,0,0,0,0|3,0,0]=4 1430 B12R1.8 CCSCCNc1cccnn1 7779585b700012c188a65dfe04eb1ac5 [0,1,0,0,0,0|2,0,0]=3 1431 B12R1.8 CCSCCNc1ccncc1 c0b412122d4dc80e66e392673c31ad9c [0,1,0,0,0,0|3,0,0]=4 1432 B12R1.8 CCSCCNc1ccncn1 54707ded034fab1d20154233bde87b56 [0,1,0,0,0,0|2,0,0]=3 1433 B12R1.8 CCSCCNc1cnccn1 6af65a68b7d9f82ed47cd35bb3a516e1 [0,1,0,0,0,0|2,0,0]=3 1434 B12R1.8 CCSCCNc1cnncn1 35067a98dd5f6787bd52ed8a64116847 [0,1,0,0,0,0|3,0,0]=4 1435 B12R1.8 CCSCCNc1ncccn1 0486dd62c947d43a700c2850cc52244f [0,1,0,0,0,0|2,0,0]=3 1436 B12R1.8 CCSCCNc1nccnn1 a41add630894db70a5644e538d9eae5f [0,1,0,0,0,0|3,0,0]=4 1437 B12R1.8 CCSCCNc1ncncn1 46296fd539f55c1ac148a7b82eec8af1 [0,1,0,0,0,0|3,0,0]=4 1438 B12R1.8 CCSCCOc1ccccn1 fb856e4b8d5fc3246866ee7d11418749 [0,1,0,0,0,0|1,0,0]=2 1439 B12R1.8 CCSCCOc1cccnc1 7a1b433bc628cddad8cf57c9341a16cf [0,1,0,0,0,0|3,0,0]=4 1440 B12R1.8 CCSCCOc1ccncc1 39d2441591cd99866c275069dfb9b929 [0,1,0,0,0,0|3,0,0]=4 1441 B12R1.8 CCSCCOc1cnccn1 ff1aff4b0d48bba2fd7dddb2323e221a [0,1,0,0,0,0|2,0,0]=3 1442 B12R1.8 CCSCCOc1cncnn1 df6a30b28b1f7262931e16d1c250d822 [0,1,0,0,0,0|3,0,0]=4 1443 B12R1.8 CCSCCOc1ncccn1 0d33c9c85c16b4fcd6d9a12124e7fd2f [0,1,0,0,0,0|2,0,0]=3 1444 B12R1.8 COCCCNc1ccccc1 3df3fc4fbaedb1dd760b4a37be035630 [0,1,0,0,0,0|2,0,0]=3 1445 B12R1.8 COCCCNc1ccccn1 b3704682ea886739d8d3ef30bc747ee7 [0,1,0,0,0,0|1,0,0]=2 1446 B12R1.8 COCCCNc1cccnc1 f137f9251ed366e53ff206e14110778d [0,1,0,0,0,0|3,0,0]=4 1447 B12R1.8 COCCCNc1cccnn1 0867dbc8a1e919f5687237df8b00ee39 [0,1,0,0,0,0|2,0,0]=3 1448 B12R1.8 COCCCNc1ccncc1 c41a6489b75ed922ab6364283a988c83 [0,1,0,0,0,0|3,0,0]=4 1449 B12R1.8 COCCCNc1ccncn1 23de1961866255004167f81da3017c08 [0,1,0,0,0,0|2,0,0]=3 1450 B12R1.8 COCCCNc1cnccn1 90e3e9e86ab90ed9e921777b834fa746 [0,1,0,0,0,0|2,0,0]=3 1451 B12R1.8 COCCCNc1cnncn1 3f684c3941e6cc36e025215e69632c52 [0,1,0,0,0,0|3,0,0]=4 1452 B12R1.8 COCCCNc1ncccn1 480c5a81b857b38c618cd05b3f52a0d1 [0,1,0,0,0,0|2,0,0]=3 1453 B12R1.8 COCCCNc1nccnn1 b9becf68c619e79280d947d95a06b4f7 [0,1,0,0,0,0|3,0,0]=4 1454 B12R1.8 COCCCNc1ncncn1 48f478b1e19cb3ff1eba3b72ae04166c [0,1,0,0,0,0|3,0,0]=4 1455 B12R1.8 COCCCOc1ccccn1 43bfda6a85c42f66b9ce84c1adba5682 [0,1,0,0,0,0|1,0,0]=2 1456 B12R1.8 COCCCOc1cccnc1 ec958672fe26ba1a178ae65969d24489 [0,1,0,0,0,0|3,0,0]=4 1457 B12R1.8 COCCCOc1ccncc1 e5daa8a0ea56b79b7618cce89f1cbf45 [0,1,0,0,0,0|3,0,0]=4 1458 B12R1.8 COCCCOc1cnccn1 4f95f96243168ed43dbf37c4d9fe539d [0,1,0,0,0,0|2,0,0]=3 1459 B12R1.8 COCCCOc1cncnn1 acc7579fe4ba02d472ce0e40dfb4a9f7 [0,1,0,0,0,0|3,0,0]=4 1460 B12R1.8 COCCCOc1ncccn1 d66ba8a7816f55b7cd98f4a77a3b6b45 [0,1,0,0,0,0|2,0,0]=3 1461 B12R1.8 COCCNCc1ccccc1 8a36d3044a8140246d8590cb65467526 [0,1,0,0,0,0|2,0,0]=3 1462 B12R1.8 COCCNCc1ccccn1 3f19c45c0ff011efc1b5c3ee20b6b35e [0,1,0,0,0,0|1,0,0]=2 1463 B12R1.8 COCCNCc1cccnc1 daeeb1b2dd3039141ded10f95692d744 [0,1,0,0,0,0|3,0,0]=4 1464 B12R1.8 COCCNCc1cccnn1 a3daf10b8adf2cf4d79827dc7ea4a6f3 [0,1,0,0,0,0|2,0,0]=3 1465 B12R1.8 COCCNCc1ccncc1 92207752fd88ce5ce5c8380c92f4a083 [0,1,0,0,0,0|3,0,0]=4 1466 B12R1.8 COCCNCc1ccncn1 0d6b868d49b753831674cc5f72e15b3d [0,1,0,0,0,0|2,0,0]=3 1467 B12R1.8 COCCNCc1cnccn1 d0b6464b1143809f82269d8dad799fee [0,1,0,0,0,0|2,0,0]=3 1468 B12R1.8 COCCNCc1ncccn1 3fc29e851ff60de01e407a1881432eb4 [0,1,0,0,0,0|2,0,0]=3 1469 B12R1.8 COCCOCc1ccccc1 b9f846e77ac1098b75510b938c502133 [0,1,0,0,0,0|2,0,0]=3 1470 B12R1.8 COCCOCc1ccccn1 86c9ea446a5f0c2dbf739a9c1ec4af6f [0,1,0,0,0,0|1,0,0]=2 1471 B12R1.8 COCCOCc1cccnc1 317f931a4364675768525b7f79270a0e [0,1,0,0,0,0|3,0,0]=4 1472 B12R1.8 COCCOCc1cccnn1 6408daff7922ff99d328664433bb04e5 [0,1,0,0,0,0|2,0,0]=3 1473 B12R1.8 COCCOCc1ccncc1 777776af9843b5789a5e9b603c11672b [0,1,0,0,0,0|3,0,0]=4 1474 B12R1.8 COCCOCc1ccncn1 59ec7095bcafcd2ebc843842861ad8b2 [0,1,0,0,0,0|2,0,0]=3 1475 B12R1.8 COCCOCc1cnccn1 02c82acf474fda95b7a7a381228a4ada [0,1,0,0,0,0|2,0,0]=3 1476 B12R1.8 COCCOCc1ncccn1 04048f4ff54770269cf5dda97ff92668 [0,1,0,0,0,0|2,0,0]=3 1477 B12R1.8 COCNCCc1ccccc1 a912e7467b1cfbc21e322d32a6dcd9f6 [0,1,0,0,0,0|2,0,0]=3 1478 B12R1.8 COCNCCc1ccccn1 d2388531e21389a0bbeb6695b6cea49d [0,1,0,0,0,0|1,0,0]=2 1479 B12R1.8 COCNCCc1cccnc1 3064a84f6232ed938ac5d787283e4e47 [0,1,0,0,0,0|3,0,0]=4 1480 B12R1.8 COCNCCc1ccncc1 6b569331b6ff5ac4e281457fad47a423 [0,1,0,0,0,0|3,0,0]=4 1481 B12R1.8 COCNCCc1ccncn1 1a854ed5d386c0daae0e95e611f8fdfc [0,1,0,0,0,0|2,0,0]=3 1482 B12R1.8 COCNCCc1cnccn1 bf87a3331ba42ace588710d5b4856175 [0,1,0,0,0,0|2,0,0]=3 1483 B12R1.8 COCNCCc1ncccn1 8fba07c89cace42bbb581fd44efdd301 [0,1,0,0,0,0|2,0,0]=3 1484 B12R1.8 COCOCCc1ccccc1 770adb91b0343cd94d912838fb402d30 [0,1,0,0,0,0|2,0,0]=3 1485 B12R1.8 COCOCCc1ccccn1 844ec6012059e3e290cbbc2ae5f59230 [0,1,0,0,0,0|1,0,0]=2 1486 B12R1.8 COCOCCc1cccnc1 9d4fdcdb68f5067a05286e77e6f5164f [0,1,0,0,0,0|3,0,0]=4 1487 B12R1.8 COCOCCc1ccncc1 2305f86484e3fbdb87c5f93fceb814cd [0,1,0,0,0,0|3,0,0]=4 1488 B12R1.8 COCOCCc1ccncn1 748dcf5b02a15aaeacebf409cccd24eb [0,1,0,0,0,0|2,0,0]=3 1489 B12R1.8 COCOCCc1cnccn1 5608489fa47adaf76825900029a862da [0,1,0,0,0,0|2,0,0]=3 1490 B12R1.8 COCOCCc1ncccn1 d724c05e27dfc7afdcc3f434b6962bf3 [0,1,0,0,0,0|2,0,0]=3 1491 B12R1.8 CSCCCNc1ccccc1 4e1411f18abc16ae61e9748ad3fe9913 [0,1,0,0,0,0|2,0,0]=3 1492 B12R1.8 CSCCCNc1ccccn1 80fd9025455749dcd8da4ebce8a4f0a8 [0,1,0,0,0,0|1,0,0]=2 1493 B12R1.8 CSCCCNc1cccnc1 a65744a1c0bfc4ffc8f90d3d751e8fd9 [0,1,0,0,0,0|3,0,0]=4 1494 B12R1.8 CSCCCNc1cccnn1 30da6488f1ff75c840c66941baed1b84 [0,1,0,0,0,0|2,0,0]=3 1495 B12R1.8 CSCCCNc1ccncc1 8937538f26cbfac38fa144dc16ba30f6 [0,1,0,0,0,0|3,0,0]=4 1496 B12R1.8 CSCCCNc1ccncn1 9cb64f8a4c3ea74798a440e1dfa33d1a [0,1,0,0,0,0|2,0,0]=3 1497 B12R1.8 CSCCCNc1cnccn1 adbf48463c54ada01462865c6d035712 [0,1,0,0,0,0|2,0,0]=3 1498 B12R1.8 CSCCCNc1cnncn1 7dbec02ed80552298ca2cf2a3e6c9c1d [0,1,0,0,0,0|3,0,0]=4 1499 B12R1.8 CSCCCNc1ncccn1 bde72c46fe55cb7c4f05a3cc75ff8a09 [0,1,0,0,0,0|2,0,0]=3 1500 B12R1.8 CSCCCNc1nccnn1 eab157811a3085f87f5d4e1a2d4e3dc3 [0,1,0,0,0,0|3,0,0]=4 1501 B12R1.8 CSCCCNc1ncncn1 3d0dc354e1e336eff3bb6c61ea7cd042 [0,1,0,0,0,0|3,0,0]=4 1502 B12R1.8 CSCCCOc1ccccn1 3ffe432bdcd1a250a9ca21e1fd86b1e9 [0,1,0,0,0,0|1,0,0]=2 1503 B12R1.8 CSCCCOc1cccnc1 86df670b3262b86521b899f8575ac879 [0,1,0,0,0,0|3,0,0]=4 1504 B12R1.8 CSCCCOc1ccncc1 55e2a767f068d3518a4625983214ce1a [0,1,0,0,0,0|3,0,0]=4 1505 B12R1.8 CSCCCOc1cnccn1 9c3d87437e23b8ea1567bfef8b29d38a [0,1,0,0,0,0|2,0,0]=3 1506 B12R1.8 CSCCCOc1cncnn1 3b7219610014c9767391134156f62e7b [0,1,0,0,0,0|3,0,0]=4 1507 B12R1.8 CSCCCOc1ncccn1 31649ccdc79843e4c4feb3aed45ce10d [0,1,0,0,0,0|2,0,0]=3 1508 B12R1.8 CSCCNCc1ccccc1 0d4e7f51d968ec32ec790202ae2a515e [0,1,0,0,0,0|2,0,0]=3 1509 B12R1.8 CSCCNCc1ccccn1 1637bb4fe5437c10ef5060198d868124 [0,1,0,0,0,0|1,0,0]=2 1510 B12R1.8 CSCCNCc1cccnc1 ecfab7d8e375ad1f8b77b31b8d0610f7 [0,1,0,0,0,0|3,0,0]=4 1511 B12R1.8 CSCCNCc1cccnn1 200a5d28bbaca89aab6f3d40a04481a9 [0,1,0,0,0,0|2,0,0]=3 1512 B12R1.8 CSCCNCc1ccncc1 51ffe14c2037889bed6c70473f493ea0 [0,1,0,0,0,0|3,0,0]=4 1513 B12R1.8 CSCCNCc1ccncn1 ced414fa325eb607f80f3592d0ce80b8 [0,1,0,0,0,0|2,0,0]=3 1514 B12R1.8 CSCCNCc1cnccn1 a140a84ab10598d2e0065e9c8ce3512c [0,1,0,0,0,0|2,0,0]=3 1515 B12R1.8 CSCCNCc1ncccn1 042b97be3e56b3c41f5ddf6609732ffa [0,1,0,0,0,0|2,0,0]=3 1516 B12R1.8 CSCCOCc1ccccc1 84c183c4a4472a4f34bccedb678bad7b [0,1,0,0,0,0|2,0,0]=3 1517 B12R1.8 CSCCOCc1ccccn1 4347aa5a5271fb25a5cc77c30dfa8a82 [0,1,0,0,0,0|1,0,0]=2 1518 B12R1.8 CSCCOCc1cccnc1 2805e860271ae018830b9c6b9d160171 [0,1,0,0,0,0|3,0,0]=4 1519 B12R1.8 CSCCOCc1cccnn1 8287a658f31b96ae866296e3940041ee [0,1,0,0,0,0|2,0,0]=3 1520 B12R1.8 CSCCOCc1ccncc1 da1bc6e1cdfc850ef0acdf1a6cc8da23 [0,1,0,0,0,0|3,0,0]=4 1521 B12R1.8 CSCCOCc1ccncn1 fa2a19fff1e39c69f1f64ffbb14c8872 [0,1,0,0,0,0|2,0,0]=3 1522 B12R1.8 CSCCOCc1cnccn1 dce6736c5d1e5a1139325b397172ae4f [0,1,0,0,0,0|2,0,0]=3 1523 B12R1.8 CSCCOCc1ncccn1 272c9d5264a804a51449bbba6a26010a [0,1,0,0,0,0|2,0,0]=3 1524 B12R1.8 CSCNCCc1ccccc1 8cb9946ee650f17d4a684e0a1795e862 [0,1,0,0,0,0|2,0,0]=3 1525 B12R1.8 CSCNCCc1ccccn1 1805bded532b1b9756c352b14606e2a1 [0,1,0,0,0,0|1,0,0]=2 1526 B12R1.8 CSCNCCc1cccnc1 a572540020592b533113991945b4ad18 [0,1,0,0,0,0|3,0,0]=4 1527 B12R1.8 CSCNCCc1ccncc1 03b3401fdb1cdeb25dbd38f4797d54c8 [0,1,0,0,0,0|3,0,0]=4 1528 B12R1.8 CSCNCCc1ccncn1 8ab2ad97a2322b500e0516b85be30473 [0,1,0,0,0,0|2,0,0]=3 1529 B12R1.8 CSCNCCc1cnccn1 70034cb084c6ae5c6e2a48cda7843223 [0,1,0,0,0,0|2,0,0]=3 1530 B12R1.8 CSCNCCc1ncccn1 508164d4be0707af231a7595e5629392 [0,1,0,0,0,0|2,0,0]=3 1531 B12R1.8 CSCOCCc1ccccc1 ae45fc1dadd522ae78b6ec0b53b58cbe [0,1,0,0,0,0|2,0,0]=3 1532 B12R1.8 CSCOCCc1ccccn1 40581d5eea60828490877c6330a8a9e0 [0,1,0,0,0,0|1,0,0]=2 1533 B12R1.8 CSCOCCc1cccnc1 f9735501f5c0f5766f3d2359d2e2e003 [0,1,0,0,0,0|3,0,0]=4 1534 B12R1.8 CSCOCCc1ccncc1 0eb83f8787ae71ed3ae7d5be71f64369 [0,1,0,0,0,0|3,0,0]=4 1535 B12R1.8 CSCOCCc1ccncn1 ef80479e687f6fb7a2dba6d3c9d17608 [0,1,0,0,0,0|2,0,0]=3 1536 B12R1.8 CSCOCCc1cnccn1 c2c51c11dbe1d014169515e71f2ee355 [0,1,0,0,0,0|2,0,0]=3 1537 B12R1.8 CSCOCCc1ncccn1 91aec60b933bcc3edc5c4b2fcf2322f4 [0,1,0,0,0,0|2,0,0]=3 1538 B12R1.8 Cl/C=C/CNCc1ccccn1 9168f61a18ab1a6442ef5ae95335a708 [0,1,0,0,0,0|1,0,2]=4 1539 B12R1.8 Cl/C=C/COCc1ccccn1 224783ee42a3577b1a3512c1e8bc6b9d [0,1,0,0,0,0|1,0,2]=4 1540 B12R1.8 Cl/C=C\CNCc1ccccn1 2e8c85145e74c1b75a3ae2c3ef45ad33 [0,1,0,0,0,0|1,0,2]=4 1541 B12R1.8 Cl/C=C\COCc1ccccn1 4d80f63b3f4c8db3b9cb10cbe63a708a [0,1,0,0,0,0|1,0,2]=4 1542 B12R1.8 ClC=CCOCc1ccccn1 1f9bc2b45798735e9adbb35ba690d905 [0,1,0,0,0,0|1,0,2]=4 1543 B12R1.8 ClCCCCNc1ccccc1 8d4b10d9b5325336494f2a30a6b84cc2 [0,1,0,0,0,0|2,0,0]=3 1544 B12R1.8 ClCCCCNc1ccccn1 91d68bf25a8019630edf3def244c8724 [0,1,0,0,0,0|1,0,0]=2 1545 B12R1.8 ClCCCCNc1cccnc1 b8f5fa4e5c888fdc44d8ce08412f3c22 [0,1,0,0,0,0|3,0,0]=4 1546 B12R1.8 ClCCCCNc1cccnn1 a36c29f91d16a6a3dabdb15dda9f33d0 [0,1,0,0,0,0|2,0,0]=3 1547 B12R1.8 ClCCCCNc1ccncc1 cb55373bcc657a348b8951479b216fc6 [0,1,0,0,0,0|3,0,0]=4 1548 B12R1.8 ClCCCCNc1ccncn1 bd318aeb63f919627fbe4450641f6881 [0,1,0,0,0,0|2,0,0]=3 1549 B12R1.8 ClCCCCNc1cnccn1 14b0d3342ec2a65f62af51dd30561fe9 [0,1,0,0,0,0|2,0,0]=3 1550 B12R1.8 ClCCCCNc1ncccn1 69c2af7800143120c1d629291cf2a2db [0,1,0,0,0,0|2,0,0]=3 1551 B12R1.8 ClCCCNCc1ccccc1 8f799c9e441fd632be62e26270cf2f35 [0,1,0,0,0,0|2,0,0]=3 1552 B12R1.8 ClCCCNCc1ccccn1 96ae9d70c035a2cbcba2fe24aaa3ffdc [0,1,0,0,0,0|1,0,0]=2 1553 B12R1.8 ClCCCNCc1cccnc1 fcf275c1364e995d69fad995850b6783 [0,1,0,0,0,0|3,0,0]=4 1554 B12R1.8 ClCCCNCc1cccnn1 816abbe5bf204583da9ba29b02b1134b [0,1,0,0,0,0|2,0,0]=3 1555 B12R1.8 ClCCCNCc1ccncn1 0b6ec2a56951c47b2bf518443349f81f [0,1,0,0,0,0|2,0,0]=3 1556 B12R1.8 ClCCCNCc1ncccn1 ab806f3fec78fde3376165a74241bb61 [0,1,0,0,0,0|2,0,0]=3 1557 B12R1.8 FCCCCNc1ccccc1 8c2145855632f0dc060333e90dbf6d6e [0,1,0,0,0,0|2,0,0]=3 1558 B12R1.8 FCCCCNc1ccccn1 3356af4d3cce46c847f383ba1fe33929 [0,1,0,0,0,0|1,0,0]=2 1559 B12R1.8 FCCCCNc1cccnc1 b306cc7c8a3a8e54e4f76d4c4c74a414 [0,1,0,0,0,0|3,0,0]=4 1560 B12R1.8 FCCCCNc1cccnn1 57e4bd40ea1d7447496afcb13e760434 [0,1,0,0,0,0|2,0,0]=3 1561 B12R1.8 FCCCCNc1ccncc1 17fb431f81c580930a43fc057d4535ce [0,1,0,0,0,0|3,0,0]=4 1562 B12R1.8 FCCCCNc1ccncn1 1f2a6b2446e503d4e5f516b26701fe5b [0,1,0,0,0,0|2,0,0]=3 1563 B12R1.8 FCCCCNc1cnccn1 4f01033bc5cb4349d9bf71be1b42a658 [0,1,0,0,0,0|2,0,0]=3 1564 B12R1.8 FCCCCNc1cnncn1 280a0d6a578243eb3903062b6ecd9875 [0,1,0,0,0,0|3,0,0]=4 1565 B12R1.8 FCCCCNc1ncccn1 0a9f0ff2e159bc594e64fa63e49f2e86 [0,1,0,0,0,0|2,0,0]=3 1566 B12R1.8 FCCCCNc1nccnn1 bced292dc5afae0ba83ad8689bcbac37 [0,1,0,0,0,0|3,0,0]=4 1567 B12R1.8 FCCCCNc1ncncn1 ce70f6e060b4bd6505655d68bd57601c [0,1,0,0,0,0|3,0,0]=4 1568 B12R1.8 FCCCCOc1ccccn1 e938132a19c063e02459ae67d61d9932 [0,1,0,0,0,0|1,0,0]=2 1569 B12R1.8 FCCCCOc1cccnc1 92a78db328bafeeb72a2e3ae6c8f7d1f [0,1,0,0,0,0|3,0,0]=4 1570 B12R1.8 FCCCCOc1ccncc1 221ca4fd54d414d4099f0fe213bb84d9 [0,1,0,0,0,0|3,0,0]=4 1571 B12R1.8 FCCCCOc1cnccn1 7cca7391400ddb5689ed1e44d4ed7ca4 [0,1,0,0,0,0|2,0,0]=3 1572 B12R1.8 FCCCCOc1cncnn1 0c871aad19feb034275983d7d36439c5 [0,1,0,0,0,0|3,0,0]=4 1573 B12R1.8 FCCCCOc1ncccn1 b421826be34ee99ab627d12faf1cc0dc [0,1,0,0,0,0|2,0,0]=3 1574 B12R1.8 FCCCNCc1ccccc1 6d1372e4372415cb5d41d01b1ced7571 [0,1,0,0,0,0|2,0,0]=3 1575 B12R1.8 FCCCNCc1ccccn1 bebe8fe2bd3d1beb1ac8cad20fd3191a [0,1,0,0,0,0|1,0,0]=2 1576 B12R1.8 FCCCNCc1cccnc1 3a0a9a1e19f91aff9afdabecf3e6a9e9 [0,1,0,0,0,0|3,0,0]=4 1577 B12R1.8 FCCCNCc1cccnn1 edaeb2670e474e61d2cb59a6504fe158 [0,1,0,0,0,0|2,0,0]=3 1578 B12R1.8 FCCCNCc1ccncc1 d030deda5d995fc17634727b2c2c397b [0,1,0,0,0,0|3,0,0]=4 1579 B12R1.8 FCCCNCc1ccncn1 1d59a101d24e226b37ff96c356606382 [0,1,0,0,0,0|2,0,0]=3 1580 B12R1.8 FCCCNCc1cnccn1 79c2a512e84fff9e976779db5ce45aaf [0,1,0,0,0,0|2,0,0]=3 1581 B12R1.8 FCCCNCc1ncccn1 899f61e3f87517916cbbae7094fa9a93 [0,1,0,0,0,0|2,0,0]=3 1582 B12R1.8 FCCCOCc1ccccc1 ec8c223bdd42642bcadc9c3ef97f9c25 [0,1,0,0,0,0|2,0,0]=3 1583 B12R1.8 FCCCOCc1ccccn1 528370285b3b5e280a7693ede1e62dba [0,1,0,0,0,0|1,0,0]=2 1584 B12R1.8 FCCCOCc1cccnc1 6f562313b06d2fd995c9386f7d544539 [0,1,0,0,0,0|3,0,0]=4 1585 B12R1.8 FCCCOCc1cccnn1 7fec7cf1c0594b1407ede55dd696f8b8 [0,1,0,0,0,0|2,0,0]=3 1586 B12R1.8 FCCCOCc1ccncc1 b7003999f3576cc06c45595be50b086d [0,1,0,0,0,0|3,0,0]=4 1587 B12R1.8 FCCCOCc1ccncn1 42d8c1159625f3bbd3f5345533fa1531 [0,1,0,0,0,0|2,0,0]=3 1588 B12R1.8 FCCCOCc1cnccn1 8794c08885b9401b20372aa9c4415f42 [0,1,0,0,0,0|2,0,0]=3 1589 B12R1.8 FCCCOCc1ncccn1 c29bfb342041d7f5a8a1ac19f78bd48e [0,1,0,0,0,0|2,0,0]=3 1590 B12R1.8 FCCNCCc1ccccc1 361355d651ba3401fa85cac238cfdb0b [0,1,0,0,0,0|2,0,0]=3 1591 B12R1.8 FCCNCCc1ccccn1 29c8a9f54fc2a477b50973596a269acb [0,1,0,0,0,0|1,0,0]=2 1592 B12R1.8 FCCNCCc1cccnc1 58b2ab7fc620968122c80079c047b73c [0,1,0,0,0,0|3,0,0]=4 1593 B12R1.8 FCCNCCc1ccncc1 3811375e5c5f5ffb86663c4d7bd351e7 [0,1,0,0,0,0|3,0,0]=4 1594 B12R1.8 FCCNCCc1ccncn1 1033eb899e8a9123c58a3ee267405b85 [0,1,0,0,0,0|2,0,0]=3 1595 B12R1.8 FCCNCCc1cnccn1 a1e37df5ad357c2fd50b62d8f0ce199c [0,1,0,0,0,0|2,0,0]=3 1596 B12R1.8 FCCNCCc1ncccn1 ac67052a15ad957177f9a91d35146648 [0,1,0,0,0,0|2,0,0]=3 1597 B12R1.8 FCCNCSc1ccccc1 b99d60c0fc5df8022ed05538b8ad6f86 [0,1,0,0,0,0|3,0,0]=4 1598 B12R1.8 FCCOCCc1ccccc1 3b5b20f3626d4389ca61c96c4166e57a [0,1,0,0,0,0|2,0,0]=3 1599 B12R1.8 FCCOCCc1ccccn1 656fc26896d540955c618d694ea4c322 [0,1,0,0,0,0|1,0,0]=2 1600 B12R1.8 FCCOCCc1cccnc1 957482671423f2e3d0589e435774cdc9 [0,1,0,0,0,0|3,0,0]=4 1601 B12R1.8 FCCOCCc1ccncc1 8f3402e3aabc7209bdcae575065e4e1c [0,1,0,0,0,0|3,0,0]=4 1602 B12R1.8 FCCOCCc1ccncn1 48aeec81c3b497e7d254b1c6ec46d51e [0,1,0,0,0,0|2,0,0]=3 1603 B12R1.8 FCCOCCc1cnccn1 f2f7c6a84c38a85148564be41afc3927 [0,1,0,0,0,0|2,0,0]=3 1604 B12R1.8 FCCOCCc1ncccn1 50045bd0e3ff889f53e25d7c9410181f [0,1,0,0,0,0|2,0,0]=3 1605 B12R1.8 FCNCCCc1ccccc1 36413a7a64ebaf0c06144ade57dac471 [0,1,0,0,0,0|2,0,0]=3 1606 B12R1.8 FCNCCCc1ccccn1 540e815b69c598f8c06e83b81e832380 [0,1,0,0,0,0|1,0,0]=2 1607 B12R1.8 FCNCCCc1cccnc1 14b609c05aa718f62169111db8c3db9d [0,1,0,0,0,0|3,0,0]=4 1608 B12R1.8 FCNCCCc1ccncc1 7f07567512e5a743ace3f4492421eca1 [0,1,0,0,0,0|3,0,0]=4 1609 B12R1.8 FCNCCOc1ccccc1 614b328619e3beb87099bb0fb4ee3fbb [0,1,0,0,0,0|3,0,0]=4 1610 B12R1.8 FCNCCOc1ccccn1 8fef6c9e6106f1034aa0e60b7ac4c87c [0,1,0,0,0,0|2,0,0]=3 1611 B12R1.8 FCOC/C=C/c1ccccn1 380d259ba986729daf278c6438aba24c [0,1,0,0,0,0|1,0,2]=4 1612 B12R1.8 FCOCC#Cc1ccccn1 1f9f4afc4ebf0e267d23470dd251d8f8 [0,1,0,0,0,0|1,0,2]=4 1613 B12R1.8 FCOCCCC1=CCC=CC1 1294cfccca94eb93dcc9ddacbc4f99bf [0,1,0,0,0,0|2,0,1]=4 1614 B12R1.8 FCOCCCc1ccccc1 337af886dc35840fb3b320f6a2c82837 [0,1,0,0,0,0|2,0,0]=3 1615 B12R1.8 FCOCCCc1ccccn1 2e559e01a296a0de86a304e4360dee8e [0,1,0,0,0,0|1,0,0]=2 1616 B12R1.8 FCOCCCc1cccnc1 f5369d800374823eaa516c7467969e5a [0,1,0,0,0,0|3,0,0]=4 1617 B12R1.8 FCOCCCc1ccncc1 466da5d2d1e40cb9128dbe68f0c0cf6c [0,1,0,0,0,0|3,0,0]=4 1618 B12R1.8 FCOCCCc1cnccn1 1acdc5c948d16d48f25b61dcd252d6d5 [0,1,0,0,0,0|2,0,0]=3 1619 B12R1.8 FCOCCCc1ncccn1 54706bbc33e999a8038b2346d9e3ee82 [0,1,0,0,0,0|2,0,0]=3 1620 B12R1.8 FCOCCOc1ccccc1 f1abda8c43f206c81b6519331a77e9c9 [0,1,0,0,0,0|3,0,0]=4 1621 B12R1.8 FCOCCSc1ccccc1 ccf72dbc5c74c757f9876ec0c6e08012 [0,1,0,0,0,0|3,0,0]=4 1622 B12R1.8 FCOCCSc1ccccn1 40bbc0f60728ea96d5ae43f17a068fff [0,1,0,0,0,0|2,0,0]=3 1623 B12R1.8 IC#CCOCc1ccccn1 f065381f636aef29e7ae6e14db8fd478 [0,1,0,0,0,0|1,0,2]=4 1624 B12R1.8 ICCNCCc1ccccc1 3d43af0eb4bc8ed1c19be50fd2591b44 [0,1,0,0,0,0|2,0,0]=3 1625 B12R1.8 ICCNCCc1ccccn1 3a2513367ab7cf9a5f37f82491c73a54 [0,1,0,0,0,0|1,0,0]=2 1626 B12R1.8 ICCNCCc1cccnc1 9a37b912cff3420349bcdd29b8da0796 [0,1,0,0,0,0|3,0,0]=4 1627 B12R1.8 ICCNCCc1ccncc1 693c40e0cf7891ad91fdd11c327b86d3 [0,1,0,0,0,0|3,0,0]=4 1628 B12R1.8 N#CCCCNc1ccccc1 b63d3fad690b955214294824bdee6b3a [0,1,0,0,0,0|2,0,1]=4 1629 B12R1.8 N#CCCCNc1ccccn1 7b9975779e2248387eea03c8b9a0d3d5 [0,1,0,0,0,0|1,0,1]=3 1630 B12R1.8 N#CCCCNc1cccnn1 2bf3c0793230fbcc42b675fd5a902962 [0,1,0,0,0,0|2,0,1]=4 1631 B12R1.8 N#CCCCNc1ccncn1 7c43f3695d94f3aa2a0ca673aa344d7c [0,1,0,0,0,0|2,0,1]=4 1632 B12R1.8 N#CCCCNc1cnccn1 91cb3f85751518c20648af5a0c6e9d47 [0,1,0,0,0,0|2,0,1]=4 1633 B12R1.8 N#CCCCNc1ncccn1 d52c0af668bb0051d21a3c39c05064ec [0,1,0,0,0,0|2,0,1]=4 1634 B12R1.8 N#CCCCOc1ccccn1 54d86eead3e87e3254bcacec6892070b [0,1,0,0,0,0|1,0,1]=3 1635 B12R1.8 N#CCCCOc1cnccn1 7c6f89adb296f105cfde30672e5c647e [0,1,0,0,0,0|2,0,1]=4 1636 B12R1.8 N#CCCCOc1ncccn1 431f01ce4c990db7d6f8fbd823b3d1d1 [0,1,0,0,0,0|2,0,1]=4 1637 B12R1.8 N#CCCNCc1ccccc1 4d72f08df781a4a97f9c75c6cad34723 [0,1,0,0,0,0|2,0,1]=4 1638 B12R1.8 N#CCCNCc1ccccn1 84562c84373ae0a4f2ec4ac5d995d569 [0,1,0,0,0,0|1,0,1]=3 1639 B12R1.8 N#CCCNCc1cccnn1 ae7eae43e12623470346f15e7248f487 [0,1,0,0,0,0|2,0,1]=4 1640 B12R1.8 N#CCCNCc1ccncn1 0419014e63869c11a38a568fc4c2d4d8 [0,1,0,0,0,0|2,0,1]=4 1641 B12R1.8 N#CCCNCc1cnccn1 d183bc2085d394054ebf0bb619064e5f [0,1,0,0,0,0|2,0,1]=4 1642 B12R1.8 N#CCCNCc1ncccn1 271a6093bba63cf7ad26bd6c7caac65b [0,1,0,0,0,0|2,0,1]=4 1643 B12R1.8 N#CCCOCc1ccccc1 ee4f67be7b7a1f02f3abb23db1d228e3 [0,1,0,0,0,0|2,0,1]=4 1644 B12R1.8 N#CCCOCc1ccccn1 8378ddb820596415e545c88dfc8ce857 [0,1,0,0,0,0|1,0,1]=3 1645 B12R1.8 N#CCCOCc1cccnn1 502c9e539e0542b80ac15a47bdaa3ee2 [0,1,0,0,0,0|2,0,1]=4 1646 B12R1.8 N#CCCOCc1ccncn1 59530c59b9f82780a63a7272c263a612 [0,1,0,0,0,0|2,0,1]=4 1647 B12R1.8 N#CCCOCc1cnccn1 e2377ec3f0b0aaa81fcdc796e7ac5cca [0,1,0,0,0,0|2,0,1]=4 1648 B12R1.8 N#CCCOCc1ncccn1 1958c3247462c30be1db071c4e0f7725 [0,1,0,0,0,0|2,0,1]=4 1649 B12R1.8 N#CCNCCc1ccccc1 196965f1ea9924e72f23b610f5ed5162 [0,1,0,0,0,0|2,0,1]=4 1650 B12R1.8 N#CCNCCc1ccccn1 163b09df21cb199dae55caf11c578544 [0,1,0,0,0,0|1,0,1]=3 1651 B12R1.8 N#CCNCCc1ccncn1 2d26a1c030f6629341c958ae72026151 [0,1,0,0,0,0|2,0,1]=4 1652 B12R1.8 N#CCNCCc1cnccn1 4d2ee91057972c6bc24d90c0f04dd017 [0,1,0,0,0,0|2,0,1]=4 1653 B12R1.8 N#CCNCCc1ncccn1 6804f2415cc34a797c92230b83c133c8 [0,1,0,0,0,0|2,0,1]=4 1654 B12R1.8 N#CCOCCc1ccccc1 f710fd753c514569a7e1cf024d236cec [0,1,0,0,0,0|2,0,1]=4 1655 B12R1.8 N#CCOCCc1ccccn1 bafea33941ce33ee97bd85bc178ec803 [0,1,0,0,0,0|1,0,1]=3 1656 B12R1.8 N#CCOCCc1ccncn1 b6832822bb637f965be004efa3f4dfa0 [0,1,0,0,0,0|2,0,1]=4 1657 B12R1.8 N#CCOCCc1cnccn1 a9feb7b5d615a0a1cce476e22891a04b [0,1,0,0,0,0|2,0,1]=4 1658 B12R1.8 N#CCOCCc1ncccn1 738c0e36bc4e69fb0a91524b39eefe73 [0,1,0,0,0,0|2,0,1]=4 1659 B12R1.8 N#CNCCCc1ccccc1 c15a86ec4727013e594da04c9a6943f6 [0,1,0,0,0,0|2,0,1]=4 1660 B12R1.8 N#CNCCCc1ccccn1 605e80d923f8e9ee00ace4725eaea567 [0,1,0,0,0,0|1,0,1]=3 1661 B12R1.8 N#CSCOCc1ccccn1 90dcd331da3484fae7a86033b3aa4d66 [0,1,0,0,0,0|2,0,1]=4 1662 B12R1.8 NOCCNCc1ccccc1 c44b16f502caeb4e0911ea1065c9b2b0 [0,1,0,0,0,0|3,0,0]=4 1663 B12R1.8 NOCCNCc1ccccn1 165a31a3ac0fc53401699a7491732285 [0,1,0,0,0,0|2,0,0]=3 1664 B12R1.8 NOCCNCc1cccnn1 8154812b76167235bdba7cd86b7dea16 [0,1,0,0,0,0|3,0,0]=4 1665 B12R1.8 NOCCNCc1ccncn1 cdc73443ae0425b205da6b8bc65eb0a6 [0,1,0,0,0,0|3,0,0]=4 1666 B12R1.8 NOCCNCc1ncccn1 ab1a3f1359ced66b27a92ea477de43d6 [0,1,0,0,0,0|3,0,0]=4 1667 B12R1.8 O/C=C\CNCc1ccccn1 697d371fb7988146e4e661e4ba711945 [0,1,0,0,0,0|1,0,2]=4 1668 B12R1.8 O=CCCCNc1ccccc1 2c85f0734b2940921a92b997758dfb5d [0,1,0,0,0,0|2,0,1]=4 1669 B12R1.8 O=CCCCNc1ccccn1 375fb3783e47017e4d61698f1246742e [0,1,0,0,0,0|1,0,1]=3 1670 B12R1.8 O=CCCCNc1cccnn1 07ad10457e2675490b5dd7e7b4b05c3e [0,1,0,0,0,0|2,0,1]=4 1671 B12R1.8 O=CCCCNc1ccncn1 46f2083dee13942f3b8e8cfac5a217a1 [0,1,0,0,0,0|2,0,1]=4 1672 B12R1.8 O=CCCCNc1cnccn1 5690460597e018b6259e8b67e882b4be [0,1,0,0,0,0|2,0,1]=4 1673 B12R1.8 O=CCCCNc1ncccn1 3198bdaa61596b69b727edf6efeadd0d [0,1,0,0,0,0|2,0,1]=4 1674 B12R1.8 O=CCCCOc1ccccn1 8f20a04e1a00678c31945d8e4b63032d [0,1,0,0,0,0|1,0,1]=3 1675 B12R1.8 O=CCCCOc1cnccn1 1a8740609212e7f2402a92ee72eaa6b7 [0,1,0,0,0,0|2,0,1]=4 1676 B12R1.8 O=CCCCOc1ncccn1 0446bf996fe88d5cbad931caa63cd847 [0,1,0,0,0,0|2,0,1]=4 1677 B12R1.8 O=CCCNCc1ccccc1 c74469b4a98525e28c41fd68e9d4e654 [0,1,0,0,0,0|2,0,1]=4 1678 B12R1.8 O=CCCNCc1ccccn1 2928127fee0430861fe18b9de93f9724 [0,1,0,0,0,0|1,0,1]=3 1679 B12R1.8 O=CCCNCc1cccnn1 d7f737877ab1782611c3b728a3f190ba [0,1,0,0,0,0|2,0,1]=4 1680 B12R1.8 O=CCCNCc1ccncn1 8e1da5545e7ea3eadabd23551f0d7552 [0,1,0,0,0,0|2,0,1]=4 1681 B12R1.8 O=CCCNCc1cnccn1 acb3eb76a659ea8269c4b2f0641aa436 [0,1,0,0,0,0|2,0,1]=4 1682 B12R1.8 O=CCCNCc1ncccn1 0bca1abe63e9d25593500a1ba1017ff3 [0,1,0,0,0,0|2,0,1]=4 1683 B12R1.8 O=CCCOCc1ccccc1 ac3f888cccae65d1996a84a27a558161 [0,1,0,0,0,0|2,0,1]=4 1684 B12R1.8 O=CCCOCc1ccccn1 452c44763d9f43cf0876ba3272ee4abb [0,1,0,0,0,0|1,0,1]=3 1685 B12R1.8 O=CCCOCc1cccnn1 4ee1b637d9d8e5afb721db309ba84904 [0,1,0,0,0,0|2,0,1]=4 1686 B12R1.8 O=CCCOCc1ccncn1 12e3346750fcb07ed17d8037ccf6cfee [0,1,0,0,0,0|2,0,1]=4 1687 B12R1.8 O=CCCOCc1cnccn1 16e1a357468025e922c9517098e0fdbb [0,1,0,0,0,0|2,0,1]=4 1688 B12R1.8 O=CCCOCc1ncccn1 9693bfbe3ec3953af39f6d97c29773df [0,1,0,0,0,0|2,0,1]=4 1689 B12R1.8 O=CCNCCc1ccccc1 7b8a13082bcfdef296ce3280285f19f6 [0,1,0,0,0,0|2,0,1]=4 1690 B12R1.8 O=CCNCCc1ccccn1 2ac86c7ddc23dc7a650d74729fdd57a5 [0,1,0,0,0,0|1,0,1]=3 1691 B12R1.8 O=CCNCCc1ccncn1 2029b0d05764242ee454489b06199806 [0,1,0,0,0,0|2,0,1]=4 1692 B12R1.8 O=CCNCCc1cnccn1 982e0c31b97f5dd452015067e991da34 [0,1,0,0,0,0|2,0,1]=4 1693 B12R1.8 O=CCNCCc1ncccn1 163cd7d6b75b440118565dc84573c62f [0,1,0,0,0,0|2,0,1]=4 1694 B12R1.8 O=CCOCCc1ccccc1 2441de9de85249e6953e55d007d8182d [0,1,0,0,0,0|2,0,1]=4 1695 B12R1.8 O=CCOCCc1ccccn1 0361d1c3b5a1b9e1a7dbd5d2dbfa21cd [0,1,0,0,0,0|1,0,1]=3 1696 B12R1.8 O=CCOCCc1ccncn1 26aa8422f214298cceb729eafc5e748d [0,1,0,0,0,0|2,0,1]=4 1697 B12R1.8 O=CCOCCc1cnccn1 d1a156923fa243fa3e5a73ec915203c4 [0,1,0,0,0,0|2,0,1]=4 1698 B12R1.8 O=CCOCCc1ncccn1 5b24bc3455d7be677b74a9d0b3768327 [0,1,0,0,0,0|2,0,1]=4 1699 B12R1.8 O=CNCCCc1ccccc1 538cecde6b0a6e38513d6c405409a280 [0,1,0,0,0,0|2,0,1]=4 1700 B12R1.8 O=CNCCCc1ccccn1 20faf153a86b580fc193b19310f729ce [0,1,0,0,0,0|1,0,1]=3 1701 B12R1.8 O=CNCCOc1ccccn1 0281c382297bab2e1965a1016d553623 [0,1,0,0,0,0|2,0,1]=4 1702 B12R1.8 OCC#CCNc1ccccn1 a1e4d08fb97b6b870b7b56c84c9d5091 [0,1,0,0,0,0|1,0,2]=4 1703 B12R1.8 OCCCCNc1ccccc1 2154e665ebfa9ee647e239d5a23b3bbd [0,1,0,0,0,0|2,0,0]=3 1704 B12R1.8 OCCCCNc1ccccn1 13b989e40aa07edcb6de17c9446b591d [0,1,0,0,0,0|1,0,0]=2 1705 B12R1.8 OCCCCNc1cccnc1 27a79c461a1ee6618a6e7fe3cc1d992b [0,1,0,0,0,0|3,0,0]=4 1706 B12R1.8 OCCCCNc1cccnn1 4a4bc79ec6e5b87bdf4bd521b21662e9 [0,1,0,0,0,0|2,0,0]=3 1707 B12R1.8 OCCCCNc1ccncc1 39bc0436bd73ae73ff6d2c17ccd5c512 [0,1,0,0,0,0|3,0,0]=4 1708 B12R1.8 OCCCCNc1ccncn1 48317a0aaf203e9571bbbd2e1d32e0de [0,1,0,0,0,0|2,0,0]=3 1709 B12R1.8 OCCCCNc1cnccn1 a8d2b7c51175e217473c939acc3ecfae [0,1,0,0,0,0|2,0,0]=3 1710 B12R1.8 OCCCCNc1cnncn1 2b2ff40926ed937312795aeb9a4da714 [0,1,0,0,0,0|3,0,0]=4 1711 B12R1.8 OCCCCNc1ncccn1 d96b7c1033abf7030424d2088537b99f [0,1,0,0,0,0|2,0,0]=3 1712 B12R1.8 OCCCCNc1nccnn1 4cbfd7467d3ce551f47450ef55d824b0 [0,1,0,0,0,0|3,0,0]=4 1713 B12R1.8 OCCCCNc1ncncn1 87e6680a222cb6c5ecc6ac3a4cb19e12 [0,1,0,0,0,0|3,0,0]=4 1714 B12R1.8 OCCCNCc1ccccc1 1f43a365b69733d9fd54c3f1367679b4 [0,1,0,0,0,0|2,0,0]=3 1715 B12R1.8 OCCCNCc1ccccn1 2db74cd30f61e8e3f9c52c7133bf4507 [0,1,0,0,0,0|1,0,0]=2 1716 B12R1.8 OCCCNCc1cccnc1 b48c3c866d05056f01b31ecc1dce4b1c [0,1,0,0,0,0|3,0,0]=4 1717 B12R1.8 OCCCNCc1cccnn1 a312adbfb55a4df0b5a28a0696338a2a [0,1,0,0,0,0|2,0,0]=3 1718 B12R1.8 OCCCNCc1ccncc1 66e831e14b2dc2dae28ad5f265bc1c0f [0,1,0,0,0,0|3,0,0]=4 1719 B12R1.8 OCCCNCc1ccncn1 8318ec2c75509e4836fa7079b73ea2bb [0,1,0,0,0,0|2,0,0]=3 1720 B12R1.8 OCCCNCc1cnccn1 8ab70361acb42f3be57a58e304209fd3 [0,1,0,0,0,0|2,0,0]=3 1721 B12R1.8 OCCCNCc1ncccn1 99082d096c0eafd52f20c6e5b477b288 [0,1,0,0,0,0|2,0,0]=3 1722 B12R1.8 OCCNCCc1ccccc1 6832b0d8880be8700c4d8c29ed63036c [0,1,0,0,0,0|2,0,0]=3 1723 B12R1.8 OCCNCCc1ccccn1 192e21053d8ac918db362a708882a85e [0,1,0,0,0,0|1,0,0]=2 1724 B12R1.8 OCCNCCc1cccnc1 5891d48f724f9c6f3ad1caf0a25a85fd [0,1,0,0,0,0|3,0,0]=4 1725 B12R1.8 OCCNCCc1ccncc1 b842232cc5675331ff05fecfcbf14339 [0,1,0,0,0,0|3,0,0]=4 1726 B12R1.8 OCCNCCc1ccncn1 821a2a913516f407477e46762ca3ff25 [0,1,0,0,0,0|2,0,0]=3 1727 B12R1.8 OCCNCCc1cnccn1 66c83a33710541ada8eae5b6545f4ea1 [0,1,0,0,0,0|2,0,0]=3 1728 B12R1.8 OCCNCCc1ncccn1 c77f116cf00efa0a4f072dd47e42b289 [0,1,0,0,0,0|2,0,0]=3 1729 B12R1.8 OCCNCSc1ccccc1 973e07915013e23c41bc74a1aa466e19 [0,1,0,0,0,0|3,0,0]=4 1730 B12R1.8 OCNCCCc1ccccc1 4af827ec2909e74315445a370a932107 [0,1,0,0,0,0|2,0,0]=3 1731 B12R1.8 OCNCCCc1ccccn1 b4b77985940d9e7029052ba013ff39f2 [0,1,0,0,0,0|1,0,0]=2 1732 B12R1.8 OCNCCCc1cccnc1 5d17832d95f3d6e1e2dbe7e755d7ff68 [0,1,0,0,0,0|3,0,0]=4 1733 B12R1.8 OCNCCCc1ccncc1 fa6c58ba5a5ca30c3e77a7d188a18ade [0,1,0,0,0,0|3,0,0]=4 1734 B12R1.8 OCNCCOc1ccccc1 641239c62160a991f896e082b9cc08e2 [0,1,0,0,0,0|3,0,0]=4 1735 B12R1.8 OCNCCOc1ccccn1 06ebb48d83e2a20777eb8509019ff344 [0,1,0,0,0,0|2,0,0]=3 1736 B12R1.8 SCCCCNc1ccccc1 ed2d9d7f95071d0803e58eb2622dd581 [0,1,0,0,0,0|2,0,0]=3 1737 B12R1.8 SCCCCNc1ccccn1 8db86b31e92529d8508911c90bd3155e [0,1,0,0,0,0|1,0,0]=2 1738 B12R1.8 SCCCCNc1cccnc1 1a880ae57e783a38d52938eda41c5ac3 [0,1,0,0,0,0|3,0,0]=4 1739 B12R1.8 SCCCCNc1cccnn1 b6cf4f52cd5f8d1e25b5720efe0f3f6d [0,1,0,0,0,0|2,0,0]=3 1740 B12R1.8 SCCCCNc1ccncc1 ec85506b4432e39a7976426b643d3271 [0,1,0,0,0,0|3,0,0]=4 1741 B12R1.8 SCCCCNc1ccncn1 6229c559e8f85a8fcddd551d6b5fa3e8 [0,1,0,0,0,0|2,0,0]=3 1742 B12R1.8 SCCCNCc1ccccc1 66312e7d4ce4f899347700206744a721 [0,1,0,0,0,0|2,0,0]=3 1743 B12R1.8 SCCCNCc1ccccn1 bc507d54c38f34dd3e4362708255f752 [0,1,0,0,0,0|1,0,0]=2 1744 B12R1.8 SCCCNCc1cccnc1 f92b68cac5fbfc6a7a8fb20332d0deca [0,1,0,0,0,0|3,0,0]=4 1745 B12R1.8 SCCCNCc1cccnn1 5c8290276f103d313b60ecf5988a9817 [0,1,0,0,0,0|2,0,0]=3 1746 B12R1.8 SCCCNCc1ccncc1 930f1152ea81b6ce28440b05e77d9e15 [0,1,0,0,0,0|3,0,0]=4 1747 B12R1.8 SCCCNCc1ccncn1 ee884c438a1e04d8c4cb423df8962a85 [0,1,0,0,0,0|2,0,0]=3 1748 B12R1.8 SCCCNCc1cnccn1 0dc2e42f6b4baa1a8039b764d27b4be3 [0,1,0,0,0,0|2,0,0]=3 1749 B12R1.8 SCCCNCc1ncccn1 084fbb55705de04228b4765ef0829af9 [0,1,0,0,0,0|2,0,0]=3 1750 B12R1.8 SCCCOCc1ccccc1 a40983423638d779f7a71c708a989b8f [0,1,0,0,0,0|2,0,0]=3 1751 B12R1.8 SCCCOCc1ccccn1 89b32eb12d51f5c6bc232ac75f5b9e1c [0,1,0,0,0,0|1,0,0]=2 1752 B12R1.8 SCCCOCc1cccnc1 29020307926ad4edbc3f8479d71e5a01 [0,1,0,0,0,0|3,0,0]=4 1753 B12R1.8 SCCCOCc1cccnn1 4481546e138c90308cffb357cbd49022 [0,1,0,0,0,0|2,0,0]=3 1754 B12R1.8 SCCCOCc1ccncc1 292b1f66d09671e748170d605ae04b81 [0,1,0,0,0,0|3,0,0]=4 1755 B12R1.8 SCCCOCc1ccncn1 b0a941afa1b269401211622f666291bd [0,1,0,0,0,0|2,0,0]=3 1756 B12R1.8 SCCCOCc1cnccn1 f9546e4ce542fc8673ca98c29e80acaf [0,1,0,0,0,0|2,0,0]=3 1757 B12R1.8 SCCCOCc1ncccn1 1a107052fa451da460e89461cf4fa7a7 [0,1,0,0,0,0|2,0,0]=3 1758 B12R1.8 SCCNCCc1ccccc1 77f9cf13a4d370b17f1b8a888b3044b3 [0,1,0,0,0,0|2,0,0]=3 1759 B12R1.8 SCCNCCc1ccccn1 ee52ad5cacea42a063542560ca02c6c5 [0,1,0,0,0,0|1,0,0]=2 1760 B12R1.8 SCCNCCc1cccnc1 f05b013db913ccc909ff89417846b387 [0,1,0,0,0,0|3,0,0]=4 1761 B12R1.8 SCCNCCc1ccncc1 ccb9121d287104528c39ff9698fecd48 [0,1,0,0,0,0|3,0,0]=4 1762 B12R1.8 SCCNCCc1ccncn1 e0db423eea418a3d095d18c1b0b2937d [0,1,0,0,0,0|2,0,0]=3 1763 B12R1.8 SCCNCCc1cnccn1 a028c8756951e1926d48e9b8916e556e [0,1,0,0,0,0|2,0,0]=3 1764 B12R1.8 SCCNCCc1ncccn1 7b3e288dbd82d45649850117ea5933aa [0,1,0,0,0,0|2,0,0]=3 1765 B12R1.8 SCCOCCc1ccccc1 622b11be5805e98ac28331a5544396fa [0,1,0,0,0,0|2,0,0]=3 1766 B12R1.8 SCCOCCc1ccccn1 820fc7c612ac0b816564f27a6a32eeec [0,1,0,0,0,0|1,0,0]=2 1767 B12R1.8 SCCOCCc1cccnc1 25c35e21ef3282518885c7aefe7967bd [0,1,0,0,0,0|3,0,0]=4 1768 B12R1.8 SCCOCCc1ccncc1 8cfdbbc980fddb3908df97d939253c99 [0,1,0,0,0,0|3,0,0]=4 1769 B12R1.8 SCCOCCc1ccncn1 37d4d60151c9b43d6c1039a8fea54f51 [0,1,0,0,0,0|2,0,0]=3 1770 B12R1.8 SCCOCCc1cnccn1 905f6f0a986510af20c208e3d896fdee [0,1,0,0,0,0|2,0,0]=3 1771 B12R1.8 SCCOCCc1ncccn1 0b0b23bd933e93d7832f3287ded9ee9d [0,1,0,0,0,0|2,0,0]=3 1772 B12R1.27 BrCC(Br)CNc1ccccc1 e7e12b5e4c30a5d2720e1014017ec37c [0,1,0,0,0,0|3,0,0]=4 1773 B12R1.27 BrCC(Br)CNc1ccccn1 f6cf2089bf10aa602d3cdacac7c9d312 [0,1,0,0,0,0|2,0,0]=3 1774 B12R1.27 BrCC(Br)CNc1cccnn1 056ad6b7cf3fc14ad663c6de04924ee3 [0,1,0,0,0,0|3,0,0]=4 1775 B12R1.27 BrCC(Br)CNc1ccncn1 92b2ab76716d23aff403fa3f4fc02055 [0,1,0,0,0,0|3,0,0]=4 1776 B12R1.27 BrCC(Br)CNc1cnccn1 1f184251eec548e9e3933b2f4153f491 [0,1,0,0,0,0|3,0,0]=4 1777 B12R1.27 C#CC(C)NCc1ccccn1 ad6b1fb21ba096ea477c4ba3a68283ca [0,1,0,0,0,0|1,0,2]=4 1778 B12R1.27 C#CC(C)OCc1ccccn1 903ee5413328087e012403be2a6f9a74 [0,1,0,0,0,0|1,0,2]=4 1779 B12R1.27 C#C[C@@H](C)NCc1ccccn1 4d1c127dd42610df5076aa2ebacb008d [0,1,0,0,0,0|1,0,2]=4 1780 B12R1.27 C#C[C@@H](C)OCc1ccccn1 04d0f33658cd73c944a5f8ac187b6720 [0,1,0,0,0,0|1,0,2]=4 1781 B12R1.27 C#C[C@H](C)NCc1ccccn1 decfdb3d020b9f8f1748be500b3d3e94 [0,1,0,0,0,0|1,0,2]=4 1782 B12R1.27 C#C[C@H](C)OCc1ccccn1 194393544ea69e88ea521cbd4a133ce5 [0,1,0,0,0,0|1,0,2]=4 1783 B12R1.27 C=C(CC)CNc1ccccc1 109c052abdb53f9ddab28ed347d98fd8 [0,1,0,0,0,0|2,0,1]=4 1784 B12R1.27 C=C(CC)CNc1ccccn1 269fffb91f576e6b2d02d6dbae013f37 [0,1,0,0,0,0|1,0,1]=3 1785 B12R1.27 C=C(CC)CNc1cccnn1 e1d2ec16cda503098415277bea441d76 [0,1,0,0,0,0|2,0,1]=4 1786 B12R1.27 C=C(CC)CNc1ccncn1 a01d13e68779ed01e3757e601862d086 [0,1,0,0,0,0|2,0,1]=4 1787 B12R1.27 C=C(CC)CNc1cnccn1 6bbfe48cc97b4c42b75b1cad162d3ca8 [0,1,0,0,0,0|2,0,1]=4 1788 B12R1.27 C=C(CC)CNc1ncccn1 6d883986048660f0544ebeb5afff2786 [0,1,0,0,0,0|2,0,1]=4 1789 B12R1.27 C=C(CC)COc1ccccn1 fcb5a49cd024de94d9cb7e17b7984e9f [0,1,0,0,0,0|1,0,1]=3 1790 B12R1.27 C=C(CC)COc1cnccn1 f2a4723e5829985c27a65252e3778fac [0,1,0,0,0,0|2,0,1]=4 1791 B12R1.27 C=C(CC)COc1ncccn1 9d068d83207b5ea4be691b62e436672b [0,1,0,0,0,0|2,0,1]=4 1792 B12R1.27 C=C(CNc1ccccn1)OC 3de7e001df09be3a86b7985205b8d232 [0,1,0,0,0,0|2,0,1]=4 1793 B12R1.27 C=C(CO)CNc1ccccn1 6105decc4fd535ea60914c586543371b [0,1,0,0,0,0|2,0,1]=4 1794 B12R1.27 C=C(COc1ccccn1)OC a43bd483ae573d6cfa4f8d7b75d98ff8 [0,1,0,0,0,0|2,0,1]=4 1795 B12R1.27 C=CC(C)NCc1ccccn1 c2585ccce6fd2359aaa73835bf2cf65d [0,1,0,0,0,0|1,0,2]=4 1796 B12R1.27 C=CC(C)OCc1ccccn1 bbdfd69ebb8ab53913fa15d4b2825809 [0,1,0,0,0,0|1,0,2]=4 1797 B12R1.27 C=CC(O)CNc1ccccn1 38bb823f312b98d5691f547d82dd5a59 [0,1,0,0,0,0|1,0,2]=4 1798 B12R1.27 C=C[C@H](C)OCc1ccccn1 9eb6fc20ae0d5afdfad18379d27f9f8b [0,1,0,0,0,0|1,0,2]=4 1799 B12R1.27 CC(C#N)CNc1ccccn1 0fc32d740ad406a6dc426ede3076b193 [0,1,0,0,0,0|2,0,1]=4 1800 B12R1.27 CC(C#N)COc1ccccn1 ba403bd0c82629b664b7888c6e2df195 [0,1,0,0,0,0|2,0,1]=4 1801 B12R1.27 CC(C#N)NCc1ccccn1 c49f40e61428cbf5316185f700db1db6 [0,1,0,0,0,0|2,0,1]=4 1802 B12R1.27 CC(C=O)NCc1ccccn1 0951a0ee01d1b16bb17c0f8e58213b1e [0,1,0,0,0,0|2,0,1]=4 1803 B12R1.27 CC(C=O)OCc1ccccn1 1cd8eadb46df6e59cb4a04a39c1e77c7 [0,1,0,0,0,0|2,0,1]=4 1804 B12R1.27 CC(CF)OCc1ccccc1 c18da580e3dabe7992624a35c25d53e8 [0,1,0,0,0,0|3,0,0]=4 1805 B12R1.27 CC(CF)OCc1ccccn1 0d7b7c864206636c9235d181d09d6b15 [0,1,0,0,0,0|2,0,0]=3 1806 B12R1.27 CC(CF)OCc1cccnn1 2c6b5889e411e9f53b3bd7e4e48410da [0,1,0,0,0,0|3,0,0]=4 1807 B12R1.27 CC(CF)OCc1ccncn1 7eb50aaf117aa7f61d2941f6dd6c4fce [0,1,0,0,0,0|3,0,0]=4 1808 B12R1.27 CC(CF)OCc1ncccn1 efeafcf08dded6fb6ac0d0bf6fb697f6 [0,1,0,0,0,0|3,0,0]=4 1809 B12R1.27 CC(CO)CNc1ccccc1 f07a32871260f72c2fb2363a7f611104 [0,1,0,0,0,0|3,0,0]=4 1810 B12R1.27 CC(CO)CNc1ccccn1 9228158f05cdce3bcf2332746a0d5a23 [0,1,0,0,0,0|2,0,0]=3 1811 B12R1.27 CC(CO)CNc1cccnn1 98d1904fab5d41362a075c11e1efa1aa [0,1,0,0,0,0|3,0,0]=4 1812 B12R1.27 CC(CO)CNc1ccncn1 b45c3d5b1659b474c15fccd6fbedf12a [0,1,0,0,0,0|3,0,0]=4 1813 B12R1.27 CC(CO)CNc1cnccn1 4467f0cfd9c9dbc876a653a533aa52f9 [0,1,0,0,0,0|3,0,0]=4 1814 B12R1.27 CC(CO)CNc1ncccn1 201c3fb44aebb48ac9014ffccfbfbea5 [0,1,0,0,0,0|3,0,0]=4 1815 B12R1.27 CC(CO)NCc1ccccc1 8f2e7b2c99e7f1ec8ee06bbaf841b37c [0,1,0,0,0,0|3,0,0]=4 1816 B12R1.27 CC(CO)NCc1ccccn1 dc606027ab1cf21842521e3cd6aab041 [0,1,0,0,0,0|2,0,0]=3 1817 B12R1.27 CC(CO)NCc1cccnn1 c0ae66a6706b4b09ae7fbfdd61df0b00 [0,1,0,0,0,0|3,0,0]=4 1818 B12R1.27 CC(CO)NCc1ccncn1 eeb32be9623ececc3cd1b1108d4a73d9 [0,1,0,0,0,0|3,0,0]=4 1819 B12R1.27 CC(CO)NCc1cnccn1 c4d9086c3d359aa0fead8d59b651d860 [0,1,0,0,0,0|3,0,0]=4 1820 B12R1.27 CC(CO)NCc1ncccn1 837e97a48ad085370e6b0d812fd567c5 [0,1,0,0,0,0|3,0,0]=4 1821 B12R1.27 CC(CS)OCc1ccccc1 bf9173a456888d57225f0e1203a32c5e [0,1,0,0,0,0|3,0,0]=4 1822 B12R1.27 CC(CS)OCc1ccccn1 d5c25dfa8bcef5c73ff7d0ae8229ced9 [0,1,0,0,0,0|2,0,0]=3 1823 B12R1.27 CC(CS)OCc1cccnn1 a0872fdb6d741d866e92a6ca3a80681f [0,1,0,0,0,0|3,0,0]=4 1824 B12R1.27 CC(CS)OCc1ccncn1 6bc0b1ad4d781f68d45af34f251458c6 [0,1,0,0,0,0|3,0,0]=4 1825 B12R1.27 CC(CS)OCc1ncccn1 ae0239a16957c280a40779b5f9f2f28f [0,1,0,0,0,0|3,0,0]=4 1826 B12R1.27 CCC(=O)CNc1ccccc1 8a00a9b87cff2992f22bb204b9e2670f [0,1,0,0,0,0|2,0,1]=4 1827 B12R1.27 CCC(=O)CNc1ccccn1 2d342bf045411702eec8a271afb524c7 [0,1,0,0,0,0|1,0,1]=3 1828 B12R1.27 CCC(=O)CNc1cccnn1 09b904cf943697c5703e114041cabbf6 [0,1,0,0,0,0|2,0,1]=4 1829 B12R1.27 CCC(=O)CNc1ccncn1 e4c52c9ff455e6b380bac7fcc3f8e44c [0,1,0,0,0,0|2,0,1]=4 1830 B12R1.27 CCC(=O)CNc1cnccn1 30c805bc62fa93daf99bb4c03fccefb8 [0,1,0,0,0,0|2,0,1]=4 1831 B12R1.27 CCC(=O)CNc1ncccn1 0845f5d0456fa052751eabf2f2f8fbcc [0,1,0,0,0,0|2,0,1]=4 1832 B12R1.27 CCC(=O)COc1ccccn1 3a724b1bda77ee3c2eba66bde7c3ebc1 [0,1,0,0,0,0|1,0,1]=3 1833 B12R1.27 CCC(=O)COc1cnccn1 811f6d4b56accd6810554b3263423de3 [0,1,0,0,0,0|2,0,1]=4 1834 B12R1.27 CCC(=O)COc1ncccn1 5b52ba885c4d20858431b1b0ed1b74df [0,1,0,0,0,0|2,0,1]=4 1835 B12R1.27 CCC(=O)NCc1ccccc1 cd109163e80059e2763660343f9dbe36 [0,1,0,0,0,0|2,0,1]=4 1836 B12R1.27 CCC(=O)NCc1ccccn1 8feeaaa17ff0b8e92392e088c3f6feb2 [0,1,0,0,0,0|1,0,1]=3 1837 B12R1.27 CCC(=O)NCc1cccnn1 1483b94e7eca014cbe2ad2c78a20b994 [0,1,0,0,0,0|2,0,1]=4 1838 B12R1.27 CCC(=O)NCc1ccncn1 88b81439885ea8cff5a8958cb1bb43ac [0,1,0,0,0,0|2,0,1]=4 1839 B12R1.27 CCC(=O)NCc1cnccn1 9cdf4761dd5db2a2596b884b42c64499 [0,1,0,0,0,0|2,0,1]=4 1840 B12R1.27 CCC(=O)NCc1ncccn1 d392902d20140819a273d44b32cc0be2 [0,1,0,0,0,0|2,0,1]=4 1841 B12R1.27 CCC(C)CNc1ccccc1 fb8ee4288bf8853fd57c8a217184507f [0,1,0,0,0,0|2,0,0]=3 1842 B12R1.27 CCC(C)CNc1ccccn1 6f2b4521dfa3e14ebf77bc9e288b8c6c [0,1,0,0,0,0|1,0,0]=2 1843 B12R1.27 CCC(C)CNc1cccnc1 799d2535ec95c75adc3efc07c94a55e6 [0,1,0,0,0,0|3,0,0]=4 1844 B12R1.27 CCC(C)CNc1cccnn1 fe60a93e339912dde949c52c81965e44 [0,1,0,0,0,0|2,0,0]=3 1845 B12R1.27 CCC(C)CNc1ccncc1 1d114bdb53eb8bc5873d9cc0853c5acf [0,1,0,0,0,0|3,0,0]=4 1846 B12R1.27 CCC(C)CNc1ccncn1 0030485c0ff4d5483f8ba9ed97ccde88 [0,1,0,0,0,0|2,0,0]=3 1847 B12R1.27 CCC(C)CNc1cnccn1 3cf63567314cf83ced5941a4b5546fbb [0,1,0,0,0,0|2,0,0]=3 1848 B12R1.27 CCC(C)CNc1cnncn1 6d72a6f9e1301c8ce1098ad663d57751 [0,1,0,0,0,0|3,0,0]=4 1849 B12R1.27 CCC(C)CNc1ncccn1 497fd02a45b5f50f2e8db83a730bdce0 [0,1,0,0,0,0|2,0,0]=3 1850 B12R1.27 CCC(C)CNc1nccnn1 57f3d440302fc8184936cfcffe3767dd [0,1,0,0,0,0|3,0,0]=4 1851 B12R1.27 CCC(C)CNc1ncncn1 82a79ccfb4ad166dc812093c7248e456 [0,1,0,0,0,0|3,0,0]=4 1852 B12R1.27 CCC(C)COc1ccccn1 068a7be24dc7922a67d6964a1394c7d6 [0,1,0,0,0,0|1,0,0]=2 1853 B12R1.27 CCC(C)COc1cccnc1 0c32f61d8566e65294b7d65adcb5b70b [0,1,0,0,0,0|3,0,0]=4 1854 B12R1.27 CCC(C)COc1ccncc1 60b90e0040b7a2f08da03a263d76f7dc [0,1,0,0,0,0|3,0,0]=4 1855 B12R1.27 CCC(C)COc1cnccn1 c288149b64550ff633a3f83434c9440a [0,1,0,0,0,0|2,0,0]=3 1856 B12R1.27 CCC(C)COc1cncnn1 c83a8d8b5fd62552650db277a1811352 [0,1,0,0,0,0|3,0,0]=4 1857 B12R1.27 CCC(C)COc1ncccn1 91b15bfc3cf8a97e2d4d562bae36eb9d [0,1,0,0,0,0|2,0,0]=3 1858 B12R1.27 CCC(C)NCc1ccccc1 ab8df84230779f2ea3e6a09700944eac [0,1,0,0,0,0|2,0,0]=3 1859 B12R1.27 CCC(C)NCc1ccccn1 600531c2c0367b3cbfd9810ef9c18666 [0,1,0,0,0,0|1,0,0]=2 1860 B12R1.27 CCC(C)NCc1cccnc1 03aa38772555301826d5e6a7450f6276 [0,1,0,0,0,0|3,0,0]=4 1861 B12R1.27 CCC(C)NCc1cccnn1 e88f67ed586eb144bc95e5bd7bcb62fb [0,1,0,0,0,0|2,0,0]=3 1862 B12R1.27 CCC(C)NCc1ccncc1 8f2ef9d0f5df7ed3c4b3d292b12e10fb [0,1,0,0,0,0|3,0,0]=4 1863 B12R1.27 CCC(C)NCc1ccncn1 01397d606cc3fffc348ba55c505e4e14 [0,1,0,0,0,0|2,0,0]=3 1864 B12R1.27 CCC(C)NCc1cnccn1 a0930806765eb19590abfca69771946b [0,1,0,0,0,0|2,0,0]=3 1865 B12R1.27 CCC(C)NCc1ncccn1 8df2592374dc9d99b6917404fbb9e793 [0,1,0,0,0,0|2,0,0]=3 1866 B12R1.27 CCC(C)OCc1ccccc1 ecd56e0e8d83f20f8ba3d53f4367b277 [0,1,0,0,0,0|2,0,0]=3 1867 B12R1.27 CCC(C)OCc1ccccn1 cdbc114ff1e98274e0c76d4efba7fd19 [0,1,0,0,0,0|1,0,0]=2 1868 B12R1.27 CCC(C)OCc1cccnc1 48e9afbe8701af90763c0a4646314a57 [0,1,0,0,0,0|3,0,0]=4 1869 B12R1.27 CCC(C)OCc1cccnn1 931286049d3813ef6a988d4bb07d95ff [0,1,0,0,0,0|2,0,0]=3 1870 B12R1.27 CCC(C)OCc1ccncc1 a48ab0f470a95fc03f35a49430e127c9 [0,1,0,0,0,0|3,0,0]=4 1871 B12R1.27 CCC(C)OCc1ccncn1 e6dd96fe0be9c443333ddd94f3b52c38 [0,1,0,0,0,0|2,0,0]=3 1872 B12R1.27 CCC(C)OCc1cnccn1 989f83298573eea5a35c1e5bc64dd4aa [0,1,0,0,0,0|2,0,0]=3 1873 B12R1.27 CCC(C)OCc1ncccn1 38a703d49d9020f50edd3359d9d3a942 [0,1,0,0,0,0|2,0,0]=3 1874 B12R1.27 CCC(O)CNc1ccccc1 3a32ac0a6b49d877750df15cf382268b [0,1,0,0,0,0|2,0,0]=3 1875 B12R1.27 CCC(O)CNc1ccccn1 6864d6686de3983b3129898abd14e11f [0,1,0,0,0,0|1,0,0]=2 1876 B12R1.27 CCC(O)CNc1cccnc1 5ec705eaa989393421bbf1121531428c [0,1,0,0,0,0|3,0,0]=4 1877 B12R1.27 CCC(O)CNc1cccnn1 ac8c3cdae8804672bacb52140e53905b [0,1,0,0,0,0|2,0,0]=3 1878 B12R1.27 CCC(O)CNc1ccncc1 0b60e4dad8ea5561a0d2716be536ff21 [0,1,0,0,0,0|3,0,0]=4 1879 B12R1.27 CCC(O)CNc1ccncn1 ca102469dcbe8fe4e133ae077b53bc80 [0,1,0,0,0,0|2,0,0]=3 1880 B12R1.27 CCC(O)CNc1cnccn1 6334d1439105446d009be2bfcd484584 [0,1,0,0,0,0|2,0,0]=3 1881 B12R1.27 CCC(O)CNc1cnncn1 b28937253965f31772f198c8896925a5 [0,1,0,0,0,0|3,0,0]=4 1882 B12R1.27 CCC(O)CNc1ncccn1 fcd9c82d249780013a859f025e7e3182 [0,1,0,0,0,0|2,0,0]=3 1883 B12R1.27 CCC(O)CNc1nccnn1 1a5902cb894b3dc51ab97649a9839812 [0,1,0,0,0,0|3,0,0]=4 1884 B12R1.27 CCC(O)CNc1ncncn1 5a4d7f718014c11ec4a9b994a3f27b67 [0,1,0,0,0,0|3,0,0]=4 1885 B12R1.27 CCN(C)CCc1ccccc1 7c4ca4f684c66e96c63c7f2e129ac623 [0,1,0,0,0,0|2,0,0]=3 1886 B12R1.27 CCN(C)CCc1ccccn1 2fc992e6b94f2894c06f88d1be2c6eae [0,1,0,0,0,0|1,0,0]=2 1887 B12R1.27 CCN(C)CCc1cccnc1 8f102e3d75ada77333a942e239825207 [0,1,0,0,0,0|3,0,0]=4 1888 B12R1.27 CCN(C)CCc1ccncc1 b74613155a01263f6023f3efd6abab19 [0,1,0,0,0,0|3,0,0]=4 1889 B12R1.27 CC[C@@H](C)CNc1ccccc1 7adb7de69cc286747885efdd5e0d3ab0 [0,1,0,0,0,0|2,0,0]=3 1890 B12R1.27 CC[C@@H](C)CNc1ccccn1 b147644fe4c42e26e6b4ca990988fc8c [0,1,0,0,0,0|1,0,0]=2 1891 B12R1.27 CC[C@@H](C)CNc1cccnc1 1eb105ddecf8c3249110848ecff4eaa7 [0,1,0,0,0,0|3,0,0]=4 1892 B12R1.27 CC[C@@H](C)CNc1cccnn1 f138a0d0c9267c29c52fe7f61c67828a [0,1,0,0,0,0|2,0,0]=3 1893 B12R1.27 CC[C@@H](C)CNc1ccncc1 ea454cc837b589ad6fa29f9da9abac60 [0,1,0,0,0,0|3,0,0]=4 1894 B12R1.27 CC[C@@H](C)CNc1ccncn1 9bdf9c9da31ebd979aecf6842d7ac6dc [0,1,0,0,0,0|2,0,0]=3 1895 B12R1.27 CC[C@@H](C)CNc1cnccn1 03c5733ba7940e2549808a371cd40c8d [0,1,0,0,0,0|2,0,0]=3 1896 B12R1.27 CC[C@@H](C)CNc1cnncn1 cce845849acdf356a4fb8233fd6c64ab [0,1,0,0,0,0|3,0,0]=4 1897 B12R1.27 CC[C@@H](C)CNc1ncccn1 182960260e320668bc478065c63b7965 [0,1,0,0,0,0|2,0,0]=3 1898 B12R1.27 CC[C@@H](C)CNc1nccnn1 94611cb70ff9bf45b3491622bc2df22e [0,1,0,0,0,0|3,0,0]=4 1899 B12R1.27 CC[C@@H](C)CNc1ncncn1 3fe1d195d89ac6910db4cbb2d46441ec [0,1,0,0,0,0|3,0,0]=4 1900 B12R1.27 CC[C@@H](C)COc1ccccn1 874982a66f916edcb8896717a7802590 [0,1,0,0,0,0|1,0,0]=2 1901 B12R1.27 CC[C@@H](C)COc1cccnc1 58227191aae01f35afcd7cf132697857 [0,1,0,0,0,0|3,0,0]=4 1902 B12R1.27 CC[C@@H](C)COc1ccncc1 d0894bc1ae7cda042c896f44faa1550c [0,1,0,0,0,0|3,0,0]=4 1903 B12R1.27 CC[C@@H](C)COc1cnccn1 7b3f825b503a154f58403ce019b27176 [0,1,0,0,0,0|2,0,0]=3 1904 B12R1.27 CC[C@@H](C)COc1cncnn1 68dcc5b8420837a8199c57e6694db34a [0,1,0,0,0,0|3,0,0]=4 1905 B12R1.27 CC[C@@H](C)COc1ncccn1 b6054516e1fc527614d9f5bd8fbbfebc [0,1,0,0,0,0|2,0,0]=3 1906 B12R1.27 CC[C@@H](C)NCc1ccccc1 1448d746eef22413d3964f8047936159 [0,1,0,0,0,0|2,0,0]=3 1907 B12R1.27 CC[C@@H](C)NCc1ccccn1 abcbefa3b0b43406c128be8257adf8b2 [0,1,0,0,0,0|1,0,0]=2 1908 B12R1.27 CC[C@@H](C)NCc1cccnc1 b119e02beb918b7f43cb64ab2c69b801 [0,1,0,0,0,0|3,0,0]=4 1909 B12R1.27 CC[C@@H](C)NCc1cccnn1 67c35e96e8b22c34c0f9f2bf0dbc7c53 [0,1,0,0,0,0|2,0,0]=3 1910 B12R1.27 CC[C@@H](C)NCc1ccncn1 8982898b930cc64d3f97e8f22b517451 [0,1,0,0,0,0|2,0,0]=3 1911 B12R1.27 CC[C@@H](C)NCc1ncccn1 f3d5324285f373a311d24ca5f258e5b2 [0,1,0,0,0,0|2,0,0]=3 1912 B12R1.27 CC[C@@H](C)OCc1ccccc1 0a5e215baf34a258dd8987ff4d2156b3 [0,1,0,0,0,0|2,0,0]=3 1913 B12R1.27 CC[C@@H](C)OCc1ccccn1 01fb0c2d8a73e699c5cca2351e7c51da [0,1,0,0,0,0|1,0,0]=2 1914 B12R1.27 CC[C@@H](C)OCc1cccnc1 2a740981d9be19ca809d229b469f45a2 [0,1,0,0,0,0|3,0,0]=4 1915 B12R1.27 CC[C@@H](C)OCc1cccnn1 2fac72deb935cb1047377c76377e9d51 [0,1,0,0,0,0|2,0,0]=3 1916 B12R1.27 CC[C@@H](C)OCc1ccncn1 6836f2a86da52782b28754e4db4a7845 [0,1,0,0,0,0|2,0,0]=3 1917 B12R1.27 CC[C@@H](C)OCc1ncccn1 0a03468190ed42b08f9cfae2cfb173a4 [0,1,0,0,0,0|2,0,0]=3 1918 B12R1.27 CC[C@@H](O)CNc1ccccc1 765034dc37ea09fed7d7c3321191febe [0,1,0,0,0,0|2,0,0]=3 1919 B12R1.27 CC[C@@H](O)CNc1cccnc1 804d6049e9a11075b053115d69a8a4fd [0,1,0,0,0,0|3,0,0]=4 1920 B12R1.27 CC[C@@H](O)CNc1ccncc1 d1898f70a0d74eecc26d475907d4eaff [0,1,0,0,0,0|3,0,0]=4 1921 B12R1.27 CC[C@@H](O)CNc1ccncn1 649018c5a6a5f17284abaad2f68f2eae [0,1,0,0,0,0|2,0,0]=3 1922 B12R1.27 CC[C@H](C)CNc1ccccc1 1ad1285ada078333483cb7913624769f [0,1,0,0,0,0|2,0,0]=3 1923 B12R1.27 CC[C@H](C)CNc1ccccn1 75c9b55178b9e6cbffbfe52153637e1b [0,1,0,0,0,0|1,0,0]=2 1924 B12R1.27 CC[C@H](C)CNc1cccnc1 2e0a2075fe988129d1dcbf5d21b158ec [0,1,0,0,0,0|3,0,0]=4 1925 B12R1.27 CC[C@H](C)CNc1cccnn1 f45f47606b109d68254290173d5081e6 [0,1,0,0,0,0|2,0,0]=3 1926 B12R1.27 CC[C@H](C)CNc1ccncc1 1476b49c3603a7542420a49c2bf3dc59 [0,1,0,0,0,0|3,0,0]=4 1927 B12R1.27 CC[C@H](C)CNc1ccncn1 f07bef34dedeff8e4d46ab831df19257 [0,1,0,0,0,0|2,0,0]=3 1928 B12R1.27 CC[C@H](C)CNc1cnccn1 8ecdfdf7b0f098ad2d5cb8d4d77444ce [0,1,0,0,0,0|2,0,0]=3 1929 B12R1.27 CC[C@H](C)CNc1cnncn1 93e26faa6eea2540f42bb35fe390a07e [0,1,0,0,0,0|3,0,0]=4 1930 B12R1.27 CC[C@H](C)CNc1ncccn1 577523f9b16287c54754a979f87ae1b0 [0,1,0,0,0,0|2,0,0]=3 1931 B12R1.27 CC[C@H](C)CNc1nccnn1 26821168c217d3f15e15d954537c94e7 [0,1,0,0,0,0|3,0,0]=4 1932 B12R1.27 CC[C@H](C)CNc1ncncn1 6defcee22a5572c3c77befec64af8b2c [0,1,0,0,0,0|3,0,0]=4 1933 B12R1.27 CC[C@H](C)COc1ccccn1 f5b749782758cf24dab04e1718b2b720 [0,1,0,0,0,0|1,0,0]=2 1934 B12R1.27 CC[C@H](C)COc1cccnc1 07e42e29a9d594c30776c88035bd838e [0,1,0,0,0,0|3,0,0]=4 1935 B12R1.27 CC[C@H](C)COc1ccncc1 91877b6a13f619eb114c1ca0ccf0b7a7 [0,1,0,0,0,0|3,0,0]=4 1936 B12R1.27 CC[C@H](C)COc1cnccn1 cab76278093fc45be19b2bc8e97ced1c [0,1,0,0,0,0|2,0,0]=3 1937 B12R1.27 CC[C@H](C)COc1cncnn1 97c445a9830c8bf9f171e601386da812 [0,1,0,0,0,0|3,0,0]=4 1938 B12R1.27 CC[C@H](C)COc1ncccn1 7aae48ba7a09d63ea52adb232ad746c4 [0,1,0,0,0,0|2,0,0]=3 1939 B12R1.27 CC[C@H](C)NCc1ccccc1 1d652b15c79b972376b40d93f2c0c28b [0,1,0,0,0,0|2,0,0]=3 1940 B12R1.27 CC[C@H](C)NCc1ccccn1 db87df854d63d8a538c09dd589fcce72 [0,1,0,0,0,0|1,0,0]=2 1941 B12R1.27 CC[C@H](C)NCc1cccnc1 fa7be05a72600688ba61bb2a45c0e2c1 [0,1,0,0,0,0|3,0,0]=4 1942 B12R1.27 CC[C@H](C)NCc1cccnn1 afb2d02055de31c3b13c38e7426238a5 [0,1,0,0,0,0|2,0,0]=3 1943 B12R1.27 CC[C@H](C)NCc1ccncn1 68e404577e6515900cd967404a759d1e [0,1,0,0,0,0|2,0,0]=3 1944 B12R1.27 CC[C@H](C)NCc1ncccn1 4b99ab313f24380219528f42be31f07d [0,1,0,0,0,0|2,0,0]=3 1945 B12R1.27 CC[C@H](C)OCc1ccccc1 b8de8bd5177d460679bde97bee24bb31 [0,1,0,0,0,0|2,0,0]=3 1946 B12R1.27 CC[C@H](C)OCc1ccccn1 095ff59c775b3964aafbd1681dc69b03 [0,1,0,0,0,0|1,0,0]=2 1947 B12R1.27 CC[C@H](C)OCc1cccnc1 dc7942b08bf13064943cbe342b7c887c [0,1,0,0,0,0|3,0,0]=4 1948 B12R1.27 CC[C@H](C)OCc1cccnn1 140744aee80ca8123abb7507b4305d28 [0,1,0,0,0,0|2,0,0]=3 1949 B12R1.27 CC[C@H](C)OCc1ccncn1 35f3c9d29295bb910146093a6786c4b1 [0,1,0,0,0,0|2,0,0]=3 1950 B12R1.27 CC[C@H](C)OCc1ncccn1 181b6f3316ad03af0956648dba459c7a [0,1,0,0,0,0|2,0,0]=3 1951 B12R1.27 CN(C=O)CCc1ccccn1 16a2ece4ff1bacf526fae60eca9f8ffa [0,1,0,0,0,0|2,0,1]=4 1952 B12R1.27 CN(CF)CCc1ccccc1 af958a660e6bf737d02c2dfab1bc467d [0,1,0,0,0,0|3,0,0]=4 1953 B12R1.27 CN(CF)CCc1ccccn1 e47249cec0a9e47647623cac83a45a8e [0,1,0,0,0,0|2,0,0]=3 1954 B12R1.27 CN(CO)CCc1ccccc1 c9a67cdf713e4c874ec2d63ed5e8590a [0,1,0,0,0,0|3,0,0]=4 1955 B12R1.27 CN(CO)CCc1ccccn1 aa0d4ac6d05fc927494412ee9fe9c7cc [0,1,0,0,0,0|2,0,0]=3 1956 B12R1.27 CNC(=O)CNc1ccccn1 fc4762116a27bb8b6ea53a6e66542d19 [0,1,0,0,0,0|2,0,1]=4 1957 B12R1.27 CNC(=O)COc1ccccn1 bd4756c0f0116ab38b1a4beac8202f0e [0,1,0,0,0,0|2,0,1]=4 1958 B12R1.27 COC(=O)CNc1ccccn1 422ec05b49687667e2eb26080da1b005 [0,1,0,0,0,0|2,0,1]=4 1959 B12R1.27 COC(=O)COc1ccccn1 b9320fa8fadd3b157619c972c855ab22 [0,1,0,0,0,0|2,0,1]=4 1960 B12R1.27 COC(C)CNc1ccccc1 8b7aea6540e0014f2969161722152c0a [0,1,0,0,0,0|3,0,0]=4 1961 B12R1.27 COC(C)CNc1ccccn1 aa1fffc4826b028b66ca3b6131bb2129 [0,1,0,0,0,0|2,0,0]=3 1962 B12R1.27 COC(C)CNc1cccnn1 57b8f2e31a89437037bb968036b0a7ad [0,1,0,0,0,0|3,0,0]=4 1963 B12R1.27 COC(C)CNc1ccncn1 9a338fed3fdbe41865e288d21845d7b6 [0,1,0,0,0,0|3,0,0]=4 1964 B12R1.27 COC(C)CNc1cnccn1 4934fe98e881c8caac1de5e17b4dc92d [0,1,0,0,0,0|3,0,0]=4 1965 B12R1.27 COC(C)CNc1ncccn1 8570879f1ddd8a7a1e5f6c89edecdeea [0,1,0,0,0,0|3,0,0]=4 1966 B12R1.27 COC(C)COc1ccccn1 f8dc8bfeccf22df73c7ed2e356fc48da [0,1,0,0,0,0|2,0,0]=3 1967 B12R1.27 COC(C)COc1cnccn1 168521879b84e34b8c393d32fd7d174c [0,1,0,0,0,0|3,0,0]=4 1968 B12R1.27 COC(C)COc1ncccn1 0fcc0297343c993aabe4b47abb5acb0d [0,1,0,0,0,0|3,0,0]=4 1969 B12R1.27 CO[C@@H](C)CNc1ccccc1 1db51b6397d595cc5bd1ef07b3dce178 [0,1,0,0,0,0|3,0,0]=4 1970 B12R1.27 CO[C@@H](C)CNc1ccccn1 3f6f24d683b32bf983db741333c2969d [0,1,0,0,0,0|2,0,0]=3 1971 B12R1.27 CO[C@@H](C)CNc1cccnn1 a7aab28edd21d3a5ef3d70cba3e8d7f9 [0,1,0,0,0,0|3,0,0]=4 1972 B12R1.27 CO[C@@H](C)CNc1ccncn1 917b47bd5f497576d3e7486855c6ee57 [0,1,0,0,0,0|3,0,0]=4 1973 B12R1.27 CO[C@@H](C)CNc1cnccn1 53ae0935256e105b3eb7c609b854c909 [0,1,0,0,0,0|3,0,0]=4 1974 B12R1.27 CO[C@@H](C)CNc1ncccn1 0812a69d040d25016f59a08e6acb2161 [0,1,0,0,0,0|3,0,0]=4 1975 B12R1.27 CO[C@@H](C)COc1ccccn1 74e5eb55678aa99f2f01dd02e58c0f99 [0,1,0,0,0,0|2,0,0]=3 1976 B12R1.27 CO[C@@H](C)COc1cnccn1 b74633bf8dc1ffc4614cbf0963cc0979 [0,1,0,0,0,0|3,0,0]=4 1977 B12R1.27 CO[C@@H](C)COc1ncccn1 d43b5c2f21fcbe512af85251c28b8a25 [0,1,0,0,0,0|3,0,0]=4 1978 B12R1.27 CO[C@H](C)CNc1ccccc1 b7b86a2dea3233b080c54d71a8f46990 [0,1,0,0,0,0|3,0,0]=4 1979 B12R1.27 CO[C@H](C)CNc1ccccn1 04ec0231ca9bc4cf1eff96f841c37724 [0,1,0,0,0,0|2,0,0]=3 1980 B12R1.27 CO[C@H](C)CNc1cccnn1 308d9b61ca0613da225819a6631aa0ff [0,1,0,0,0,0|3,0,0]=4 1981 B12R1.27 CO[C@H](C)CNc1ccncn1 7bf1aa7877bed7ec80381d13b25beaa6 [0,1,0,0,0,0|3,0,0]=4 1982 B12R1.27 CO[C@H](C)CNc1cnccn1 b719a317b586b472c3ca3ba92317ee19 [0,1,0,0,0,0|3,0,0]=4 1983 B12R1.27 CO[C@H](C)CNc1ncccn1 b988e20ae9c69cfad8a575078571ad98 [0,1,0,0,0,0|3,0,0]=4 1984 B12R1.27 CO[C@H](C)COc1ccccn1 48788836bfd03aade6f0bd2c51b60c5c [0,1,0,0,0,0|2,0,0]=3 1985 B12R1.27 CO[C@H](C)COc1cnccn1 f10e17992a6825010ede7d0e515d88a7 [0,1,0,0,0,0|3,0,0]=4 1986 B12R1.27 CO[C@H](C)COc1ncccn1 f5255e9db0e1162de21d873188fcd514 [0,1,0,0,0,0|3,0,0]=4 1987 B12R1.27 C[C@@H](CO)CNc1ccccc1 8acaf8396f10bf3948fe3b52f4656e75 [0,1,0,0,0,0|3,0,0]=4 1988 B12R1.27 C[C@@H](CO)CNc1ccccn1 af016b84d95f1080f07ef6f02d15824a [0,1,0,0,0,0|2,0,0]=3 1989 B12R1.27 C[C@@H](CO)CNc1cccnn1 0b6a2fb6d9427f1ca932a4a2c6e94db3 [0,1,0,0,0,0|3,0,0]=4 1990 B12R1.27 C[C@@H](CO)CNc1ccncn1 d45f622473b51bdfa511c740fe038021 [0,1,0,0,0,0|3,0,0]=4 1991 B12R1.27 C[C@@H](CO)CNc1cnccn1 b34ebd6399cbc236ef2ab5ac79900198 [0,1,0,0,0,0|3,0,0]=4 1992 B12R1.27 C[C@@H](CO)CNc1ncccn1 af018eff6911c0d83a5da864e125d204 [0,1,0,0,0,0|3,0,0]=4 1993 B12R1.27 C[C@@H](CO)NCc1ccccc1 a52866c987a35d6e1a5b62fda8afddea [0,1,0,0,0,0|3,0,0]=4 1994 B12R1.27 C[C@@H](CO)NCc1ccccn1 24b346e5ac8cec24f6566fe18f21e557 [0,1,0,0,0,0|2,0,0]=3 1995 B12R1.27 C[C@@H](CO)NCc1cccnn1 05a1dc5c207ae3eee6144f6e1c657205 [0,1,0,0,0,0|3,0,0]=4 1996 B12R1.27 C[C@@H](CO)NCc1ccncn1 f6ff3ba88bfe69e87216c2a7058d07f8 [0,1,0,0,0,0|3,0,0]=4 1997 B12R1.27 C[C@@H](CO)NCc1cnccn1 848c1433beb181bd59c54d3b96b16fa8 [0,1,0,0,0,0|3,0,0]=4 1998 B12R1.27 C[C@@H](CO)NCc1ncccn1 18b98af25da2c21ca4e52167d59e15d7 [0,1,0,0,0,0|3,0,0]=4 1999 B12R1.27 C[C@H](C=O)NCc1ccccn1 03bdbd8da67049c2d2c33d47db20e2fa [0,1,0,0,0,0|2,0,1]=4 2000 B12R1.27 C[C@H](C=O)OCc1ccccn1 77e036a149c9b895f58a4f79f65d470f [0,1,0,0,0,0|2,0,1]=4 2001 B12R1.27 C[C@H](CO)CNc1ccccc1 de01f7c1f1d3b008ec664fad35110bba [0,1,0,0,0,0|3,0,0]=4 2002 B12R1.27 C[C@H](CO)CNc1ccccn1 e822e956d48a344afeb617359365dcfb [0,1,0,0,0,0|2,0,0]=3 2003 B12R1.27 C[C@H](CO)CNc1cccnn1 560938529d62da9a8aac673de498ec01 [0,1,0,0,0,0|3,0,0]=4 2004 B12R1.27 C[C@H](CO)CNc1ccncn1 bda1eef39f4a95e453c3bac3205df33f [0,1,0,0,0,0|3,0,0]=4 2005 B12R1.27 C[C@H](CO)CNc1cnccn1 de693ece84470b212343000297ad249f [0,1,0,0,0,0|3,0,0]=4 2006 B12R1.27 C[C@H](CO)CNc1ncccn1 916d39941d1066a7157031db8367b91b [0,1,0,0,0,0|3,0,0]=4 2007 B12R1.27 C[C@H](CO)NCc1ccccc1 6eed9f4ff81e8b8226b9282b8f3ad13f [0,1,0,0,0,0|3,0,0]=4 2008 B12R1.27 C[C@H](CO)NCc1ccccn1 f876cbcb18ab33a44cd48067a6e0c620 [0,1,0,0,0,0|2,0,0]=3 2009 B12R1.27 C[C@H](CO)NCc1cccnn1 1a2bd735b97b66ca6ea47e333ae5c2c6 [0,1,0,0,0,0|3,0,0]=4 2010 B12R1.27 C[C@H](CO)NCc1ccncn1 c32e0f5fede4f5050d0aa02b72ffe485 [0,1,0,0,0,0|3,0,0]=4 2011 B12R1.27 C[C@H](CO)NCc1cnccn1 aa92059eda1f440fdfb5e1dbb18875a2 [0,1,0,0,0,0|3,0,0]=4 2012 B12R1.27 C[C@H](CO)NCc1ncccn1 0f954e7651a99fa27d25d1118270587f [0,1,0,0,0,0|3,0,0]=4 2013 B12R1.27 C[C@H](CS)OCc1ccccc1 76a62ad706fe4942b152f21141bdace8 [0,1,0,0,0,0|3,0,0]=4 2014 B12R1.27 C[C@H](CS)OCc1ccccn1 bfa2f3c46950c58e36e3009f57740457 [0,1,0,0,0,0|2,0,0]=3 2015 B12R1.27 C[C@H](CS)OCc1cccnn1 ed596dc0487d88f9c4050fab00936dd6 [0,1,0,0,0,0|3,0,0]=4 2016 B12R1.27 C[C@H](CS)OCc1ccncn1 bcfae6bd9da7a561bbca62d1ea19c5d1 [0,1,0,0,0,0|3,0,0]=4 2017 B12R1.27 C[C@H](CS)OCc1ncccn1 58841d38a292b01728562b6a0e3ba5a4 [0,1,0,0,0,0|3,0,0]=4 2018 B12R1.27 O=C(CF)NCc1ccccn1 4c7b5fbb214e22648f8c87757a037fe0 [0,1,0,0,0,0|2,0,1]=4 2019 B12R1.27 O=C(CO)CNc1ccccn1 0c5a750a3ead3f0642560291fe4bd338 [0,1,0,0,0,0|2,0,1]=4 2020 B12R1.27 O=C(CO)NCc1ccccn1 76eb78e75930ec6892869074780cca40 [0,1,0,0,0,0|2,0,1]=4 2021 B12R1.27 O=C(CS)NCc1ccccn1 ae765a2702e1ea1d8d048ef10891fe36 [0,1,0,0,0,0|2,0,1]=4 2022 B12R1.27 OC(CF)CNc1ccccc1 e518893c8dbaaac7e0289d266d42fc20 [0,1,0,0,0,0|3,0,0]=4 2023 B12R1.27 OC(CF)CNc1ccccn1 1b489c84af593acbd12dd849bb8613a4 [0,1,0,0,0,0|2,0,0]=3 2024 B12R1.27 OC(CF)CNc1cccnn1 29f1003d9f08ef42ebf9fbe7bc31121a [0,1,0,0,0,0|3,0,0]=4 2025 B12R1.27 OC(CF)CNc1ccncn1 0bcfbf6e12b3f59f0790d80fc41339c1 [0,1,0,0,0,0|3,0,0]=4 2026 B12R1.27 OC(CF)CNc1cnccn1 ee6cb5aa7b22cf43e37825f709173987 [0,1,0,0,0,0|3,0,0]=4 2027 B12R1.27 OC(CF)CNc1ncccn1 dd089ad3929e2fe47b5067487d7f2a6d [0,1,0,0,0,0|3,0,0]=4 2028 B12R1.27 OCC(F)CNc1ccccc1 12f6637854cd5607d7beeb33d98c9d66 [0,1,0,0,0,0|3,0,0]=4 2029 B12R1.27 OCC(F)CNc1ccccn1 636742c95dad33ab1c71801ff2f3a9f9 [0,1,0,0,0,0|2,0,0]=3 2030 B12R1.27 OCC(F)CNc1cccnn1 3206d2a2e5405671183d9fbae6b6f869 [0,1,0,0,0,0|3,0,0]=4 2031 B12R1.27 OCC(F)CNc1ccncn1 e47a7fece5be9dab87f5065b8d5faad2 [0,1,0,0,0,0|3,0,0]=4 2032 B12R1.27 OCC(F)CNc1cnccn1 afb9dfd6639eb50d2d5ff1a29359175d [0,1,0,0,0,0|3,0,0]=4 2033 B12R1.27 OCC(F)CNc1ncccn1 e95c3ce2f17538746c4f3fd19d2dcf76 [0,1,0,0,0,0|3,0,0]=4 2034 B12R1.27 OCC(O)CNc1ccccc1 2c98ea52c81c0230088b12196d6eb24a [0,1,0,0,0,0|3,0,0]=4 2035 B12R1.27 OCC(O)CNc1ccccn1 01ee7f693227d7b41743528a5289097e [0,1,0,0,0,0|2,0,0]=3 2036 B12R1.27 OCC(O)CNc1cccnn1 c37660606513696fffd56ba0becf4339 [0,1,0,0,0,0|3,0,0]=4 2037 B12R1.27 OCC(O)CNc1ccncn1 6c3d967743ad1842f53cd0a78440874e [0,1,0,0,0,0|3,0,0]=4 2038 B12R1.27 OCC(O)CNc1cnccn1 38f4f717546be1a1edb1cb90ca085d60 [0,1,0,0,0,0|3,0,0]=4 2039 B12R1.27 OCC(O)CNc1ncccn1 c8c3ea7763b8905b18ba231ae62c2d9a [0,1,0,0,0,0|3,0,0]=4 2040 B12R1.27 OCC(O)COc1ccccn1 de982e49db9e5905cbf502b472dbf63c [0,1,0,0,0,0|2,0,0]=3 2041 B12R1.27 OCC(O)COc1cnccn1 11df0c63b0f6b4d8bd464a325e4a7069 [0,1,0,0,0,0|3,0,0]=4 2042 B12R1.27 OCC(O)COc1ncccn1 286403b4fdbdd90521acb85f3a67a40b [0,1,0,0,0,0|3,0,0]=4 2043 B12R1.27 OC[C@@H](F)CNc1ccccc1 df0a72159854bbc7d14ee531e659ec9c [0,1,0,0,0,0|3,0,0]=4 2044 B12R1.27 OC[C@@H](F)CNc1ccccn1 1584848d336c5e6a789273d622755063 [0,1,0,0,0,0|2,0,0]=3 2045 B12R1.27 OC[C@@H](F)CNc1cccnn1 c59c212ecfe4a38d71370a6090a4c76b [0,1,0,0,0,0|3,0,0]=4 2046 B12R1.27 OC[C@@H](F)CNc1ccncn1 f33c3b0dfeabff0c991fb4ca945e03c9 [0,1,0,0,0,0|3,0,0]=4 2047 B12R1.27 OC[C@@H](F)CNc1cnccn1 908a6074f6ae5123691476cafb870574 [0,1,0,0,0,0|3,0,0]=4 2048 B12R1.27 OC[C@@H](F)CNc1ncccn1 abc44e6dacd16d67f5cef855f5167cc3 [0,1,0,0,0,0|3,0,0]=4 2049 B12R1.27 OC[C@@H](O)CNc1ccccc1 d5ed593b781b051c17ac5c0f665c9b28 [0,1,0,0,0,0|3,0,0]=4 2050 B12R1.27 OC[C@@H](O)CNc1ccccn1 2519c7c1d8c00423d8e7e0d2e871ff57 [0,1,0,0,0,0|2,0,0]=3 2051 B12R1.27 OC[C@@H](O)CNc1cccnn1 58a3e678159e6534b8b3409e8c95293a [0,1,0,0,0,0|3,0,0]=4 2052 B12R1.27 OC[C@@H](O)CNc1ccncn1 10efd3c226492fc8b4b0e6a19a39c9ac [0,1,0,0,0,0|3,0,0]=4 2053 B12R1.27 OC[C@@H](O)CNc1cnccn1 7407429709e17e3ed0b8a23970e73740 [0,1,0,0,0,0|3,0,0]=4 2054 B12R1.27 OC[C@@H](O)CNc1ncccn1 67a9d28146b1982de145b045ea5f4c68 [0,1,0,0,0,0|3,0,0]=4 2055 B12R1.27 OC[C@@H](O)COc1ccccn1 5d7275d622eef8cbe7d078a5f35c4912 [0,1,0,0,0,0|2,0,0]=3 2056 B12R1.27 OC[C@@H](O)COc1cnccn1 0eed07766913688fb589489d701afc2f [0,1,0,0,0,0|3,0,0]=4 2057 B12R1.27 OC[C@@H](O)COc1ncccn1 fb606f8980318ebc969c6d4c4b853e7d [0,1,0,0,0,0|3,0,0]=4 2058 B12R1.27 OC[C@H](F)CNc1ccccc1 9734eac13b001b84d3ee28ab012b0276 [0,1,0,0,0,0|3,0,0]=4 2059 B12R1.27 OC[C@H](F)CNc1ccccn1 9c1fd0a321ca27bdcba2b167501dd415 [0,1,0,0,0,0|2,0,0]=3 2060 B12R1.27 OC[C@H](F)CNc1cccnn1 629ab3e247071759d1dae6b893a9e5b7 [0,1,0,0,0,0|3,0,0]=4 2061 B12R1.27 OC[C@H](F)CNc1ccncn1 25dca2b737caaea3176c6988483e7be0 [0,1,0,0,0,0|3,0,0]=4 2062 B12R1.27 OC[C@H](F)CNc1cnccn1 d3061d41a310308078c944c00d350274 [0,1,0,0,0,0|3,0,0]=4 2063 B12R1.27 OC[C@H](F)CNc1ncccn1 2f2d808ea141af971353304ead1b3d7b [0,1,0,0,0,0|3,0,0]=4 2064 B12R1.27 OC[C@H](O)CNc1ccccc1 4df6835ea35fcadc1546d95d2a23469d [0,1,0,0,0,0|3,0,0]=4 2065 B12R1.27 OC[C@H](O)CNc1ccccn1 e668a53640e03ea6cd35db659b23303b [0,1,0,0,0,0|2,0,0]=3 2066 B12R1.27 OC[C@H](O)CNc1cccnn1 087448f1183ed7f43bb3b961de8ba49d [0,1,0,0,0,0|3,0,0]=4 2067 B12R1.27 OC[C@H](O)CNc1ccncn1 70c5dc777387b42dc9ea51088d2653ff [0,1,0,0,0,0|3,0,0]=4 2068 B12R1.27 OC[C@H](O)CNc1cnccn1 ee79647d0d893b6c2e8e16a89ef61985 [0,1,0,0,0,0|3,0,0]=4 2069 B12R1.27 OC[C@H](O)CNc1ncccn1 ababa3637c22251016991c8e9b423ba2 [0,1,0,0,0,0|3,0,0]=4 2070 B12R1.27 OC[C@H](O)COc1ccccn1 045d37c66440cc9315b76b72a2532fa4 [0,1,0,0,0,0|2,0,0]=3 2071 B12R1.27 OC[C@H](O)COc1cnccn1 f148bf1e896930240548bc4612b4a608 [0,1,0,0,0,0|3,0,0]=4 2072 B12R1.27 OC[C@H](O)COc1ncccn1 ec1e58c945dcba45a17837c41f7c3b4c [0,1,0,0,0,0|3,0,0]=4 2073 B12R1.28 BrCCNCc1cc(ccn1)Br dc8d135073069863867fb810e9456082 [0,1,0,0,0,0|2,0,0]=3 2074 B12R1.28 BrCCNCc1cccc(c1)Br effb840743a36d5ca1212ae572e23e89 [0,1,0,0,0,0|3,0,0]=4 2075 B12R1.28 BrCCNCc1cccc(c1)I 705e584509c8e70c3e5306c34cf9d9dc [0,1,0,0,0,0|3,0,0]=4 2076 B12R1.28 BrCCNCc1cccc(n1)Br 35fdbe778beb0605754f5c973fa89056 [0,1,0,0,0,0|2,0,0]=3 2077 B12R1.28 Brc1cccc(c1)CNCCI a24c38b5ffa11e307c2e1a19f30a87d3 [0,1,0,0,0,0|3,0,0]=4 2078 B12R1.28 Brc1cccc(n1)CNCCI bdd36d6c37e9274a018bca035d80a8c8 [0,1,0,0,0,0|2,0,0]=3 2079 B12R1.28 Brc1ccnc(c1)CNCCI e11909c6a52d8cf388c5d1f8935748af [0,1,0,0,0,0|2,0,0]=3 2080 B12R1.28 C#CCCNc1cc(ccn1)Br 404cf2146c1073f65c74b171c73d7fdc [0,1,0,0,0,0|1,0,2]=4 2081 B12R1.28 C#CCCNc1cc(ccn1)C 32b5542ea9c5294cd1ac59b56de49d5a [0,1,0,0,0,0|1,0,2]=4 2082 B12R1.28 C#CCCNc1cc(ccn1)Cl 6f056d25c1eff38223146129842ddd08 [0,1,0,0,0,0|1,0,2]=4 2083 B12R1.28 C#CCCNc1cc(ccn1)F 9057865750e53c5ab69db95d4293c202 [0,1,0,0,0,0|1,0,2]=4 2084 B12R1.28 C#CCCNc1cc(ccn1)I dcb1e9a111e249df869b0dfc097c6339 [0,1,0,0,0,0|1,0,2]=4 2085 B12R1.28 C#CCCNc1cccc(n1)Br 4b10fedd0cbddb702d76226deea53c3f [0,1,0,0,0,0|1,0,2]=4 2086 B12R1.28 C#CCCNc1cccc(n1)C 56d9ddba416c2fbbbf71365296e9d410 [0,1,0,0,0,0|1,0,2]=4 2087 B12R1.28 C#CCCNc1cccc(n1)Cl d4da977f0cde4cd33965810daf1dc435 [0,1,0,0,0,0|1,0,2]=4 2088 B12R1.28 C#CCCNc1cccc(n1)F 1389a57968f24b23b6fd1936930fc92c [0,1,0,0,0,0|1,0,2]=4 2089 B12R1.28 C#CCCNc1cccc(n1)I bd537b807cb5dc277c248da8f26351b8 [0,1,0,0,0,0|1,0,2]=4 2090 B12R1.28 C#CCCOc1cc(ccn1)Br aa56f7e51e58e4be8b760a0e82018085 [0,1,0,0,0,0|1,0,2]=4 2091 B12R1.28 C#CCCOc1cc(ccn1)C 9652bad2c12ad1760a36d243713c0d88 [0,1,0,0,0,0|1,0,2]=4 2092 B12R1.28 C#CCCOc1cc(ccn1)Cl 691f98fbfb6dc527b0e05fbfc1807f29 [0,1,0,0,0,0|1,0,2]=4 2093 B12R1.28 C#CCCOc1cc(ccn1)F f654927920f5c24102028491cbd67357 [0,1,0,0,0,0|1,0,2]=4 2094 B12R1.28 C#CCCOc1cccc(n1)Br b12f819bef6fa2785c518c361f46319e [0,1,0,0,0,0|1,0,2]=4 2095 B12R1.28 C#CCCOc1cccc(n1)C 337b3d2a7bd8cfe61f01d353e248ec29 [0,1,0,0,0,0|1,0,2]=4 2096 B12R1.28 C#CCCOc1cccc(n1)F ebfde503748094c8a591e9f1c2f2fce3 [0,1,0,0,0,0|1,0,2]=4 2097 B12R1.28 C#CCNCc1cc(ccn1)Br e4a99d8ebeacdb90b1162abf3cdfcb9f [0,1,0,0,0,0|1,0,2]=4 2098 B12R1.28 C#CCNCc1cc(ccn1)C 66d0a1f795843bd8f8fe2c749b5f23d5 [0,1,0,0,0,0|1,0,2]=4 2099 B12R1.28 C#CCNCc1cc(ccn1)Cl b6a016a68423009e37681078c9cacd24 [0,1,0,0,0,0|1,0,2]=4 2100 B12R1.28 C#CCNCc1cccc(n1)Br 2639b9d4a14e7811ba8b4b3428549712 [0,1,0,0,0,0|1,0,2]=4 2101 B12R1.28 C#CCNCc1cccc(n1)C 5f8c671b4f220e1177ec2f61c225d6e0 [0,1,0,0,0,0|1,0,2]=4 2102 B12R1.28 C#CCNCc1cccc(n1)Cl 833077b11d08224240c55f26feba7462 [0,1,0,0,0,0|1,0,2]=4 2103 B12R1.28 C#CCNCc1cccc(n1)F 04f08c3ff8d136e5e3b4f09d2d406276 [0,1,0,0,0,0|1,0,2]=4 2104 B12R1.28 C#CCOCc1cc(ccn1)Br 5c8cef806e50cbba8e1953170ea31493 [0,1,0,0,0,0|1,0,2]=4 2105 B12R1.28 C#CCOCc1cc(ccn1)C 30ed720ea45924b7844684a526f6cfe4 [0,1,0,0,0,0|1,0,2]=4 2106 B12R1.28 C#CCOCc1cc(ccn1)Cl 7f906d970c5d8b48e7450203293e99bd [0,1,0,0,0,0|1,0,2]=4 2107 B12R1.28 C#CCOCc1cc(ccn1)F b893d6f931ab55f424fc0f88d948fc79 [0,1,0,0,0,0|1,0,2]=4 2108 B12R1.28 C#CCOCc1cc(ccn1)I 2cf188e0c8663d98c1ebc83f9b261858 [0,1,0,0,0,0|1,0,2]=4 2109 B12R1.28 C#CCOCc1cccc(n1)Br a7406d2f6950b98914aa6fd3879ee107 [0,1,0,0,0,0|1,0,2]=4 2110 B12R1.28 C#CCOCc1cccc(n1)C 6c34d4258c1d4f70295afe641cb33939 [0,1,0,0,0,0|1,0,2]=4 2111 B12R1.28 C#CCOCc1cccc(n1)Cl 4b188e7540e22f7c58d202ba6231b074 [0,1,0,0,0,0|1,0,2]=4 2112 B12R1.28 C#CCOCc1cccc(n1)F 3e7d0daf87c3171a188adc82274e9a97 [0,1,0,0,0,0|1,0,2]=4 2113 B12R1.28 C#CCOCc1cccc(n1)I da99bf0ce109c47f1e084317ff569ccb [0,1,0,0,0,0|1,0,2]=4 2114 B12R1.28 C/C=C/CNc1cc(ccn1)Br 0433c323324f5f55d4e0243ade60141d [0,1,0,0,0,0|1,0,2]=4 2115 B12R1.28 C/C=C/CNc1cc(ccn1)C 228bf65195597f1ae20bcce96d41e3e5 [0,1,0,0,0,0|1,0,2]=4 2116 B12R1.28 C/C=C/CNc1cc(ccn1)Cl cd6626067ba4e9365985b2d0ba54cb49 [0,1,0,0,0,0|1,0,2]=4 2117 B12R1.28 C/C=C/CNc1cc(ccn1)F f32443a0c0c53dc4885f2ababbc015fc [0,1,0,0,0,0|1,0,2]=4 2118 B12R1.28 C/C=C/CNc1cc(ccn1)I 84c8eb9b2f67bd0a83383606eea8a0b1 [0,1,0,0,0,0|1,0,2]=4 2119 B12R1.28 C/C=C/CNc1cccc(n1)Br 17735f56ea74d19c6a332ec12806867d [0,1,0,0,0,0|1,0,2]=4 2120 B12R1.28 C/C=C/CNc1cccc(n1)C 480e2e2d544592cf65c04710ae33e2cd [0,1,0,0,0,0|1,0,2]=4 2121 B12R1.28 C/C=C/CNc1cccc(n1)Cl 340df6de739e98fd299a4cd42ff1dc8e [0,1,0,0,0,0|1,0,2]=4 2122 B12R1.28 C/C=C/CNc1cccc(n1)F d0eb74f620b71016c4629e1963bf9bc6 [0,1,0,0,0,0|1,0,2]=4 2123 B12R1.28 C/C=C/CNc1cccc(n1)I ba78b98f2b43b5ab9d70919aae2f4f23 [0,1,0,0,0,0|1,0,2]=4 2124 B12R1.28 C/C=C/COc1cc(ccn1)Br c0bd8a4d7c1a9b40468c10c1ee36c9ca [0,1,0,0,0,0|1,0,2]=4 2125 B12R1.28 C/C=C/COc1cc(ccn1)C 8471a9ac2d2d6e0f6aed0a1a7f5b8303 [0,1,0,0,0,0|1,0,2]=4 2126 B12R1.28 C/C=C/COc1cc(ccn1)Cl 36c582731d9d0c2c104011e13d2a614b [0,1,0,0,0,0|1,0,2]=4 2127 B12R1.28 C/C=C/COc1cc(ccn1)F 25de7583bc2f85fef25d723b69a24084 [0,1,0,0,0,0|1,0,2]=4 2128 B12R1.28 C/C=C/COc1cccc(n1)Br b7bff913ac6fafa7b1ef0fe96d6948f5 [0,1,0,0,0,0|1,0,2]=4 2129 B12R1.28 C/C=C/COc1cccc(n1)C a571ad3d9a308e9567ce32d3446a185e [0,1,0,0,0,0|1,0,2]=4 2130 B12R1.28 C/C=C/COc1cccc(n1)F 0170081e7ad9269b20174fab0fac5a97 [0,1,0,0,0,0|1,0,2]=4 2131 B12R1.28 C/C=C\CNc1cc(ccn1)Br fb632c43a4c24500c0b5c377f31bd3d8 [0,1,0,0,0,0|1,0,2]=4 2132 B12R1.28 C/C=C\CNc1cc(ccn1)C 8e7502b55bef763b26d199b647469db2 [0,1,0,0,0,0|1,0,2]=4 2133 B12R1.28 C/C=C\CNc1cc(ccn1)Cl f25ddddc2501a8ea89b861e3d7a39b5d [0,1,0,0,0,0|1,0,2]=4 2134 B12R1.28 C/C=C\CNc1cc(ccn1)F 9060567afe04240849e1f17ac1d78617 [0,1,0,0,0,0|1,0,2]=4 2135 B12R1.28 C/C=C\CNc1cc(ccn1)I 97f8d2a48751a9693c0edac757d8dab4 [0,1,0,0,0,0|1,0,2]=4 2136 B12R1.28 C/C=C\CNc1cccc(n1)Br 44e417021446db9473d0fd5f9517e67f [0,1,0,0,0,0|1,0,2]=4 2137 B12R1.28 C/C=C\CNc1cccc(n1)C d38b78469be5bc04f16c957dc70221f0 [0,1,0,0,0,0|1,0,2]=4 2138 B12R1.28 C/C=C\CNc1cccc(n1)Cl 4605ce275ddf8c74d5ace82c404018f1 [0,1,0,0,0,0|1,0,2]=4 2139 B12R1.28 C/C=C\CNc1cccc(n1)F 30a4fc3a2c3eb0f0a6b4155c14437506 [0,1,0,0,0,0|1,0,2]=4 2140 B12R1.28 C/C=C\CNc1cccc(n1)I 7b5d0ce271b13cd1c8d0c486fa748d9d [0,1,0,0,0,0|1,0,2]=4 2141 B12R1.28 C/C=C\COc1cc(ccn1)Br d8abeced78bde745165705e6a0fc4b9a [0,1,0,0,0,0|1,0,2]=4 2142 B12R1.28 C/C=C\COc1cc(ccn1)C 89be3e583fec3f22d27c444beacf950c [0,1,0,0,0,0|1,0,2]=4 2143 B12R1.28 C/C=C\COc1cc(ccn1)Cl 8506aaf83ea56e9da154efb786f918cf [0,1,0,0,0,0|1,0,2]=4 2144 B12R1.28 C/C=C\COc1cc(ccn1)F 85777cf75d703beeb48879a0b1aa1d8d [0,1,0,0,0,0|1,0,2]=4 2145 B12R1.28 C/C=C\COc1cccc(n1)Br a978e4f474716b106a1574e42c743b2d [0,1,0,0,0,0|1,0,2]=4 2146 B12R1.28 C/C=C\COc1cccc(n1)C bbfa1aa42f11a6814330d581717d42c1 [0,1,0,0,0,0|1,0,2]=4 2147 B12R1.28 C/C=C\COc1cccc(n1)F 948264c0b21a71b96fb95062318a8518 [0,1,0,0,0,0|1,0,2]=4 2148 B12R1.28 C=CCCNc1cc(ccn1)Br 121706b9ac91570f509be0271257bcdc [0,1,0,0,0,0|1,0,2]=4 2149 B12R1.28 C=CCCNc1cc(ccn1)C 25d6d1000d9eaa4f5d1263ca226eeecd [0,1,0,0,0,0|1,0,2]=4 2150 B12R1.28 C=CCCNc1cc(ccn1)Cl ade5b2ec30c320afb7865eb570cb9ee1 [0,1,0,0,0,0|1,0,2]=4 2151 B12R1.28 C=CCCNc1cc(ccn1)F ea678ae63d41324ed853a64b1687be6a [0,1,0,0,0,0|1,0,2]=4 2152 B12R1.28 C=CCCNc1cc(ccn1)I d33d3f35ef4680f5e7ca9ac0589a66de [0,1,0,0,0,0|1,0,2]=4 2153 B12R1.28 C=CCCNc1cc(ccn1)O 09dc2f48330085bf263049e5b6ae3b06 [0,1,0,0,0,0|1,0,2]=4 2154 B12R1.28 C=CCCNc1cccc(n1)Br 1097eabbacffcc3818767aa453c5bb76 [0,1,0,0,0,0|1,0,2]=4 2155 B12R1.28 C=CCCNc1cccc(n1)C cba9bf5e0ffc59ff5af80be72f9ee61f [0,1,0,0,0,0|1,0,2]=4 2156 B12R1.28 C=CCCNc1cccc(n1)Cl de87ccb8ebe4f53af5eb442500223fd1 [0,1,0,0,0,0|1,0,2]=4 2157 B12R1.28 C=CCCNc1cccc(n1)F f7ce4356a1a85d6d6a3141c79f698280 [0,1,0,0,0,0|1,0,2]=4 2158 B12R1.28 C=CCCNc1cccc(n1)I 2722ee8d59dcc6fcc7e7be51cd6c27fb [0,1,0,0,0,0|1,0,2]=4 2159 B12R1.28 C=CCCOc1cc(ccn1)Br 0e6dd2e756e68be33901a5c803515a83 [0,1,0,0,0,0|1,0,2]=4 2160 B12R1.28 C=CCCOc1cc(ccn1)C 6064f8486dd7970bdb62e472549fcba1 [0,1,0,0,0,0|1,0,2]=4 2161 B12R1.28 C=CCCOc1cc(ccn1)Cl 6c496c1167d0f46bf45910932f032672 [0,1,0,0,0,0|1,0,2]=4 2162 B12R1.28 C=CCCOc1cc(ccn1)F 5c9269721d85c97754b7ea6250d51935 [0,1,0,0,0,0|1,0,2]=4 2163 B12R1.28 C=CCCOc1cccc(n1)Br 81fa98065b78f7f513c04513642d5897 [0,1,0,0,0,0|1,0,2]=4 2164 B12R1.28 C=CCCOc1cccc(n1)C e40c86e82fe9889829de42d8361f54c1 [0,1,0,0,0,0|1,0,2]=4 2165 B12R1.28 C=CCCOc1cccc(n1)F 9014daec5103b96ccab3280fe10ed836 [0,1,0,0,0,0|1,0,2]=4 2166 B12R1.28 C=CCNCc1cc(ccn1)Br fa2b4f3551776faeb42f57bedd8e499b [0,1,0,0,0,0|1,0,2]=4 2167 B12R1.28 C=CCNCc1cc(ccn1)C 259228dde6d30908654d14b580e04cce [0,1,0,0,0,0|1,0,2]=4 2168 B12R1.28 C=CCNCc1cc(ccn1)Cl afc0f5f95fb5dfeb0d075d9e54aec3f3 [0,1,0,0,0,0|1,0,2]=4 2169 B12R1.28 C=CCNCc1cccc(n1)Br 4fd8bf648bcbfabb7cbf3d77a75f852b [0,1,0,0,0,0|1,0,2]=4 2170 B12R1.28 C=CCNCc1cccc(n1)C 6b1b106252921842cafff44c74f8d1fa [0,1,0,0,0,0|1,0,2]=4 2171 B12R1.28 C=CCNCc1cccc(n1)Cl d933845f47814695d13fd49a2c4af63f [0,1,0,0,0,0|1,0,2]=4 2172 B12R1.28 C=CCNCc1cccc(n1)F 70c953e210e331adc3bb3fc401eb9d55 [0,1,0,0,0,0|1,0,2]=4 2173 B12R1.28 C=CCOCc1cc(ccn1)Br c4c38a657e65354dbc2264f6e0491cdd [0,1,0,0,0,0|1,0,2]=4 2174 B12R1.28 C=CCOCc1cc(ccn1)C d69d331be28308de0bed8ebf17812418 [0,1,0,0,0,0|1,0,2]=4 2175 B12R1.28 C=CCOCc1cc(ccn1)Cl 7860c8cf4d45752cabe118ee2c273e9c [0,1,0,0,0,0|1,0,2]=4 2176 B12R1.28 C=CCOCc1cc(ccn1)F 290ec043d0a8d5eb720c6a20ac50cec2 [0,1,0,0,0,0|1,0,2]=4 2177 B12R1.28 C=CCOCc1cc(ccn1)I 97d9adfb109bfc5c0b7d3a604aad71ab [0,1,0,0,0,0|1,0,2]=4 2178 B12R1.28 C=CCOCc1cccc(n1)Br f7a169b90db6778bcdb82ad6176cdbf8 [0,1,0,0,0,0|1,0,2]=4 2179 B12R1.28 C=CCOCc1cccc(n1)C 22029dbb0d43cf756b4b456003752efc [0,1,0,0,0,0|1,0,2]=4 2180 B12R1.28 C=CCOCc1cccc(n1)Cl e6671974833c56c1c5cb8e766c88e220 [0,1,0,0,0,0|1,0,2]=4 2181 B12R1.28 C=CCOCc1cccc(n1)F b32f1388771c972061405e4bc36a9d11 [0,1,0,0,0,0|1,0,2]=4 2182 B12R1.28 C=CCOCc1cccc(n1)I 86866d3924ab4a633246bfe91329a1db [0,1,0,0,0,0|1,0,2]=4 2183 B12R1.28 CC=CCNc1cc(ccn1)C 15b6636224b74baaa61d57ac45b7f310 [0,1,0,0,0,0|1,0,2]=4 2184 B12R1.28 CC=CCNc1cc(ccn1)F 69773b4ab37edb674703a383c3460251 [0,1,0,0,0,0|1,0,2]=4 2185 B12R1.28 CC=CCNc1cc(ccn1)O 46197eba20790a35d603d6fb8f251823 [0,1,0,0,0,0|1,0,2]=4 2186 B12R1.28 CC=CCNc1cccc(n1)C eba48658f48ddf71f32be4ab03e7f7fe [0,1,0,0,0,0|1,0,2]=4 2187 B12R1.28 CC=CCNc1cccc(n1)F 80b6556067ee688288a3e97805917a27 [0,1,0,0,0,0|1,0,2]=4 2188 B12R1.28 CCCCNc1cc(ccn1)Br 3ce8e9f067c3a96b8cf9dbb1309fc04e [0,1,0,0,0,0|1,0,0]=2 2189 B12R1.28 CCCCNc1cc(ccn1)C df22b9236c0d0914a12a55dc7c64c005 [0,1,0,0,0,0|1,0,0]=2 2190 B12R1.28 CCCCNc1cc(ccn1)Cl cffab7d82e3b95857c958e6281b555d3 [0,1,0,0,0,0|1,0,0]=2 2191 B12R1.28 CCCCNc1cc(ccn1)F 76d962442661bbd03d8a1a7a4e1b4df8 [0,1,0,0,0,0|1,0,0]=2 2192 B12R1.28 CCCCNc1cc(ccn1)I 59ce12897e7090fd85fc4dfb96fddf31 [0,1,0,0,0,0|1,0,0]=2 2193 B12R1.28 CCCCNc1cc(cnn1)Br 846a58d7c7ac21bf8aa4e579e740e721 [0,1,0,0,0,0|2,0,0]=3 2194 B12R1.28 CCCCNc1cc(cnn1)C eca325fd8872164d7241954bcc558e62 [0,1,0,0,0,0|2,0,0]=3 2195 B12R1.28 CCCCNc1cc(cnn1)Cl 797c0b4d06bcbed6e4170222ad28a87b [0,1,0,0,0,0|2,0,0]=3 2196 B12R1.28 CCCCNc1cc(ncn1)Br aec6fefcc2fa4f95be0e681422bae987 [0,1,0,0,0,0|2,0,0]=3 2197 B12R1.28 CCCCNc1cc(ncn1)C f5240c10d5f1d258952d846391401838 [0,1,0,0,0,0|2,0,0]=3 2198 B12R1.28 CCCCNc1cc(ncn1)Cl e49eeca8962e8aaa87d45e887bb66350 [0,1,0,0,0,0|2,0,0]=3 2199 B12R1.28 CCCCNc1cc(ncn1)F fc6b999a6d513a3129b91fdd9a24e80d [0,1,0,0,0,0|2,0,0]=3 2200 B12R1.28 CCCCNc1cc(ncn1)I 81d35aaedccf8b502e223da3c9eb3b47 [0,1,0,0,0,0|2,0,0]=3 2201 B12R1.28 CCCCNc1cc[nH]c(=O)c1 3680c4d5311ae40abd6ce4902a0424b0 [0,1,0,0,0,0|3,0,0]=4 2202 B12R1.28 CCCCNc1cc[nH]c(=O)n1 3c2d7358ad18678bea06990cc26a1907 [0,1,0,0,0,0|2,0,0]=3 2203 B12R1.28 CCCCNc1cc[nH]c(=S)c1 ea9cb42b74e9dcca19e8748ca3c5dc34 [0,1,0,0,0,0|3,0,0]=4 2204 B12R1.28 CCCCNc1ccc[n+](c1)[O-] 679e1535df40d2e493121e03e1801eb4 [0,1,0,0,0,0|3,0,0]=4 2205 B12R1.28 CCCCNc1cccc(=O)[nH]1 3692f6133be3cd54daa34043dfb91b4f [0,1,0,0,0,0|1,0,1]=3 2206 B12R1.28 CCCCNc1cccc(c1)Br 3ba87045eb71cb9daeb0c6df049ffff7 [0,1,0,0,0,0|2,0,0]=3 2207 B12R1.28 CCCCNc1cccc(c1)C f36b39ad3ead5e197d911ea9d057dd4e [0,1,0,0,0,0|2,0,0]=3 2208 B12R1.28 CCCCNc1cccc(c1)Cl a6dae9e8390011a3064dddc965e1d2b9 [0,1,0,0,0,0|2,0,0]=3 2209 B12R1.28 CCCCNc1cccc(c1)F 0ad37da684945b6ecbc5a392ea5af5e5 [0,1,0,0,0,0|2,0,0]=3 2210 B12R1.28 CCCCNc1cccc(c1)I dc76b7022ba07d453e5841475326c95d [0,1,0,0,0,0|2,0,0]=3 2211 B12R1.28 CCCCNc1cccc(c1)S 43cd57044d5c62dbdc445cebf65eff9d [0,1,0,0,0,0|2,0,0]=3 2212 B12R1.28 CCCCNc1cccc(n1)Br fac5b1f9c484cf59cb6a4b3669a341c0 [0,1,0,0,0,0|1,0,0]=2 2213 B12R1.28 CCCCNc1cccc(n1)C b50c160478b645e8709ed00a31cf2df2 [0,1,0,0,0,0|1,0,0]=2 2214 B12R1.28 CCCCNc1cccc(n1)Cl ed33204606245079fd78621e5440d037 [0,1,0,0,0,0|1,0,0]=2 2215 B12R1.28 CCCCNc1cccc(n1)F a31fed733d277471f4055bcc2e8b1eab [0,1,0,0,0,0|1,0,0]=2 2216 B12R1.28 CCCCNc1cccc(n1)I 0b65a525126639de52d69849ecc93a45 [0,1,0,0,0,0|1,0,0]=2 2217 B12R1.28 CCCCNc1ccnc(c1)Br ecb5342ab7f6e01e3e3b964c4843f8aa [0,1,0,0,0,0|3,0,0]=4 2218 B12R1.28 CCCCNc1ccnc(c1)C e6b03d134a6089ca15a5b9a55503d762 [0,1,0,0,0,0|3,0,0]=4 2219 B12R1.28 CCCCNc1ccnc(c1)Cl 1749b707475bfdeb026197262d22361b [0,1,0,0,0,0|3,0,0]=4 2220 B12R1.28 CCCCNc1ccnc(c1)F 87d73fa5d39fd30e54e9de6d0cafb0f4 [0,1,0,0,0,0|3,0,0]=4 2221 B12R1.28 CCCCNc1ccnc(c1)I 202ff841ad6a80e2f7d252fb9a46ab0d [0,1,0,0,0,0|3,0,0]=4 2222 B12R1.28 CCCCNc1ccnc(n1)Br a228833653debef884ce9c5089c19b30 [0,1,0,0,0,0|2,0,0]=3 2223 B12R1.28 CCCCNc1ccnc(n1)C f7a06b587a85665edf6f11e6f36013d2 [0,1,0,0,0,0|2,0,0]=3 2224 B12R1.28 CCCCNc1ccnc(n1)Cl 58091641581206d8f9e9944728fee602 [0,1,0,0,0,0|2,0,0]=3 2225 B12R1.28 CCCCNc1ccnc(n1)F 4184b91c85350ccf45ccf700b1637b90 [0,1,0,0,0,0|2,0,0]=3 2226 B12R1.28 CCCCNc1ccnc(n1)S c19db6b7a5c5908f54f99258f8e8956c [0,1,0,0,0,0|2,0,0]=3 2227 B12R1.28 CCCCNc1cn[nH]c(=O)n1 78dde7342a88c5f979240a9441a0c303 [0,1,0,0,0,0|3,0,0]=4 2228 B12R1.28 CCCCNc1cncc(c1)Br b2fa56f79c380776fe44ba4523a4021f [0,1,0,0,0,0|3,0,0]=4 2229 B12R1.28 CCCCNc1cncc(c1)C 5129cdde89e6a0cff0e8b3d16e5355bb [0,1,0,0,0,0|3,0,0]=4 2230 B12R1.28 CCCCNc1cncc(c1)Cl 48ec9e7a10b4511c58afedd0548e3091 [0,1,0,0,0,0|3,0,0]=4 2231 B12R1.28 CCCCNc1cncc(c1)F 15ad4e01c89a4cfa3dd1c42baf244de2 [0,1,0,0,0,0|3,0,0]=4 2232 B12R1.28 CCCCNc1cncc(c1)I ce2eb3e0439ff3de201262b9bef469f8 [0,1,0,0,0,0|3,0,0]=4 2233 B12R1.28 CCCCNc1cncc(n1)Br 81af0f4b09f7492e6c4b31a28ac03d5a [0,1,0,0,0,0|2,0,0]=3 2234 B12R1.28 CCCCNc1cncc(n1)C c36beb8b2008e00cc3d7e90c5556bcd7 [0,1,0,0,0,0|2,0,0]=3 2235 B12R1.28 CCCCNc1cncc(n1)Cl 49e4859524097802ec15a4e2ce9f6fcf [0,1,0,0,0,0|2,0,0]=3 2236 B12R1.28 CCCCNc1cncc(n1)F c5e7ec1329fb5a659d35cefbff042191 [0,1,0,0,0,0|2,0,0]=3 2237 B12R1.28 CCCCNc1cnnc(n1)C ada1c8d94c22025f56e008cece071c2c [0,1,0,0,0,0|3,0,0]=4 2238 B12R1.28 CCCCNc1cnnc(n1)Cl 0d278e168c948336d78aa76f82201631 [0,1,0,0,0,0|3,0,0]=4 2239 B12R1.28 CCCCNc1nc[nH]c(=O)n1 6db0b52cfd514d8d3b9130112dbcc1e2 [0,1,0,0,0,0|3,0,0]=4 2240 B12R1.28 CCCCNc1nccc(=O)[nH]1 bb0f9266e44c98d49e21ada496f28624 [0,1,0,0,0,0|2,0,0]=3 2241 B12R1.28 CCCCNc1nccc(n1)Br 037555a8cdbd2e012d075f6f548ee732 [0,1,0,0,0,0|2,0,0]=3 2242 B12R1.28 CCCCNc1nccc(n1)C 6af1ae45952075e7ce03980ff88bcb6b [0,1,0,0,0,0|2,0,0]=3 2243 B12R1.28 CCCCNc1nccc(n1)Cl 5537a92b69823787d0f09e8eb837a7f3 [0,1,0,0,0,0|2,0,0]=3 2244 B12R1.28 CCCCNc1nccc(n1)F 6d24c3f01ae237f51ebf1f26736dc064 [0,1,0,0,0,0|2,0,0]=3 2245 B12R1.28 CCCCNc1nccc(n1)I ccc3fcf15f2ca1cfa88dc25ebe2d3915 [0,1,0,0,0,0|2,0,0]=3 2246 B12R1.28 CCCCNc1nccc(n1)S 9f44058f92db4c21ab5a679b271bcb9a [0,1,0,0,0,0|2,0,0]=3 2247 B12R1.28 CCCCNc1ncnc(n1)Cl 15b563b17d97c79a3d301d84f4c70af2 [0,1,0,0,0,0|3,0,0]=4 2248 B12R1.28 CCCCNc1ncnc(n1)S 84f41d221ba58b528a2b95ee76685fc4 [0,1,0,0,0,0|3,0,0]=4 2249 B12R1.28 CCCCOc1cc(ccn1)Br 127a4e24d70a2e56fe8dba38ab0d7418 [0,1,0,0,0,0|1,0,0]=2 2250 B12R1.28 CCCCOc1cc(ccn1)C a277689bb0c81dba2c426460cd5c464b [0,1,0,0,0,0|1,0,0]=2 2251 B12R1.28 CCCCOc1cc(ccn1)Cl 56a40f70abea0a64471fae4dba24fb5e [0,1,0,0,0,0|1,0,0]=2 2252 B12R1.28 CCCCOc1cc(ccn1)F 7b3ecf9ab860ac39a00f40bc9043bf42 [0,1,0,0,0,0|1,0,0]=2 2253 B12R1.28 CCCCOc1cc(ncn1)Br cfb01a997ef1f653df9d18d89951c93a [0,1,0,0,0,0|2,0,0]=3 2254 B12R1.28 CCCCOc1cc(ncn1)C f8d26fb2e7f17ca6a5c90c4f51b6c1d0 [0,1,0,0,0,0|2,0,0]=3 2255 B12R1.28 CCCCOc1cc(ncn1)Cl 01f614feadc1e787fcda6959bc1f9229 [0,1,0,0,0,0|2,0,0]=3 2256 B12R1.28 CCCCOc1ccc[n+](c1)[O-] df749312c20bba98ad1c8de7c9bf010c [0,1,0,0,0,0|3,0,0]=4 2257 B12R1.28 CCCCOc1cccc(=O)[nH]1 1f22aa2f2c8c4d772359ded89a265096 [0,1,0,0,0,0|1,0,1]=3 2258 B12R1.28 CCCCOc1cccc(c1)Br b144f667443368aab820c1f558ee7729 [0,1,0,0,0,0|2,0,0]=3 2259 B12R1.28 CCCCOc1cccc(c1)C de4e90dba26d310b97e7df87ced1e000 [0,1,0,0,0,0|2,0,0]=3 2260 B12R1.28 CCCCOc1cccc(c1)Cl 6912ea50178fc697373b3eb109be83be [0,1,0,0,0,0|2,0,0]=3 2261 B12R1.28 CCCCOc1cccc(c1)F 9bbd58eababd7836ec763165664cc247 [0,1,0,0,0,0|2,0,0]=3 2262 B12R1.28 CCCCOc1cccc(c1)I 02e05e5116a879aa64014a15641eb41a [0,1,0,0,0,0|2,0,0]=3 2263 B12R1.28 CCCCOc1cccc(c1)S 092550c23bce2a6555f79ad42c314952 [0,1,0,0,0,0|2,0,0]=3 2264 B12R1.28 CCCCOc1cccc(n1)Br 1a9bd0f42ab10adce3654ad95086796d [0,1,0,0,0,0|1,0,0]=2 2265 B12R1.28 CCCCOc1cccc(n1)C d9b6d18f8cc402e5aad7db256f0801f6 [0,1,0,0,0,0|1,0,0]=2 2266 B12R1.28 CCCCOc1cccc(n1)F 795e9d086b4da4df60943f877937c501 [0,1,0,0,0,0|1,0,0]=2 2267 B12R1.28 CCCCOc1ccnc(c1)Br a75bf8d3945a7df05c18cef85d06ff19 [0,1,0,0,0,0|3,0,0]=4 2268 B12R1.28 CCCCOc1ccnc(c1)C 958584adfae3a5ad9d3921f49695ad0e [0,1,0,0,0,0|3,0,0]=4 2269 B12R1.28 CCCCOc1ccnc(c1)Cl 8ed91e6bca5cac7a57b73dca14f3ec8b [0,1,0,0,0,0|3,0,0]=4 2270 B12R1.28 CCCCOc1ccnc(c1)F 3873283cc21b8a16e46b3da5fa810d2c [0,1,0,0,0,0|3,0,0]=4 2271 B12R1.28 CCCCOc1ccnc(n1)C 15cac3b113ebafcd2ccc1dec19409ffb [0,1,0,0,0,0|2,0,0]=3 2272 B12R1.28 CCCCOc1ccnc(n1)Cl caf8b47a510d867ec3cf74c87f4d2e9e [0,1,0,0,0,0|2,0,0]=3 2273 B12R1.28 CCCCOc1cncc(c1)Br a7527beb0dfc7f59c17ee94303ef08de [0,1,0,0,0,0|3,0,0]=4 2274 B12R1.28 CCCCOc1cncc(c1)C 0007ff0e63944aa372234adb125a872c [0,1,0,0,0,0|3,0,0]=4 2275 B12R1.28 CCCCOc1cncc(c1)Cl 43cf7404510a84ae2ffcd7f30b3b3691 [0,1,0,0,0,0|3,0,0]=4 2276 B12R1.28 CCCCOc1cncc(c1)F 01b81a592c8dbfe673a2ba66b9183d00 [0,1,0,0,0,0|3,0,0]=4 2277 B12R1.28 CCCCOc1cncc(c1)I 6a71a3ae9a8b6a209904e90b5446a08d [0,1,0,0,0,0|3,0,0]=4 2278 B12R1.28 CCCCOc1cncc(n1)Br 50d16f94419b1952d5583e5bef2e79f6 [0,1,0,0,0,0|2,0,0]=3 2279 B12R1.28 CCCCOc1cncc(n1)C 3cdfb5d3e9edb05ecf45357e8c3b1074 [0,1,0,0,0,0|2,0,0]=3 2280 B12R1.28 CCCCOc1cncc(n1)Cl abb2b3325e34bac9efe2e839e39c291c [0,1,0,0,0,0|2,0,0]=3 2281 B12R1.28 CCCCOc1nccc(n1)Cl 3027d2f03d604257e78374b4662cf537 [0,1,0,0,0,0|2,0,0]=3 2282 B12R1.28 CCCCOc1nccc(n1)S 65097b0d0d644d5b53a00064d7dd91da [0,1,0,0,0,0|2,0,0]=3 2283 B12R1.28 CCCNCc1cc(ccn1)Br 62b70cd570592b04505bcfacfa76c0a8 [0,1,0,0,0,0|1,0,0]=2 2284 B12R1.28 CCCNCc1cc(ccn1)C 8f64567856c5a6b9541eee6863b3acf3 [0,1,0,0,0,0|1,0,0]=2 2285 B12R1.28 CCCNCc1cc(ccn1)Cl 33d38006b2776043cf75acff3a96c3bc [0,1,0,0,0,0|1,0,0]=2 2286 B12R1.28 CCCNCc1cc[nH]c(=O)c1 4d3551ff6d97808fad95dbe208e6e6f7 [0,1,0,0,0,0|3,0,0]=4 2287 B12R1.28 CCCNCc1cc[nH]c(=O)n1 83a5dafc02314146c53fc413d59eea65 [0,1,0,0,0,0|2,0,0]=3 2288 B12R1.28 CCCNCc1ccc[n+](c1)[O-] 9030f4a8f20f481b4d929fabb8e9f8c4 [0,1,0,0,0,0|3,0,0]=4 2289 B12R1.28 CCCNCc1cccc(c1)Br ab115619eaf5d28cfa37403b6fa7ac8f [0,1,0,0,0,0|2,0,0]=3 2290 B12R1.28 CCCNCc1cccc(c1)C 0ea9b946138db81b53023dbdaca16203 [0,1,0,0,0,0|2,0,0]=3 2291 B12R1.28 CCCNCc1cccc(c1)Cl d46956d798c81ca7a12e7d74076d63f3 [0,1,0,0,0,0|2,0,0]=3 2292 B12R1.28 CCCNCc1cccc(c1)F fec44b74b110238869e7726b42829c72 [0,1,0,0,0,0|2,0,0]=3 2293 B12R1.28 CCCNCc1cccc(c1)I ec50005f001189b77183e63c9ca35e03 [0,1,0,0,0,0|2,0,0]=3 2294 B12R1.28 CCCNCc1cccc(n1)Br bc593c6f51687abad18885bc99f5c95a [0,1,0,0,0,0|1,0,0]=2 2295 B12R1.28 CCCNCc1cccc(n1)C eb159799c3e39812c6e0f5ecfc00929c [0,1,0,0,0,0|1,0,0]=2 2296 B12R1.28 CCCNCc1cccc(n1)Cl 94687edaf9eb76abc359c0ee14de5cdb [0,1,0,0,0,0|1,0,0]=2 2297 B12R1.28 CCCNCc1cccc(n1)F d2389ac79e260eebbc9be9dd76bffa68 [0,1,0,0,0,0|1,0,0]=2 2298 B12R1.28 CCCNCc1ccnc(c1)Br cd93074a785b440f75a051f29d102f74 [0,1,0,0,0,0|3,0,0]=4 2299 B12R1.28 CCCNCc1ccnc(c1)C 44e3f8e97f0195b1553b942808256e2f [0,1,0,0,0,0|3,0,0]=4 2300 B12R1.28 CCCNCc1ccnc(c1)Cl 8d578c7e3bd687164cedc285e7a85839 [0,1,0,0,0,0|3,0,0]=4 2301 B12R1.28 CCCNCc1ccnc(c1)F 0764251a219853f8ad12c7dad0b77be7 [0,1,0,0,0,0|3,0,0]=4 2302 B12R1.28 CCCNCc1ccnc(n1)C 6ceb8c766940d7220ce793fadca3d07b [0,1,0,0,0,0|2,0,0]=3 2303 B12R1.28 CCCNCc1ccnc(n1)Cl e8f86fdbc8ea1752f58bc25fbb17b71a [0,1,0,0,0,0|2,0,0]=3 2304 B12R1.28 CCCNCc1cncc(c1)Br dd5395a070fe2a754d4e2e6686157366 [0,1,0,0,0,0|3,0,0]=4 2305 B12R1.28 CCCNCc1cncc(c1)C 93f050af005663718449bbd3ede95b01 [0,1,0,0,0,0|3,0,0]=4 2306 B12R1.28 CCCNCc1cncc(c1)Cl a9f078773a7c257d3b42b4fe2c63dd8d [0,1,0,0,0,0|3,0,0]=4 2307 B12R1.28 CCCNCc1cncc(c1)F a41a901c88e12e1540206257502347f5 [0,1,0,0,0,0|3,0,0]=4 2308 B12R1.28 CCCNCc1cncc(n1)Cl 34870c603f37b92563ace4b77f5de42d [0,1,0,0,0,0|2,0,0]=3 2309 B12R1.28 CCCNCc1nccc(n1)C e58dc1e95eaf012f23da8a5683f78cc6 [0,1,0,0,0,0|2,0,0]=3 2310 B12R1.28 CCCNCc1nccc(n1)Cl b66180cd703f35e930b9bfcc3e1e042b [0,1,0,0,0,0|2,0,0]=3 2311 B12R1.28 CCCOCc1cc(ccn1)Br 55b245978a87266e978cf80fd37b8760 [0,1,0,0,0,0|1,0,0]=2 2312 B12R1.28 CCCOCc1cc(ccn1)C 437e02001d74ccffa20b468cf3b27583 [0,1,0,0,0,0|1,0,0]=2 2313 B12R1.28 CCCOCc1cc(ccn1)Cl 57147ac72f315e193a33357e27e37a83 [0,1,0,0,0,0|1,0,0]=2 2314 B12R1.28 CCCOCc1cc(ccn1)F 8858345998cbadf17293c5f4134b7123 [0,1,0,0,0,0|1,0,0]=2 2315 B12R1.28 CCCOCc1cc(ccn1)I 52a63e2452a5d464627ee845ec55bee8 [0,1,0,0,0,0|1,0,0]=2 2316 B12R1.28 CCCOCc1cc(cnn1)C 2cd9786e699b5106054a0ec7469015db [0,1,0,0,0,0|2,0,0]=3 2317 B12R1.28 CCCOCc1cc(ncn1)C edbf4f1ac8ad28554fee48ddcc15ae02 [0,1,0,0,0,0|2,0,0]=3 2318 B12R1.28 CCCOCc1cc(ncn1)Cl 71f93cfebdcf041f9ac6b540e63934cf [0,1,0,0,0,0|2,0,0]=3 2319 B12R1.28 CCCOCc1cc[nH]c(=O)c1 82206fb059c9c4c36c258eb5d9cc90c9 [0,1,0,0,0,0|3,0,0]=4 2320 B12R1.28 CCCOCc1ccc[n+](c1)[O-] a5e525d8838aa27d20098eb15f253021 [0,1,0,0,0,0|3,0,0]=4 2321 B12R1.28 CCCOCc1cccc(c1)Br 51b265396dee1ad4a9bb63037e020576 [0,1,0,0,0,0|2,0,0]=3 2322 B12R1.28 CCCOCc1cccc(c1)C d8eb8d05914bbe210bfe6d56aae3fe46 [0,1,0,0,0,0|2,0,0]=3 2323 B12R1.28 CCCOCc1cccc(c1)Cl 04967c4422580f79cdb296f010807ced [0,1,0,0,0,0|2,0,0]=3 2324 B12R1.28 CCCOCc1cccc(c1)F 0d807124e5077ad8540130b67a71280a [0,1,0,0,0,0|2,0,0]=3 2325 B12R1.28 CCCOCc1cccc(c1)I 8a2a3d6ad20e441201e59e161816ef78 [0,1,0,0,0,0|2,0,0]=3 2326 B12R1.28 CCCOCc1cccc(n1)Br 5a5029b9d6268213b7c79e92879e6576 [0,1,0,0,0,0|1,0,0]=2 2327 B12R1.28 CCCOCc1cccc(n1)C 108e42919326b113159263e17f8ec3cb [0,1,0,0,0,0|1,0,0]=2 2328 B12R1.28 CCCOCc1cccc(n1)Cl 3837a6848aec96edc567f764a90da8b2 [0,1,0,0,0,0|1,0,0]=2 2329 B12R1.28 CCCOCc1cccc(n1)F c1faf6b0f233e7e9b5654b5be2923e16 [0,1,0,0,0,0|1,0,0]=2 2330 B12R1.28 CCCOCc1cccc(n1)I c8ff9890bec20a11d495514a971eb19a [0,1,0,0,0,0|1,0,0]=2 2331 B12R1.28 CCCOCc1ccnc(=O)[nH]1 6a9acdbf68ab817782410cac6fd56f6d [0,1,0,0,0,0|2,0,1]=4 2332 B12R1.28 CCCOCc1ccnc(c1)Br c7f7b5da6349bbcc876b2af23d30f842 [0,1,0,0,0,0|3,0,0]=4 2333 B12R1.28 CCCOCc1ccnc(c1)C 03df2ec691f193e1ca6cefb2cc28aec4 [0,1,0,0,0,0|3,0,0]=4 2334 B12R1.28 CCCOCc1ccnc(c1)Cl 8dc40d011cb457572b43eb05750f990a [0,1,0,0,0,0|3,0,0]=4 2335 B12R1.28 CCCOCc1ccnc(c1)F 180548efa17c7463918b6585dde9fd6a [0,1,0,0,0,0|3,0,0]=4 2336 B12R1.28 CCCOCc1ccnc(n1)C 1f8f84d51edbdb097cc6195234b1cc6c [0,1,0,0,0,0|2,0,0]=3 2337 B12R1.28 CCCOCc1ccnc(n1)Cl 035fc8a5ba2d6ba9ab40b5af57c13d4a [0,1,0,0,0,0|2,0,0]=3 2338 B12R1.28 CCCOCc1cncc(c1)Br edd1bdceb7f06ff4f246dd95ac80987c [0,1,0,0,0,0|3,0,0]=4 2339 B12R1.28 CCCOCc1cncc(c1)C bb3d63bafa19bc290e3048469cddbe1d [0,1,0,0,0,0|3,0,0]=4 2340 B12R1.28 CCCOCc1cncc(c1)Cl f70d4a97328b3231fc0b7408c19e7a61 [0,1,0,0,0,0|3,0,0]=4 2341 B12R1.28 CCCOCc1cncc(c1)F 8bc920bf2f1a3562c1cb9628fd8a9828 [0,1,0,0,0,0|3,0,0]=4 2342 B12R1.28 CCCOCc1cncc(c1)I 50ec080ea05aa8d0062dba9e76d8769a [0,1,0,0,0,0|3,0,0]=4 2343 B12R1.28 CCCOCc1cncc(n1)Br d3ed14c41f76f70c7325ee44fd00ed4d [0,1,0,0,0,0|2,0,0]=3 2344 B12R1.28 CCCOCc1cncc(n1)Cl 8e925d6fb8dda24bade7d22931771265 [0,1,0,0,0,0|2,0,0]=3 2345 B12R1.28 CCCOCc1nccc(n1)C beb32d76a645457c4d2ffe611eda2fce [0,1,0,0,0,0|2,0,0]=3 2346 B12R1.28 CCCOCc1nccc(n1)Cl 30b1b062e70c7bcdb3df1d2cb714c3c5 [0,1,0,0,0,0|2,0,0]=3 2347 B12R1.28 CCNCCc1cccc(c1)Br 7407aa9054e4fecb39bb7bc51e44c0d3 [0,1,0,0,0,0|2,0,0]=3 2348 B12R1.28 CCNCCc1cccc(c1)C 0b37f05c941770177fcf98d56962ff79 [0,1,0,0,0,0|2,0,0]=3 2349 B12R1.28 CCNCCc1cccc(c1)Cl bb3e937b0c5020373ac596c6a62d7c6c [0,1,0,0,0,0|2,0,0]=3 2350 B12R1.28 CCNCCc1cccc(c1)F b16016975d35bb1c00404543a6d7428f [0,1,0,0,0,0|2,0,0]=3 2351 B12R1.28 CCNCCc1cccc(c1)I b6e52167904a817c188d41fbe58465fb [0,1,0,0,0,0|2,0,0]=3 2352 B12R1.28 CCNCCc1cccc(n1)C 3000329d88efe2a226f3965b3f0354b4 [0,1,0,0,0,0|1,0,0]=2 2353 B12R1.28 CCNCCc1ccnc(c1)C b0eee97d48001267d4883731afd184d6 [0,1,0,0,0,0|3,0,0]=4 2354 B12R1.28 CCNCCc1cncc(c1)F 26f3bd16e308a2630e5283c42fb1b1c0 [0,1,0,0,0,0|3,0,0]=4 2355 B12R1.28 CCOCCc1cc(ccn1)Br 9443eaadded1848b1ec48a92121d84d2 [0,1,0,0,0,0|1,0,0]=2 2356 B12R1.28 CCOCCc1cccc(c1)Br d0f3ea49e7aa78e8012da5ebab2edff3 [0,1,0,0,0,0|2,0,0]=3 2357 B12R1.28 CCOCCc1cccc(c1)C e15d01aec8191a21a4d3b1c3faee8943 [0,1,0,0,0,0|2,0,0]=3 2358 B12R1.28 CCOCCc1cccc(c1)Cl 7d0820bb278ad9103dd8a2b1a1cfa5f9 [0,1,0,0,0,0|2,0,0]=3 2359 B12R1.28 CCOCCc1cccc(c1)F e796a8f4963a7eb406c1cd938057b94f [0,1,0,0,0,0|2,0,0]=3 2360 B12R1.28 CCOCCc1cccc(c1)I 23bb8fca7b33897456b96ef7e6cee085 [0,1,0,0,0,0|2,0,0]=3 2361 B12R1.28 CCOCCc1cccc(n1)Br 9e12569e7cc680edf89a28b25fabeaa5 [0,1,0,0,0,0|1,0,0]=2 2362 B12R1.28 CCOCCc1cccc(n1)C 6a9b5ee2ad20867e1b3d0472855f1891 [0,1,0,0,0,0|1,0,0]=2 2363 B12R1.28 CCOCCc1cccc(n1)Cl 196e1e86d26cd7dae35a23baf851489a [0,1,0,0,0,0|1,0,0]=2 2364 B12R1.28 CCOCCc1ccnc(c1)Cl 110c9b886ad89a3b2bea68ea8c959cf1 [0,1,0,0,0,0|3,0,0]=4 2365 B12R1.28 CCOCCc1cncc(c1)F 3b025a833cca82078668ddbcc40f8614 [0,1,0,0,0,0|3,0,0]=4 2366 B12R1.28 CCOCCc1cncc(n1)Cl bebdee3618169fefb9142581278397d5 [0,1,0,0,0,0|2,0,0]=3 2367 B12R1.28 CCOCNc1cc(ccn1)Br b96bdbd051f259efac3000c136d655c9 [0,1,0,0,0,0|2,0,0]=3 2368 B12R1.28 CCOCNc1cc(ccn1)C 56f78bd464a08458fdc66b26fb670204 [0,1,0,0,0,0|2,0,0]=3 2369 B12R1.28 CCOCNc1cc(ccn1)F e69a54cfd95c6660a372889956c4cc67 [0,1,0,0,0,0|2,0,0]=3 2370 B12R1.28 CCOCNc1cc(cnn1)Br 682f713e552ed7f9a3c155fd3a4463ff [0,1,0,0,0,0|3,0,0]=4 2371 B12R1.28 CCOCNc1cc(cnn1)C 4187d98e1ce33f1b0ebc7fa99ffb6b54 [0,1,0,0,0,0|3,0,0]=4 2372 B12R1.28 CCOCNc1cc(ncn1)Br cf19375a0e19df6fa85d9ef6849190a8 [0,1,0,0,0,0|3,0,0]=4 2373 B12R1.28 CCOCNc1cc(ncn1)C ad396f3259283b752bb6111aeaec5cce [0,1,0,0,0,0|3,0,0]=4 2374 B12R1.28 CCOCNc1cc(ncn1)Cl f43d51e385aec507ddb5aa4fd5b4e6fc [0,1,0,0,0,0|3,0,0]=4 2375 B12R1.28 CCOCNc1cc(ncn1)F 5357786f05eea0b8bbddef0250ffa708 [0,1,0,0,0,0|3,0,0]=4 2376 B12R1.28 CCOCNc1cc(ncn1)I 8ef84e66efe6db8b55194fe02ce066d0 [0,1,0,0,0,0|3,0,0]=4 2377 B12R1.28 CCOCNc1cc[nH]c(=O)n1 7125c99f31c59ffc08d97a99eed5caab [0,1,0,0,0,0|3,0,0]=4 2378 B12R1.28 CCOCNc1cccc(c1)Br 0ccb51e60749641090e21729194b875a [0,1,0,0,0,0|3,0,0]=4 2379 B12R1.28 CCOCNc1cccc(c1)C 162df6bb26c921cb111acfe1026254c7 [0,1,0,0,0,0|3,0,0]=4 2380 B12R1.28 CCOCNc1cccc(c1)Cl 8824cc617cff1d1fc0ee83eee7763a48 [0,1,0,0,0,0|3,0,0]=4 2381 B12R1.28 CCOCNc1cccc(c1)F 902a3f5d7af769ec952b2e1a49065281 [0,1,0,0,0,0|3,0,0]=4 2382 B12R1.28 CCOCNc1cccc(c1)I fc22ee26d6a8e0a8eaed7b48226b7ddf [0,1,0,0,0,0|3,0,0]=4 2383 B12R1.28 CCOCNc1cccc(c1)S d6453b14e25a1bff2740b140957f26a4 [0,1,0,0,0,0|3,0,0]=4 2384 B12R1.28 CCOCNc1cccc(n1)Br 948a1250c447bc25bc2b2c7cd567785b [0,1,0,0,0,0|2,0,0]=3 2385 B12R1.28 CCOCNc1cccc(n1)C b8a166afd5371f8415501a70e25b6449 [0,1,0,0,0,0|2,0,0]=3 2386 B12R1.28 CCOCNc1cccc(n1)F 111c282efaf21a88c3d32915bfd8dff0 [0,1,0,0,0,0|2,0,0]=3 2387 B12R1.28 CCOCNc1cccc(n1)I 31b433bef758e2843c4d5c05e32b2cc9 [0,1,0,0,0,0|2,0,0]=3 2388 B12R1.28 CCOCNc1ccnc(n1)Br ee7550eb861fdddfe8521524e9f9e43d [0,1,0,0,0,0|3,0,0]=4 2389 B12R1.28 CCOCNc1ccnc(n1)C 0601ef9babad9a18a8436e11152da31d [0,1,0,0,0,0|3,0,0]=4 2390 B12R1.28 CCOCNc1ccnc(n1)Cl 3afb701427f2711f5d1c958c8e7926fe [0,1,0,0,0,0|3,0,0]=4 2391 B12R1.28 CCOCNc1ccnc(n1)F 4d63bdaa6869cee3c10517ef7e07f1ec [0,1,0,0,0,0|3,0,0]=4 2392 B12R1.28 CCOCNc1ccnc(n1)S 660a2ad4da8b4f7b8a08326e7133ba27 [0,1,0,0,0,0|3,0,0]=4 2393 B12R1.28 CCOCNc1nccc(=O)[nH]1 79a0c96d70f523bbdfd2f91bb7cae968 [0,1,0,0,0,0|3,0,0]=4 2394 B12R1.28 CCOCNc1nccc(n1)Br d4241035db1c3033b648a777a4e6146c [0,1,0,0,0,0|3,0,0]=4 2395 B12R1.28 CCOCNc1nccc(n1)C eca77f184b1d3ad0120762a8190c9c65 [0,1,0,0,0,0|3,0,0]=4 2396 B12R1.28 CCOCNc1nccc(n1)Cl a683b30042b7a61982ef42fda15ea9ff [0,1,0,0,0,0|3,0,0]=4 2397 B12R1.28 CCOCNc1nccc(n1)F edaec4d5895d00128178e0daff0ec4b9 [0,1,0,0,0,0|3,0,0]=4 2398 B12R1.28 CCOCNc1nccc(n1)I 4667ce1ab3254245e3427d93d08a6b92 [0,1,0,0,0,0|3,0,0]=4 2399 B12R1.28 CCOCNc1nccc(n1)S 5cc3df25c6d4b7a8ddd36a5d89910d66 [0,1,0,0,0,0|3,0,0]=4 2400 B12R1.28 CCOCOc1cc(ccn1)Br 2fedb485e585a8e76cffed5ea80261a3 [0,1,0,0,0,0|2,0,0]=3 2401 B12R1.28 CCOCOc1cc(ccn1)C 4758279579bf133a6080ae53d0b2b300 [0,1,0,0,0,0|2,0,0]=3 2402 B12R1.28 CCOCOc1cc(ccn1)F b8520094bf0b5f5d909ed3c75eb8dac0 [0,1,0,0,0,0|2,0,0]=3 2403 B12R1.28 CCOCOc1cc(ncn1)Br 07ca4a54c412365ccddb61d352828e50 [0,1,0,0,0,0|3,0,0]=4 2404 B12R1.28 CCOCOc1cc(ncn1)Cl 3fe567bb23e48638e016c76473a7c361 [0,1,0,0,0,0|3,0,0]=4 2405 B12R1.28 CCOCOc1cccc(c1)Br 9c820c07659370bda4abf9e35606d1b8 [0,1,0,0,0,0|3,0,0]=4 2406 B12R1.28 CCOCOc1cccc(c1)C 31ccd5439bd157242e4675fa35f1e6b7 [0,1,0,0,0,0|3,0,0]=4 2407 B12R1.28 CCOCOc1cccc(c1)Cl 240c59c898803bd54edd866e61892be5 [0,1,0,0,0,0|3,0,0]=4 2408 B12R1.28 CCOCOc1cccc(c1)F a5c721a2e96fa6032c4f4da63177d9c4 [0,1,0,0,0,0|3,0,0]=4 2409 B12R1.28 CCOCOc1cccc(c1)I bd32b3bb28eaf86d6a585505df5163f4 [0,1,0,0,0,0|3,0,0]=4 2410 B12R1.28 CCOCOc1cccc(c1)S 73f4e2d151548b59a146fc80d1dc0302 [0,1,0,0,0,0|3,0,0]=4 2411 B12R1.28 CCOCOc1cccc(n1)Br 9e6ad8cfd31aa73dce7f71cfa3073495 [0,1,0,0,0,0|2,0,0]=3 2412 B12R1.28 CCOCOc1cccc(n1)C 4ecde237bbe7c1b95edf50a5d5d21b7d [0,1,0,0,0,0|2,0,0]=3 2413 B12R1.28 CCOCOc1cccc(n1)F 7709cb5af1df8195d7ad7f3410c514b6 [0,1,0,0,0,0|2,0,0]=3 2414 B12R1.28 CCOCOc1ccnc(n1)C 3e2d69df3cddafe139d36bb253d48580 [0,1,0,0,0,0|3,0,0]=4 2415 B12R1.28 CCOCOc1ccnc(n1)Cl 80c8f423cf58df698ef40e25af2161fa [0,1,0,0,0,0|3,0,0]=4 2416 B12R1.28 CCOCOc1nccc(n1)Cl a30534c089a1b9f668f70d5f5c42e015 [0,1,0,0,0,0|3,0,0]=4 2417 B12R1.28 CCOCOc1nccc(n1)S a95b9b927ad69e562c11744fbab0b679 [0,1,0,0,0,0|3,0,0]=4 2418 B12R1.28 COCCNc1c[n+](ccn1)[O-] 8a4ddb737311d3bffe7c83ab339ca34e [0,1,0,0,0,0|3,0,0]=4 2419 B12R1.28 COCCNc1cc(ccn1)Br ee1d551725be2c9befc37ac5d1283453 [0,1,0,0,0,0|2,0,0]=3 2420 B12R1.28 COCCNc1cc(ccn1)C 85fc408ff8d9f056e577dc9758b32dad [0,1,0,0,0,0|2,0,0]=3 2421 B12R1.28 COCCNc1cc(ccn1)Cl d36458456327e7c28778da93c2109dd2 [0,1,0,0,0,0|2,0,0]=3 2422 B12R1.28 COCCNc1cc(ccn1)F 8e0823a72bbbe95689d3cb62938bb740 [0,1,0,0,0,0|2,0,0]=3 2423 B12R1.28 COCCNc1cc(ccn1)I 7dbd6bf0c1403ce3a4b0204b02747d4d [0,1,0,0,0,0|2,0,0]=3 2424 B12R1.28 COCCNc1cc(ccn1)O 7e7b9aa81faf890f17c56e59f494936e [0,1,0,0,0,0|2,0,0]=3 2425 B12R1.28 COCCNc1cc(cnn1)Br 23817a41da29fdb65fbf2f59f6d1a537 [0,1,0,0,0,0|3,0,0]=4 2426 B12R1.28 COCCNc1cc(cnn1)C 23a0549749b864318b7152d6bd66988d [0,1,0,0,0,0|3,0,0]=4 2427 B12R1.28 COCCNc1cc(cnn1)Cl c469a3f23ff3508cdafdb70afae276d8 [0,1,0,0,0,0|3,0,0]=4 2428 B12R1.28 COCCNc1cc(ncn1)Br 4a76609903003e0a320357fa3ccba8e4 [0,1,0,0,0,0|3,0,0]=4 2429 B12R1.28 COCCNc1cc(ncn1)C 77b0e21953d5117ac903e308b6b5f502 [0,1,0,0,0,0|3,0,0]=4 2430 B12R1.28 COCCNc1cc(ncn1)Cl b57cff79d5b67fa0aea6b45707c9385b [0,1,0,0,0,0|3,0,0]=4 2431 B12R1.28 COCCNc1cc(ncn1)F 4428dea0bbb6adc252f4958736ff1783 [0,1,0,0,0,0|3,0,0]=4 2432 B12R1.28 COCCNc1cc(ncn1)I 01415314e5385ac6e45643a1d1899a22 [0,1,0,0,0,0|3,0,0]=4 2433 B12R1.28 COCCNc1cc[nH]c(=O)n1 529c1f30fe2b8d9e61a628939f43f447 [0,1,0,0,0,0|3,0,0]=4 2434 B12R1.28 COCCNc1cccc(=O)[nH]1 3aa34b4af1ffe1bbf01fdd97da74fa71 [0,1,0,0,0,0|2,0,1]=4 2435 B12R1.28 COCCNc1cccc(c1)Br 71c77c9c3df6a6c91c314b11ceb1849d [0,1,0,0,0,0|3,0,0]=4 2436 B12R1.28 COCCNc1cccc(c1)C 5ef431b95b6bf510cdcd4f0b49dfc6bc [0,1,0,0,0,0|3,0,0]=4 2437 B12R1.28 COCCNc1cccc(c1)Cl 6598ecbda65ef257fda9088d5594ab03 [0,1,0,0,0,0|3,0,0]=4 2438 B12R1.28 COCCNc1cccc(c1)F 0a10994accbb1998222640a161ec1a85 [0,1,0,0,0,0|3,0,0]=4 2439 B12R1.28 COCCNc1cccc(c1)I e043208ffe523e43da91158a2f9dcbd0 [0,1,0,0,0,0|3,0,0]=4 2440 B12R1.28 COCCNc1cccc(c1)O 800174eec4e3bda203f4052df1e6de1f [0,1,0,0,0,0|3,0,0]=4 2441 B12R1.28 COCCNc1cccc(c1)S 90dc9fa308d381631b78a6cfa68bc57b [0,1,0,0,0,0|3,0,0]=4 2442 B12R1.28 COCCNc1cccc(n1)Br cb9250979eb107d81df46325b40a7e6d [0,1,0,0,0,0|2,0,0]=3 2443 B12R1.28 COCCNc1cccc(n1)C f7dcea4e399d78bbd42358205ed2bc77 [0,1,0,0,0,0|2,0,0]=3 2444 B12R1.28 COCCNc1cccc(n1)Cl 2908ab7a7ed37a11edcea5cdc2075367 [0,1,0,0,0,0|2,0,0]=3 2445 B12R1.28 COCCNc1cccc(n1)F 9836c3d58b7dd7401e24e5150b6f3f0e [0,1,0,0,0,0|2,0,0]=3 2446 B12R1.28 COCCNc1cccc(n1)I 4fa48ae7986ee991138495f48d05ed4b [0,1,0,0,0,0|2,0,0]=3 2447 B12R1.28 COCCNc1ccnc(n1)Br e66e1e15bd9caf90760107bd1ee44255 [0,1,0,0,0,0|3,0,0]=4 2448 B12R1.28 COCCNc1ccnc(n1)C 552ec8b79e2c803bbde9178c42ea7380 [0,1,0,0,0,0|3,0,0]=4 2449 B12R1.28 COCCNc1ccnc(n1)Cl a544307c2c92c11375fb32c81a9b883b [0,1,0,0,0,0|3,0,0]=4 2450 B12R1.28 COCCNc1ccnc(n1)F 2d80f74e5373f12c0f6c8c34e86461cd [0,1,0,0,0,0|3,0,0]=4 2451 B12R1.28 COCCNc1ccnc(n1)S 21d2a1307f338ed2da70f3aab5e13dcb [0,1,0,0,0,0|3,0,0]=4 2452 B12R1.28 COCCNc1cncc(n1)Br 89855e59698b69f56cd3fc10e18ce201 [0,1,0,0,0,0|3,0,0]=4 2453 B12R1.28 COCCNc1cncc(n1)C 885c9ecb665aa9cdfd9785bb311df172 [0,1,0,0,0,0|3,0,0]=4 2454 B12R1.28 COCCNc1cncc(n1)Cl 1b4ef2240590f5f2f52ee3ca49a5f370 [0,1,0,0,0,0|3,0,0]=4 2455 B12R1.28 COCCNc1cncc(n1)F db41f32a77dfb3172f721fbc66c14719 [0,1,0,0,0,0|3,0,0]=4 2456 B12R1.28 COCCNc1cncc(n1)O 518ce7587d3d5a4947fc2ecc2c45db95 [0,1,0,0,0,0|3,0,0]=4 2457 B12R1.28 COCCNc1nccc(=O)[nH]1 fdc26e27bda0ece92bdb62695ccb510a [0,1,0,0,0,0|3,0,0]=4 2458 B12R1.28 COCCNc1nccc(n1)Br 82db8d472d4879efe60ca05f1276c9eb [0,1,0,0,0,0|3,0,0]=4 2459 B12R1.28 COCCNc1nccc(n1)C 0985e9c8027466c85d7648b66cd9d8d2 [0,1,0,0,0,0|3,0,0]=4 2460 B12R1.28 COCCNc1nccc(n1)Cl 77847216c41663d4e49b62af694a7449 [0,1,0,0,0,0|3,0,0]=4 2461 B12R1.28 COCCNc1nccc(n1)F 7e370e44f429610e16a896df60d53038 [0,1,0,0,0,0|3,0,0]=4 2462 B12R1.28 COCCNc1nccc(n1)I 4dc6ab156155816d85d7ccc8292e7165 [0,1,0,0,0,0|3,0,0]=4 2463 B12R1.28 COCCNc1nccc(n1)S 239b1783f15f16c339346cb3261bf2a1 [0,1,0,0,0,0|3,0,0]=4 2464 B12R1.28 COCCOc1cc(ccn1)Br 7440a534c6c9b2c7ba635c34687f3bfc [0,1,0,0,0,0|2,0,0]=3 2465 B12R1.28 COCCOc1cc(ccn1)C cee4c5491bbe30d12f3bd1e5bf5e9661 [0,1,0,0,0,0|2,0,0]=3 2466 B12R1.28 COCCOc1cc(ccn1)Cl 78e1491df8e0396d7b0045053e26fb3a [0,1,0,0,0,0|2,0,0]=3 2467 B12R1.28 COCCOc1cc(ccn1)F 8dda2eb8ba05fbe3fa96bf80df27331b [0,1,0,0,0,0|2,0,0]=3 2468 B12R1.28 COCCOc1cc(ncn1)Br cdb154f8ac16714790dbd41fc8afda74 [0,1,0,0,0,0|3,0,0]=4 2469 B12R1.28 COCCOc1cc(ncn1)C 2d2facecff8e63241ad5265dbca573ee [0,1,0,0,0,0|3,0,0]=4 2470 B12R1.28 COCCOc1cc(ncn1)Cl 1a27357b024da952ed5acd49d41cd794 [0,1,0,0,0,0|3,0,0]=4 2471 B12R1.28 COCCOc1cccc(=O)[nH]1 c3e8ecdee4feded6b9db292d2c7128d1 [0,1,0,0,0,0|2,0,1]=4 2472 B12R1.28 COCCOc1cccc(c1)Br 47127a9e4c85bd373a527053864e820c [0,1,0,0,0,0|3,0,0]=4 2473 B12R1.28 COCCOc1cccc(c1)C cd5901f2ef21173701644b3d97a50385 [0,1,0,0,0,0|3,0,0]=4 2474 B12R1.28 COCCOc1cccc(c1)Cl e5978f2ed7da6efb1acfdff8b377cd31 [0,1,0,0,0,0|3,0,0]=4 2475 B12R1.28 COCCOc1cccc(c1)F 2680a1a7a75b0f57b56e4116ce7c123b [0,1,0,0,0,0|3,0,0]=4 2476 B12R1.28 COCCOc1cccc(c1)I 4ac55f904251f043d9bb19c5959fa499 [0,1,0,0,0,0|3,0,0]=4 2477 B12R1.28 COCCOc1cccc(c1)S e22098f19d4e0566337c51f23c7aa555 [0,1,0,0,0,0|3,0,0]=4 2478 B12R1.28 COCCOc1cccc(n1)Br 1fb71bc0878da06ac4795b741636bd1c [0,1,0,0,0,0|2,0,0]=3 2479 B12R1.28 COCCOc1cccc(n1)C 36c0fe9a371109bfd1e5b32be1554b55 [0,1,0,0,0,0|2,0,0]=3 2480 B12R1.28 COCCOc1cccc(n1)F 049c2621e59c939853f3de508dafbe00 [0,1,0,0,0,0|2,0,0]=3 2481 B12R1.28 COCCOc1ccnc(n1)C 4919f0944503499f635ac8c0a69ba908 [0,1,0,0,0,0|3,0,0]=4 2482 B12R1.28 COCCOc1ccnc(n1)Cl 95f229d1087e418dacee58c9f64f5d93 [0,1,0,0,0,0|3,0,0]=4 2483 B12R1.28 COCCOc1cncc(n1)Br dc666c85175d4d2953595a239427425f [0,1,0,0,0,0|3,0,0]=4 2484 B12R1.28 COCCOc1cncc(n1)C 03bf58604a8c84d5e2df3b30a65a2cb0 [0,1,0,0,0,0|3,0,0]=4 2485 B12R1.28 COCCOc1cncc(n1)Cl ba4dece59d6d956959f7af2116e2e50a [0,1,0,0,0,0|3,0,0]=4 2486 B12R1.28 COCCOc1nccc(n1)Cl babf7818996d362b0a9e20a6d855778f [0,1,0,0,0,0|3,0,0]=4 2487 B12R1.28 COCCOc1nccc(n1)S 105f4349fd7c97802d0454b10dad9ff9 [0,1,0,0,0,0|3,0,0]=4 2488 B12R1.28 COCNCc1cc(ccn1)Br dd3945e0927cb37503f7c04a7a982bbc [0,1,0,0,0,0|2,0,0]=3 2489 B12R1.28 COCNCc1cc(ccn1)C d805175601fb6ca8e978fc164e6a5c3f [0,1,0,0,0,0|2,0,0]=3 2490 B12R1.28 COCNCc1cc(ccn1)Cl cb4bae921586d8c2756296d517cff2e8 [0,1,0,0,0,0|2,0,0]=3 2491 B12R1.28 COCNCc1cc[nH]c(=O)n1 c2f31f01e72bd7672b65216df2120590 [0,1,0,0,0,0|3,0,0]=4 2492 B12R1.28 COCNCc1cccc(c1)Br bb26088e9109faf63b2c5aab82a0bab2 [0,1,0,0,0,0|3,0,0]=4 2493 B12R1.28 COCNCc1cccc(c1)C 2a616a68489893ac9fc4786c5bd224bd [0,1,0,0,0,0|3,0,0]=4 2494 B12R1.28 COCNCc1cccc(c1)Cl ca1fb393701eed7a8728da9d87eb9356 [0,1,0,0,0,0|3,0,0]=4 2495 B12R1.28 COCNCc1cccc(c1)F cb55f4e89d5e0d7efcab729f0b524b91 [0,1,0,0,0,0|3,0,0]=4 2496 B12R1.28 COCNCc1cccc(c1)I 5bb13b291c47f5546b24577b4829b678 [0,1,0,0,0,0|3,0,0]=4 2497 B12R1.28 COCNCc1cccc(n1)Br b5ae853ad471104a0e8142f2423589ad [0,1,0,0,0,0|2,0,0]=3 2498 B12R1.28 COCNCc1cccc(n1)C cdab8ec141bcfb97a079f3db879ac9cc [0,1,0,0,0,0|2,0,0]=3 2499 B12R1.28 COCNCc1cccc(n1)Cl ce8b827ea365018cec137ab326f8654f [0,1,0,0,0,0|2,0,0]=3 2500 B12R1.28 COCNCc1cccc(n1)F f44becff6669b8944b23bec591b4884e [0,1,0,0,0,0|2,0,0]=3 2501 B12R1.28 COCNCc1ccnc(n1)C c618323d8019d7e5de7d49cbfd2c929f [0,1,0,0,0,0|3,0,0]=4 2502 B12R1.28 COCNCc1cncc(n1)Cl 94ec9f229057dbcc3f64273850105eca [0,1,0,0,0,0|3,0,0]=4 2503 B12R1.28 COCNCc1nccc(n1)C 34d2a9303eb82a270d76c17ab2d5123d [0,1,0,0,0,0|3,0,0]=4 2504 B12R1.28 COCNCc1nccc(n1)Cl 41cef9a2aa9cb5b316cd5cfdfb526140 [0,1,0,0,0,0|3,0,0]=4 2505 B12R1.28 COCOCc1cc(ccn1)Br a310f049d6055b2642314946d42de21c [0,1,0,0,0,0|2,0,0]=3 2506 B12R1.28 COCOCc1cc(ccn1)C 0c5362de6a2ba86892971dcc793db187 [0,1,0,0,0,0|2,0,0]=3 2507 B12R1.28 COCOCc1cc(ccn1)Cl 0ddac00262a9c8feb431efc74d8795f3 [0,1,0,0,0,0|2,0,0]=3 2508 B12R1.28 COCOCc1cc(ccn1)F f2a6b28a81e694a0670e861cabf96044 [0,1,0,0,0,0|2,0,0]=3 2509 B12R1.28 COCOCc1cc(ccn1)I 1adf91a9a04cbce7cb3eab37ab694e56 [0,1,0,0,0,0|2,0,0]=3 2510 B12R1.28 COCOCc1cc(cnn1)C bd732f4b9817dc86585281815c816add [0,1,0,0,0,0|3,0,0]=4 2511 B12R1.28 COCOCc1cc(ncn1)C bb7c553c3a8a097dc18effcb8dc2af5e [0,1,0,0,0,0|3,0,0]=4 2512 B12R1.28 COCOCc1cc(ncn1)Cl fc13bf98bcd9ad5c36bf4fcf3d0065d1 [0,1,0,0,0,0|3,0,0]=4 2513 B12R1.28 COCOCc1cccc(c1)Br c6cf95c46ea4a77f05562ffd28f5ef20 [0,1,0,0,0,0|3,0,0]=4 2514 B12R1.28 COCOCc1cccc(c1)C 1d01d33a1b21700c4557a3eb1da01433 [0,1,0,0,0,0|3,0,0]=4 2515 B12R1.28 COCOCc1cccc(c1)Cl 725bbbfeda6dcaba43944749d2426b05 [0,1,0,0,0,0|3,0,0]=4 2516 B12R1.28 COCOCc1cccc(c1)F dcd42a5011050a007fb2422fa7534624 [0,1,0,0,0,0|3,0,0]=4 2517 B12R1.28 COCOCc1cccc(c1)I 4b864b485a6df11ced7a4a705c084d98 [0,1,0,0,0,0|3,0,0]=4 2518 B12R1.28 COCOCc1cccc(n1)Br c8a86839a1e3acfaafd34486b37f65d9 [0,1,0,0,0,0|2,0,0]=3 2519 B12R1.28 COCOCc1cccc(n1)C c14c63d4030f3848a09d28e8980375e1 [0,1,0,0,0,0|2,0,0]=3 2520 B12R1.28 COCOCc1cccc(n1)Cl bf7f280c5a1c9adc51c7a49fc21a9128 [0,1,0,0,0,0|2,0,0]=3 2521 B12R1.28 COCOCc1cccc(n1)F 270796bf2c9cfaf699ca24d668152740 [0,1,0,0,0,0|2,0,0]=3 2522 B12R1.28 COCOCc1cccc(n1)I fc0c3570d46fee9100c030de749cbfd6 [0,1,0,0,0,0|2,0,0]=3 2523 B12R1.28 COCOCc1ccnc(n1)C adfa32af6c6cda7c0fac3fb457e906c3 [0,1,0,0,0,0|3,0,0]=4 2524 B12R1.28 COCOCc1ccnc(n1)Cl 09fe838a472672a29c50238be9b32edb [0,1,0,0,0,0|3,0,0]=4 2525 B12R1.28 COCOCc1cncc(n1)Br 984dbcf50463511fde7d5ea1768d821e [0,1,0,0,0,0|3,0,0]=4 2526 B12R1.28 COCOCc1cncc(n1)Cl 95ce671b0f763cb7d63eee4023c053bd [0,1,0,0,0,0|3,0,0]=4 2527 B12R1.28 COCOCc1nccc(n1)C 9fb30cb92f772cd92786fa78bb8f0617 [0,1,0,0,0,0|3,0,0]=4 2528 B12R1.28 COCOCc1nccc(n1)Cl b0a33ea221b7070d62094a26888e6be6 [0,1,0,0,0,0|3,0,0]=4 2529 B12R1.28 CSCCNc1cc(ccn1)Br f55ebecf88a6898a74eacd6c75454672 [0,1,0,0,0,0|2,0,0]=3 2530 B12R1.28 CSCCNc1cc(ccn1)C c04c052f88fa57c2da5a8a691a58edbf [0,1,0,0,0,0|2,0,0]=3 2531 B12R1.28 CSCCNc1cc(ccn1)Cl e2e1ecd8f937a18bd1dd9a87a53d1d09 [0,1,0,0,0,0|2,0,0]=3 2532 B12R1.28 CSCCNc1cc(ccn1)F 525b543ca267a821e8df03435f44db1c [0,1,0,0,0,0|2,0,0]=3 2533 B12R1.28 CSCCNc1cc(ccn1)I 9a418a791edfeef13db813b889ada388 [0,1,0,0,0,0|2,0,0]=3 2534 B12R1.28 CSCCNc1cc(cnn1)Br 08d4fda1661e953cc7954e44f3e17251 [0,1,0,0,0,0|3,0,0]=4 2535 B12R1.28 CSCCNc1cc(cnn1)C 40cf199490f3b4197dec24a14790a4c3 [0,1,0,0,0,0|3,0,0]=4 2536 B12R1.28 CSCCNc1cc(cnn1)Cl 8b291703011b735acb2c864d3f7a3bfe [0,1,0,0,0,0|3,0,0]=4 2537 B12R1.28 CSCCNc1cc(ncn1)Br 5fadada991dbf5011c9618ee72e57f46 [0,1,0,0,0,0|3,0,0]=4 2538 B12R1.28 CSCCNc1cc(ncn1)C 856293a941cb565da79aebb4fcc8adc0 [0,1,0,0,0,0|3,0,0]=4 2539 B12R1.28 CSCCNc1cc(ncn1)Cl 433a463ce4481d1ee2ab199a5abe072e [0,1,0,0,0,0|3,0,0]=4 2540 B12R1.28 CSCCNc1cc(ncn1)F df990bea976061c37869eb2181483be3 [0,1,0,0,0,0|3,0,0]=4 2541 B12R1.28 CSCCNc1cc(ncn1)I 21144d0e7708e2dfd07b5881d76af737 [0,1,0,0,0,0|3,0,0]=4 2542 B12R1.28 CSCCNc1cc[nH]c(=O)n1 86017f0f022e925d54157e7366a3a21a [0,1,0,0,0,0|3,0,0]=4 2543 B12R1.28 CSCCNc1cccc(c1)Br 2be2fa3518e1fc60eb8a91ac4eeb1411 [0,1,0,0,0,0|3,0,0]=4 2544 B12R1.28 CSCCNc1cccc(c1)C bc9699ba8d498079a42024ba3e1c7ae3 [0,1,0,0,0,0|3,0,0]=4 2545 B12R1.28 CSCCNc1cccc(c1)Cl 5f0045ca103d5e06a23a5bbfdec86f6f [0,1,0,0,0,0|3,0,0]=4 2546 B12R1.28 CSCCNc1cccc(c1)F 1edcbda664525cbf7d6a7d8f869a6799 [0,1,0,0,0,0|3,0,0]=4 2547 B12R1.28 CSCCNc1cccc(c1)I 6a7d517cf2b82db23cd86cdaa1c0fb7f [0,1,0,0,0,0|3,0,0]=4 2548 B12R1.28 CSCCNc1cccc(c1)S dfae6331ccc7a6ebb67631202e57efeb [0,1,0,0,0,0|3,0,0]=4 2549 B12R1.28 CSCCNc1cccc(n1)Br 8642fec7fbf15294225be5e172cfda57 [0,1,0,0,0,0|2,0,0]=3 2550 B12R1.28 CSCCNc1cccc(n1)C f426c7a570621e4f58e278339592629e [0,1,0,0,0,0|2,0,0]=3 2551 B12R1.28 CSCCNc1cccc(n1)Cl 6c94ca8271cc57fb3f058d693f1d94ef [0,1,0,0,0,0|2,0,0]=3 2552 B12R1.28 CSCCNc1cccc(n1)F aff439da4da37ee4d7ca0f71a0f81826 [0,1,0,0,0,0|2,0,0]=3 2553 B12R1.28 CSCCNc1cccc(n1)I 0474894e0b23646e54ea484560cfba5e [0,1,0,0,0,0|2,0,0]=3 2554 B12R1.28 CSCCNc1ccnc(n1)Br a84ccd6d37e53aa407747c39eae1cc79 [0,1,0,0,0,0|3,0,0]=4 2555 B12R1.28 CSCCNc1ccnc(n1)C 998610dafd16fdcd973995c0de75f401 [0,1,0,0,0,0|3,0,0]=4 2556 B12R1.28 CSCCNc1ccnc(n1)Cl ba45d6fd9f8adaceec48ebf2f0320d54 [0,1,0,0,0,0|3,0,0]=4 2557 B12R1.28 CSCCNc1ccnc(n1)F e36507394bb0bf6a1c4b108205e621d7 [0,1,0,0,0,0|3,0,0]=4 2558 B12R1.28 CSCCNc1ccnc(n1)S d99ca2cf9d0f5ea8d2b6739f46a65666 [0,1,0,0,0,0|3,0,0]=4 2559 B12R1.28 CSCCNc1cncc(n1)Br b9687cb5424e82a74960d3d2252c3ce0 [0,1,0,0,0,0|3,0,0]=4 2560 B12R1.28 CSCCNc1cncc(n1)C a055c78237585a6c21806b45ca76013e [0,1,0,0,0,0|3,0,0]=4 2561 B12R1.28 CSCCNc1cncc(n1)Cl d4e91dbb2eb662e48ec581639c856833 [0,1,0,0,0,0|3,0,0]=4 2562 B12R1.28 CSCCNc1cncc(n1)F 2cc080dde888a1ccd529d32498ec8db5 [0,1,0,0,0,0|3,0,0]=4 2563 B12R1.28 CSCCNc1nccc(=O)[nH]1 74dd875329725720821c21f8e20ed1d5 [0,1,0,0,0,0|3,0,0]=4 2564 B12R1.28 CSCCNc1nccc(n1)Br f979203763f8c619b5789e78963c954c [0,1,0,0,0,0|3,0,0]=4 2565 B12R1.28 CSCCNc1nccc(n1)C c437277338b769c85e16ff7b8ad07f5e [0,1,0,0,0,0|3,0,0]=4 2566 B12R1.28 CSCCNc1nccc(n1)Cl 0bbab3a164d302bbaac87c341ded44f8 [0,1,0,0,0,0|3,0,0]=4 2567 B12R1.28 CSCCNc1nccc(n1)F b9e652b715f3ef488daa30e341a51a0f [0,1,0,0,0,0|3,0,0]=4 2568 B12R1.28 CSCCNc1nccc(n1)I 90dd98d7f13694583d6ac810e58435ae [0,1,0,0,0,0|3,0,0]=4 2569 B12R1.28 CSCCNc1nccc(n1)S d7414966e584f105952e079467cec82d [0,1,0,0,0,0|3,0,0]=4 2570 B12R1.28 CSCCOc1cc(ccn1)Br f14010427d159a0ba200cd48081c50d1 [0,1,0,0,0,0|2,0,0]=3 2571 B12R1.28 CSCCOc1cc(ccn1)C fc8ea7dd8a41b498e45bb0e7fec224f9 [0,1,0,0,0,0|2,0,0]=3 2572 B12R1.28 CSCCOc1cc(ccn1)Cl ec9c671b287f4955b24a29401a6ca8a9 [0,1,0,0,0,0|2,0,0]=3 2573 B12R1.28 CSCCOc1cc(ccn1)F 438f5f6e0bec4c2eecfd493ed213733e [0,1,0,0,0,0|2,0,0]=3 2574 B12R1.28 CSCCOc1cc(ncn1)Br 9079d27a7442a5df840ba617448f6bcc [0,1,0,0,0,0|3,0,0]=4 2575 B12R1.28 CSCCOc1cc(ncn1)C 1d04a781109600858b1f1c083659253b [0,1,0,0,0,0|3,0,0]=4 2576 B12R1.28 CSCCOc1cc(ncn1)Cl 74f56dccf5a246a5e662114b1be54b38 [0,1,0,0,0,0|3,0,0]=4 2577 B12R1.28 CSCCOc1cccc(=O)[nH]1 7d2860da65d0f0884849ae4bfe8104bf [0,1,0,0,0,0|2,0,1]=4 2578 B12R1.28 CSCCOc1cccc(c1)Br 22a266b55a442675663ee39f1963e18c [0,1,0,0,0,0|3,0,0]=4 2579 B12R1.28 CSCCOc1cccc(c1)C 2e96c03f657c1253187506863a145fa5 [0,1,0,0,0,0|3,0,0]=4 2580 B12R1.28 CSCCOc1cccc(c1)Cl 493920a961deb1373d6fe513a96a2b82 [0,1,0,0,0,0|3,0,0]=4 2581 B12R1.28 CSCCOc1cccc(c1)F 19057a849912d54d32bc3de85a26e17a [0,1,0,0,0,0|3,0,0]=4 2582 B12R1.28 CSCCOc1cccc(c1)I 697230f0fb8ef2a3cf1830721d34217b [0,1,0,0,0,0|3,0,0]=4 2583 B12R1.28 CSCCOc1cccc(c1)S 36b7c7c9003edf97400f1e25f53ec6c1 [0,1,0,0,0,0|3,0,0]=4 2584 B12R1.28 CSCCOc1cccc(n1)Br 0eb0ffd4a04e46c27546a692af50b2ce [0,1,0,0,0,0|2,0,0]=3 2585 B12R1.28 CSCCOc1cccc(n1)C 6f93f43155425ac78d16777d1b59a1aa [0,1,0,0,0,0|2,0,0]=3 2586 B12R1.28 CSCCOc1cccc(n1)F a9e62f51d879fdf0185d2774135f66bc [0,1,0,0,0,0|2,0,0]=3 2587 B12R1.28 CSCCOc1ccnc(n1)C 6af39dddd961c8a7bd63c610188d0c0b [0,1,0,0,0,0|3,0,0]=4 2588 B12R1.28 CSCCOc1ccnc(n1)Cl 40479275ab619f74d2078c91a4571748 [0,1,0,0,0,0|3,0,0]=4 2589 B12R1.28 CSCCOc1cncc(n1)Br 9a412a6a51113d7a018bacf66a503d83 [0,1,0,0,0,0|3,0,0]=4 2590 B12R1.28 CSCCOc1cncc(n1)C e398c77db9c001cb2168c9d1c3ca051a [0,1,0,0,0,0|3,0,0]=4 2591 B12R1.28 CSCCOc1cncc(n1)Cl 4003b4fcfa366bfb0e51611b5894bfe4 [0,1,0,0,0,0|3,0,0]=4 2592 B12R1.28 CSCCOc1nccc(n1)Cl 788661c0f121acdce0775c70f1981c1d [0,1,0,0,0,0|3,0,0]=4 2593 B12R1.28 CSCCOc1nccc(n1)S f0e78abdf62877e60b8abd91f9babec5 [0,1,0,0,0,0|3,0,0]=4 2594 B12R1.28 CSCNCc1cc(ccn1)Br ac4778f4042e96dbf652a2e02a002c16 [0,1,0,0,0,0|2,0,0]=3 2595 B12R1.28 CSCNCc1cc(ccn1)C f2acce9f98dc996e07e9db0968cf8f76 [0,1,0,0,0,0|2,0,0]=3 2596 B12R1.28 CSCNCc1cc(ccn1)Cl 01b2b97587b416c77fd00040dd41150e [0,1,0,0,0,0|2,0,0]=3 2597 B12R1.28 CSCNCc1cc[nH]c(=O)n1 03f393af61bc01392994a2ea44318f3b [0,1,0,0,0,0|3,0,0]=4 2598 B12R1.28 CSCNCc1cccc(c1)Br f9d3f3c5610d32f15a4cccc9e2ad306a [0,1,0,0,0,0|3,0,0]=4 2599 B12R1.28 CSCNCc1cccc(c1)C 6a6a4f6b666f5b67a7439084c9fcaccb [0,1,0,0,0,0|3,0,0]=4 2600 B12R1.28 CSCNCc1cccc(c1)Cl 222e4156e96d8b1d469c8abc375a9dee [0,1,0,0,0,0|3,0,0]=4 2601 B12R1.28 CSCNCc1cccc(c1)F a17bfd137359dc9e621dd8a626e9d1f1 [0,1,0,0,0,0|3,0,0]=4 2602 B12R1.28 CSCNCc1cccc(c1)I 5225bad32a989b6a0930ae62d876e258 [0,1,0,0,0,0|3,0,0]=4 2603 B12R1.28 CSCNCc1cccc(n1)Br 7f69fdebad4ed872cf3c71f3cac4a8cd [0,1,0,0,0,0|2,0,0]=3 2604 B12R1.28 CSCNCc1cccc(n1)C 388c4a1188fa581f864d80ef7a12c605 [0,1,0,0,0,0|2,0,0]=3 2605 B12R1.28 CSCNCc1cccc(n1)Cl 722cdca9f1307b3f32769f86636d6634 [0,1,0,0,0,0|2,0,0]=3 2606 B12R1.28 CSCNCc1cccc(n1)F adaff31e11c6295a0b89a2b51e9b62c3 [0,1,0,0,0,0|2,0,0]=3 2607 B12R1.28 CSCNCc1ccnc(n1)C d4ff1a37c3ab74017d41e2b58af03442 [0,1,0,0,0,0|3,0,0]=4 2608 B12R1.28 CSCNCc1cncc(n1)Cl 9504114d8015be7d5bc65b64139ba1f6 [0,1,0,0,0,0|3,0,0]=4 2609 B12R1.28 CSCNCc1nccc(n1)C 75d3c57cc0d53e1b704607e2eb540ab9 [0,1,0,0,0,0|3,0,0]=4 2610 B12R1.28 CSCNCc1nccc(n1)Cl 1100fecfbe95981366d636e72fdff106 [0,1,0,0,0,0|3,0,0]=4 2611 B12R1.28 CSCOCc1cc(ccn1)Br fb3cbe61f6dc9c1f7b68d37b98f1cbf8 [0,1,0,0,0,0|2,0,0]=3 2612 B12R1.28 CSCOCc1cc(ccn1)C c75a11467c2868303042597f1f82d8bb [0,1,0,0,0,0|2,0,0]=3 2613 B12R1.28 CSCOCc1cc(ccn1)Cl 8bbd23df78370483800f12408bd52e5b [0,1,0,0,0,0|2,0,0]=3 2614 B12R1.28 CSCOCc1cc(ccn1)F 26a0d1856be398e8c17f4deddef5cc3c [0,1,0,0,0,0|2,0,0]=3 2615 B12R1.28 CSCOCc1cc(ccn1)I 51198343be16bbd63479d559eeaa0ef2 [0,1,0,0,0,0|2,0,0]=3 2616 B12R1.28 CSCOCc1cc(cnn1)C 4bcb7cbb725b516f40c0da833e38e946 [0,1,0,0,0,0|3,0,0]=4 2617 B12R1.28 CSCOCc1cc(ncn1)C fbff6745e4ce9a67e3dc62a1db87c82f [0,1,0,0,0,0|3,0,0]=4 2618 B12R1.28 CSCOCc1cc(ncn1)Cl f7d8239a89f386a1afe35e77de9d0f9e [0,1,0,0,0,0|3,0,0]=4 2619 B12R1.28 CSCOCc1cccc(c1)Br 09acea27bc86a74f70f0ecb6b1b36467 [0,1,0,0,0,0|3,0,0]=4 2620 B12R1.28 CSCOCc1cccc(c1)C b92fb5422a027ebfba59db2e4c7028a2 [0,1,0,0,0,0|3,0,0]=4 2621 B12R1.28 CSCOCc1cccc(c1)Cl 03ec11799dc23912722d9ec83bd2bc58 [0,1,0,0,0,0|3,0,0]=4 2622 B12R1.28 CSCOCc1cccc(c1)F 90ab928cefee5e8c1de1e196d6909a20 [0,1,0,0,0,0|3,0,0]=4 2623 B12R1.28 CSCOCc1cccc(c1)I 50057e553d005950b6faf0768541a1d9 [0,1,0,0,0,0|3,0,0]=4 2624 B12R1.28 CSCOCc1cccc(n1)Br 11671de6c59084fb78d91ac3dfc4a6b6 [0,1,0,0,0,0|2,0,0]=3 2625 B12R1.28 CSCOCc1cccc(n1)C 07c838f8457a3dba0190ae958e1dc32f [0,1,0,0,0,0|2,0,0]=3 2626 B12R1.28 CSCOCc1cccc(n1)Cl 659db1d5be790a46765ec37e935c4d7b [0,1,0,0,0,0|2,0,0]=3 2627 B12R1.28 CSCOCc1cccc(n1)F 93b2b939cd80c030e0243ec1b45220c2 [0,1,0,0,0,0|2,0,0]=3 2628 B12R1.28 CSCOCc1cccc(n1)I 4ced7832182a857c949f9a60f423bf53 [0,1,0,0,0,0|2,0,0]=3 2629 B12R1.28 CSCOCc1ccnc(n1)C 9b134fe6f11c4bea33d7e2628040aade [0,1,0,0,0,0|3,0,0]=4 2630 B12R1.28 CSCOCc1ccnc(n1)Cl f10ffbfbbb6fc95f6feb1335c3ce9ec7 [0,1,0,0,0,0|3,0,0]=4 2631 B12R1.28 CSCOCc1cncc(n1)Br fcf6616d9c74f8a90d75b96618467bad [0,1,0,0,0,0|3,0,0]=4 2632 B12R1.28 CSCOCc1cncc(n1)Cl dfc120d8df75a438e48e3772cf049da6 [0,1,0,0,0,0|3,0,0]=4 2633 B12R1.28 CSCOCc1nccc(n1)C 82ffc342ae08b351ecb5801889cc34ff [0,1,0,0,0,0|3,0,0]=4 2634 B12R1.28 Cc1cc(ncn1)COCCF d4de797c668788ece30e12bd77ba715e [0,1,0,0,0,0|3,0,0]=4 2635 B12R1.28 Cc1cc(ncn1)COCCS 40abe38cc7621a77fd9217d3d8b8c295 [0,1,0,0,0,0|3,0,0]=4 2636 B12R1.28 Cc1cc(ncn1)NCCCF e07fcdc5813faff74fde00ee88fba0c9 [0,1,0,0,0,0|3,0,0]=4 2637 B12R1.28 Cc1cc(ncn1)NCCCO 308ee8fc07636e8c521ee82fea88547d [0,1,0,0,0,0|3,0,0]=4 2638 B12R1.28 Cc1cc(ncn1)NCCCS aa665fc1c01eb7c3d422859b8cd7310a [0,1,0,0,0,0|3,0,0]=4 2639 B12R1.28 Cc1cc(ncn1)OCCCF 34444eff5157d6a38064beed4a0da25f [0,1,0,0,0,0|3,0,0]=4 2640 B12R1.28 Cc1cc(ncn1)OCCCS a94576a4d882f6886baeb305c363d9b4 [0,1,0,0,0,0|3,0,0]=4 2641 B12R1.28 Cc1cccc(c1)CCNCF d55c688e9678c30b2351e4cbdd7450e3 [0,1,0,0,0,0|3,0,0]=4 2642 B12R1.28 Cc1cccc(c1)CCNCO 93a28a38a3a795fa33735682cc180d19 [0,1,0,0,0,0|3,0,0]=4 2643 B12R1.28 Cc1cccc(c1)CCOCF 51adc91e98de89cba91135d6bf1dd274 [0,1,0,0,0,0|3,0,0]=4 2644 B12R1.28 Cc1cccc(c1)CNCCBr 3d16c699f5a0003cb132db328a6a1f86 [0,1,0,0,0,0|3,0,0]=4 2645 B12R1.28 Cc1cccc(c1)CNCCF 17bd3c1f7a7258949baa12b282458bf4 [0,1,0,0,0,0|3,0,0]=4 2646 B12R1.28 Cc1cccc(c1)CNCCI 4c70aa23716d542f76ffcfdb09c9ba53 [0,1,0,0,0,0|3,0,0]=4 2647 B12R1.28 Cc1cccc(c1)CNCCO 8b0e4b8bd6a8c2f5f9d0a2d7f28d8116 [0,1,0,0,0,0|3,0,0]=4 2648 B12R1.28 Cc1cccc(c1)CNCCS 6a17b6589ee9d764e46bc98d6105f564 [0,1,0,0,0,0|3,0,0]=4 2649 B12R1.28 Cc1cccc(c1)COCCF 282634da35f199c5d636161a62066198 [0,1,0,0,0,0|3,0,0]=4 2650 B12R1.28 Cc1cccc(c1)COCCS 43a82caf41cdb6cc66e5768facfe490a [0,1,0,0,0,0|3,0,0]=4 2651 B12R1.28 Cc1cccc(c1)NCCCCl 0c66be29c2ddbeb41e45314daca52e55 [0,1,0,0,0,0|3,0,0]=4 2652 B12R1.28 Cc1cccc(c1)NCCCF e35a42dec1b1763b35d2ce4706c75e8c [0,1,0,0,0,0|3,0,0]=4 2653 B12R1.28 Cc1cccc(c1)NCCCO 6331c0265cdcc1d7fe5e30a546d60d68 [0,1,0,0,0,0|3,0,0]=4 2654 B12R1.28 Cc1cccc(c1)NCCCS 39f4ada09e3aebd3aff579c9d0309860 [0,1,0,0,0,0|3,0,0]=4 2655 B12R1.28 Cc1cccc(c1)OCCCF 392809c7bd11ebb7313f38ee4c726962 [0,1,0,0,0,0|3,0,0]=4 2656 B12R1.28 Cc1cccc(c1)OCCCS a9b7aad0970a3fec06a2e6b91591e562 [0,1,0,0,0,0|3,0,0]=4 2657 B12R1.28 Cc1cccc(n1)CCNC=O 34178e3cf65442deb681571eee9dcf9e [0,1,0,0,0,0|2,0,1]=4 2658 B12R1.28 Cc1cccc(n1)CCNCF 7e60ec7089ffd5716237ba7ea9cbdca5 [0,1,0,0,0,0|2,0,0]=3 2659 B12R1.28 Cc1cccc(n1)CCNCO ebc11abdc23f379c9b961aa9e165e2f5 [0,1,0,0,0,0|2,0,0]=3 2660 B12R1.28 Cc1cccc(n1)CCOCF 7fdaafd85f6a28954b123ffbfa1a3c95 [0,1,0,0,0,0|2,0,0]=3 2661 B12R1.28 Cc1cccc(n1)CNCC#N d9e30527faa0786c13a93e550f387899 [0,1,0,0,0,0|2,0,1]=4 2662 B12R1.28 Cc1cccc(n1)CNCC=O fb1a512869ca948fc8b9fec1cf03f713 [0,1,0,0,0,0|2,0,1]=4 2663 B12R1.28 Cc1cccc(n1)CNCCBr 8626aa1de665672811adba9a24173986 [0,1,0,0,0,0|2,0,0]=3 2664 B12R1.28 Cc1cccc(n1)CNCCF 3d3f13359ec6cfa3dc5b9647bd1f5a89 [0,1,0,0,0,0|2,0,0]=3 2665 B12R1.28 Cc1cccc(n1)CNCCI 3547fd153515965ed1b18dbc7136463f [0,1,0,0,0,0|2,0,0]=3 2666 B12R1.28 Cc1cccc(n1)CNCCO 49febb205ff87d94516909228abae49c [0,1,0,0,0,0|2,0,0]=3 2667 B12R1.28 Cc1cccc(n1)CNCCS 5555adc09b5e67a20220f41797503d66 [0,1,0,0,0,0|2,0,0]=3 2668 B12R1.28 Cc1cccc(n1)COCC#N be22b87087fb4bd70733ee1d101ad683 [0,1,0,0,0,0|2,0,1]=4 2669 B12R1.28 Cc1cccc(n1)COCC=O 51158135a2c92aaf0cd5de9c20b173f4 [0,1,0,0,0,0|2,0,1]=4 2670 B12R1.28 Cc1cccc(n1)COCCF 303f1500c1da8be853bf17d6116eda13 [0,1,0,0,0,0|2,0,0]=3 2671 B12R1.28 Cc1cccc(n1)COCCS a19245d1fcd3f929a339be43bfdfe8ea [0,1,0,0,0,0|2,0,0]=3 2672 B12R1.28 Cc1cccc(n1)NCCC#N 4771215d18fd64b76579926c5641327d [0,1,0,0,0,0|2,0,1]=4 2673 B12R1.28 Cc1cccc(n1)NCCC=O a154f53558954f2ac83befdd873f84f3 [0,1,0,0,0,0|2,0,1]=4 2674 B12R1.28 Cc1cccc(n1)NCCCCl 2867bd346bd7aec1c883d4e67f712031 [0,1,0,0,0,0|2,0,0]=3 2675 B12R1.28 Cc1cccc(n1)NCCCF 087d9f8e92eefe1da495be10f4dcc044 [0,1,0,0,0,0|2,0,0]=3 2676 B12R1.28 Cc1cccc(n1)NCCCO 75672200db294e0a5afb9ac695cd6750 [0,1,0,0,0,0|2,0,0]=3 2677 B12R1.28 Cc1cccc(n1)NCCCS b96a9be42a6ab1eec8dbb4dc80efb0a8 [0,1,0,0,0,0|2,0,0]=3 2678 B12R1.28 Cc1cccc(n1)NCCON ebbb2fca0268094cf4e4909fde01cad0 [0,1,0,0,0,0|3,0,0]=4 2679 B12R1.28 Cc1cccc(n1)OCCC#N 8e462e8969033271be0542b70712b7a5 [0,1,0,0,0,0|2,0,1]=4 2680 B12R1.28 Cc1cccc(n1)OCCC=O fd9585f40f0777607768f6bb19035dd4 [0,1,0,0,0,0|2,0,1]=4 2681 B12R1.28 Cc1cccc(n1)OCCCF dd27d099e0e7f87accaaa6359cb6da8f [0,1,0,0,0,0|2,0,0]=3 2682 B12R1.28 Cc1cccc(n1)OCCCS b9a8db49fc77debcd073d9b8d8a3ae38 [0,1,0,0,0,0|2,0,0]=3 2683 B12R1.28 Cc1ccnc(c1)CNCC#N 854c00be39cc991db13acd2fe63733b2 [0,1,0,0,0,0|2,0,1]=4 2684 B12R1.28 Cc1ccnc(c1)CNCC=O 28228d007ba1a8a24bd903639e4fd731 [0,1,0,0,0,0|2,0,1]=4 2685 B12R1.28 Cc1ccnc(c1)CNCCBr 5504747fe6664146ba9bb2f12301507e [0,1,0,0,0,0|2,0,0]=3 2686 B12R1.28 Cc1ccnc(c1)CNCCF 871fe36aa72569bc87d32a3842831334 [0,1,0,0,0,0|2,0,0]=3 2687 B12R1.28 Cc1ccnc(c1)CNCCO 74953434992abc476ab9b35e6dc1b58f [0,1,0,0,0,0|2,0,0]=3 2688 B12R1.28 Cc1ccnc(c1)CNCCS 138cd4b29cd2406e21a046031a8fbadb [0,1,0,0,0,0|2,0,0]=3 2689 B12R1.28 Cc1ccnc(c1)COCC#N efd075c7f2bab8f3aac76439c9f297b7 [0,1,0,0,0,0|2,0,1]=4 2690 B12R1.28 Cc1ccnc(c1)COCC=O d89515926bd44391ec7ad1d8cd78b16b [0,1,0,0,0,0|2,0,1]=4 2691 B12R1.28 Cc1ccnc(c1)COCCF e6041e94ae61bfa443f7b4ddefb60bb5 [0,1,0,0,0,0|2,0,0]=3 2692 B12R1.28 Cc1ccnc(c1)COCCS 62812e4e545890d025c804ce686f343b [0,1,0,0,0,0|2,0,0]=3 2693 B12R1.28 Cc1ccnc(c1)NCCC#N d291c8ebae1fe0c5cd235862df182822 [0,1,0,0,0,0|2,0,1]=4 2694 B12R1.28 Cc1ccnc(c1)NCCC=O cb92bcdf0f2bac82c357d594ee9359b6 [0,1,0,0,0,0|2,0,1]=4 2695 B12R1.28 Cc1ccnc(c1)NCCCCl c7860a54e8e9214c8bba1958aefd8669 [0,1,0,0,0,0|2,0,0]=3 2696 B12R1.28 Cc1ccnc(c1)NCCCF bbb92cfd5d99b292d55da6ed0a755b80 [0,1,0,0,0,0|2,0,0]=3 2697 B12R1.28 Cc1ccnc(c1)NCCCO 9fc4b5dcbc7244be78b872d1fad6bf91 [0,1,0,0,0,0|2,0,0]=3 2698 B12R1.28 Cc1ccnc(c1)NCCCS f29e43be2a52ce85ecf0de3ed63b1204 [0,1,0,0,0,0|2,0,0]=3 2699 B12R1.28 Cc1ccnc(c1)NCCON 93d834e18d17da7dc6cc81b756f859f0 [0,1,0,0,0,0|3,0,0]=4 2700 B12R1.28 Cc1ccnc(c1)OCCC#N 2ccdde2dd2743bab6f578c337b31fb74 [0,1,0,0,0,0|2,0,1]=4 2701 B12R1.28 Cc1ccnc(c1)OCCC=O 77a44e04d1af8344b36a331edd495e0a [0,1,0,0,0,0|2,0,1]=4 2702 B12R1.28 Cc1ccnc(c1)OCCCF 065b0a2c6268255b8aac649a7f471d1e [0,1,0,0,0,0|2,0,0]=3 2703 B12R1.28 Cc1ccnc(c1)OCCCS b4804cd6364a4076e0d4343eb623d733 [0,1,0,0,0,0|2,0,0]=3 2704 B12R1.28 Cc1ccnc(n1)CNCCBr 4a66f199cacc7cee1f2457164db1001b [0,1,0,0,0,0|3,0,0]=4 2705 B12R1.28 Cc1ccnc(n1)CNCCF 629489946d84e5690ca5b0a212785149 [0,1,0,0,0,0|3,0,0]=4 2706 B12R1.28 Cc1ccnc(n1)CNCCI 41e3b658d7162db1d2817ad6227394f6 [0,1,0,0,0,0|3,0,0]=4 2707 B12R1.28 Cc1ccnc(n1)CNCCO 0631f59921bbc5655d66225600624ec9 [0,1,0,0,0,0|3,0,0]=4 2708 B12R1.28 Cc1ccnc(n1)CNCCS ceeb160b1f0cf3d6c7925f486b8e4ed4 [0,1,0,0,0,0|3,0,0]=4 2709 B12R1.28 Cc1ccnc(n1)COCCF 15554f7aa4c5fdb7ea078516db0e67d8 [0,1,0,0,0,0|3,0,0]=4 2710 B12R1.28 Cc1ccnc(n1)COCCS a7de909a1a0ab89bb40ff48243634cc1 [0,1,0,0,0,0|3,0,0]=4 2711 B12R1.28 Cc1ccnc(n1)NCCCF 2bad86141e6af5e50daddc23b19f8b5b [0,1,0,0,0,0|3,0,0]=4 2712 B12R1.28 Cc1ccnc(n1)NCCCO 25c3a27b347b2eabd01e84b7832b585d [0,1,0,0,0,0|3,0,0]=4 2713 B12R1.28 Cc1ccnc(n1)NCCCS 21103563aaa541ee8c077c02f5d21f1f [0,1,0,0,0,0|3,0,0]=4 2714 B12R1.28 Cc1cncc(n1)NCCCF b5f9883ee2c914e1557a6bc5f8d8d0c3 [0,1,0,0,0,0|3,0,0]=4 2715 B12R1.28 Cc1cncc(n1)NCCCS f5cb47fb276b904ee4d024e8ae2569a1 [0,1,0,0,0,0|3,0,0]=4 2716 B12R1.28 Cc1cncc(n1)OCCCF 1211df678e03cd160dee8f9b45d054f9 [0,1,0,0,0,0|3,0,0]=4 2717 B12R1.28 Cc1cncc(n1)OCCCS 50e7613e0d742632e788092ce6b6ad6f [0,1,0,0,0,0|3,0,0]=4 2718 B12R1.28 Cc1cnnc(c1)CNCCF 16315d389523c478f48f4bac2699b6d9 [0,1,0,0,0,0|3,0,0]=4 2719 B12R1.28 Cc1cnnc(c1)CNCCS d1a98378c20007ea59b972a6e872d00c [0,1,0,0,0,0|3,0,0]=4 2720 B12R1.28 Cc1cnnc(c1)COCCF c4ca4b7170e71db83c9e0a5d9ff2e99d [0,1,0,0,0,0|3,0,0]=4 2721 B12R1.28 Cc1cnnc(c1)COCCS 9079d340f46d0b39180d2316ec6bb3f9 [0,1,0,0,0,0|3,0,0]=4 2722 B12R1.28 Cc1cnnc(c1)NCCCF b589cd82ba67b9c65cc5b403af7df408 [0,1,0,0,0,0|3,0,0]=4 2723 B12R1.28 Cc1cnnc(c1)NCCCO 48b12b968a3ec39dd1c1f961fc291916 [0,1,0,0,0,0|3,0,0]=4 2724 B12R1.28 Cc1cnnc(c1)NCCCS e65246c3d8f854822b9c9796b38342af [0,1,0,0,0,0|3,0,0]=4 2725 B12R1.28 Cc1nccc(n1)CNCCF bf7345c38fe35a98e8e3d6e67dd72027 [0,1,0,0,0,0|3,0,0]=4 2726 B12R1.28 Cc1nccc(n1)CNCCO fdc286e107d23f835a5f692b58027258 [0,1,0,0,0,0|3,0,0]=4 2727 B12R1.28 Cc1nccc(n1)CNCCS 030b45e886b80a2c810ec85cba46711a [0,1,0,0,0,0|3,0,0]=4 2728 B12R1.28 Cc1nccc(n1)COCCF aa4763e195e7ed3b23f5dd100c61f341 [0,1,0,0,0,0|3,0,0]=4 2729 B12R1.28 Cc1nccc(n1)COCCS ff7da3f29307ab0bdbfc13e52fd16123 [0,1,0,0,0,0|3,0,0]=4 2730 B12R1.28 Cc1nccc(n1)NCCCF dc38e7a707eb219e924fbfb7705fadb4 [0,1,0,0,0,0|3,0,0]=4 2731 B12R1.28 Cc1nccc(n1)NCCCO 6ee7846a4ad92bfef841af80e1f0ac7b [0,1,0,0,0,0|3,0,0]=4 2732 B12R1.28 Cc1nccc(n1)NCCCS 277fae400bdeb064009b68fba5842d2b [0,1,0,0,0,0|3,0,0]=4 2733 B12R1.28 Cc1nccc(n1)OCCCF 5320b7fa6639b3eed15b4fcb4ddd7443 [0,1,0,0,0,0|3,0,0]=4 2734 B12R1.28 Cc1nccc(n1)OCCCS 6f8143dc9284bf4c97974445726e3256 [0,1,0,0,0,0|3,0,0]=4 2735 B12R1.28 Clc1cccc(c1)CNCCBr 5cc9fe9b89061896b3b402fdf9473d72 [0,1,0,0,0,0|3,0,0]=4 2736 B12R1.28 Clc1cccc(c1)CNCCI b60e7441994a47c87a4bce06f1ff481f [0,1,0,0,0,0|3,0,0]=4 2737 B12R1.28 Clc1cccc(n1)CNCCBr 1639bc9c02c9c4765fab53ea3b8c1060 [0,1,0,0,0,0|2,0,0]=3 2738 B12R1.28 Clc1cccc(n1)CNCCI 293f2e7fa1af8c515120a19400880ebf [0,1,0,0,0,0|2,0,0]=3 2739 B12R1.28 Clc1ccnc(c1)CNCCBr 97c99f754eb304684ee51a44de5329c2 [0,1,0,0,0,0|2,0,0]=3 2740 B12R1.28 Clc1ccnc(c1)CNCCI aeccc440cbf9ee510824b3319a7e9d25 [0,1,0,0,0,0|2,0,0]=3 2741 B12R1.28 Clc1ccnc(n1)CNCCBr cffc6db2c4db1d87a3662a8df57d7be6 [0,1,0,0,0,0|3,0,0]=4 2742 B12R1.28 Clc1ccnc(n1)CNCCI 389473f759906070e3491e5c3d9b446b [0,1,0,0,0,0|3,0,0]=4 2743 B12R1.28 Clc1nccc(n1)CNCCBr 1f5ca3a4bee0e691fd0ebf11204c9951 [0,1,0,0,0,0|3,0,0]=4 2744 B12R1.28 Clc1nccc(n1)CNCCI 8587bf2b9e578fac649841b6c5292a75 [0,1,0,0,0,0|3,0,0]=4 2745 B12R1.28 FCCCNc1cc(ccn1)Br 20750c46702897db459c4611a6994d6a [0,1,0,0,0,0|2,0,0]=3 2746 B12R1.28 FCCCNc1cc(ccn1)Cl 53b4b9b33490751e1d13fea72c51cfbd [0,1,0,0,0,0|2,0,0]=3 2747 B12R1.28 FCCCNc1cc(ccn1)F 89111ddb5d0f78e428b7da15668c98dc [0,1,0,0,0,0|2,0,0]=3 2748 B12R1.28 FCCCNc1cc(ccn1)I fd081bf68f1cd6b94d4599b6be0acb72 [0,1,0,0,0,0|2,0,0]=3 2749 B12R1.28 FCCCNc1cc(cnn1)Br 0b49719d9981b778be349c670f61b6b3 [0,1,0,0,0,0|3,0,0]=4 2750 B12R1.28 FCCCNc1cc(cnn1)Cl 2d80ef66ff83b2a1c104c98004ef97c9 [0,1,0,0,0,0|3,0,0]=4 2751 B12R1.28 FCCCNc1cc(ncn1)Br d081f3382ca5c702a2dbe03ee6cd90dd [0,1,0,0,0,0|3,0,0]=4 2752 B12R1.28 FCCCNc1cc(ncn1)Cl 42e74de309c3391e7c63285194d130b7 [0,1,0,0,0,0|3,0,0]=4 2753 B12R1.28 FCCCNc1cc(ncn1)F d55861b817dbf3ff6f82517782888fad [0,1,0,0,0,0|3,0,0]=4 2754 B12R1.28 FCCCNc1cc(ncn1)I 82c37ad1d38d8175492e35405e70f05f [0,1,0,0,0,0|3,0,0]=4 2755 B12R1.28 FCCCNc1cccc(c1)Br a5e779c5a6e01a7940ef45e25ab8ffe5 [0,1,0,0,0,0|3,0,0]=4 2756 B12R1.28 FCCCNc1cccc(c1)Cl 2e2f7a49672e6223a274afd34e56ccd6 [0,1,0,0,0,0|3,0,0]=4 2757 B12R1.28 FCCCNc1cccc(c1)F 884148387af44d3273857fac2d94011a [0,1,0,0,0,0|3,0,0]=4 2758 B12R1.28 FCCCNc1cccc(c1)I 05facb2243fe352417590e09ec3f00ae [0,1,0,0,0,0|3,0,0]=4 2759 B12R1.28 FCCCNc1cccc(c1)S 9d9097c240ebf472387e6a66e727366f [0,1,0,0,0,0|3,0,0]=4 2760 B12R1.28 FCCCNc1cccc(n1)Br a202b16ae933f4870621be27c951efed [0,1,0,0,0,0|2,0,0]=3 2761 B12R1.28 FCCCNc1cccc(n1)Cl e046fa9181aa6bec69be19adf16bb8e1 [0,1,0,0,0,0|2,0,0]=3 2762 B12R1.28 FCCCNc1cccc(n1)F 41ca97cf0f3f738f6abd0e34da4e8f75 [0,1,0,0,0,0|2,0,0]=3 2763 B12R1.28 FCCCNc1cccc(n1)I 355ab42f772375ac1390675338787b79 [0,1,0,0,0,0|2,0,0]=3 2764 B12R1.28 FCCCNc1ccnc(n1)Br 6dc5707a0dfd10f08f194543f59f4bf2 [0,1,0,0,0,0|3,0,0]=4 2765 B12R1.28 FCCCNc1ccnc(n1)Cl 4351eec152ee09e89614ab23021d0d60 [0,1,0,0,0,0|3,0,0]=4 2766 B12R1.28 FCCCNc1ccnc(n1)F 6d107424cd2687f6997881c21f49631a [0,1,0,0,0,0|3,0,0]=4 2767 B12R1.28 FCCCNc1ccnc(n1)S 1dfc63bb1523a9c05ae03ee3affe2be0 [0,1,0,0,0,0|3,0,0]=4 2768 B12R1.28 FCCCNc1cncc(n1)Br 4677a77269f3086f41c49097973839ea [0,1,0,0,0,0|3,0,0]=4 2769 B12R1.28 FCCCNc1cncc(n1)Cl 07d3d39ff8ddddf462723e98e99c2948 [0,1,0,0,0,0|3,0,0]=4 2770 B12R1.28 FCCCNc1cncc(n1)F 05ab17a4d98cb18dc2b3979244bfdbd1 [0,1,0,0,0,0|3,0,0]=4 2771 B12R1.28 FCCCNc1nccc(n1)Br 4ceff7f7080e737ce92e17c2bde09c49 [0,1,0,0,0,0|3,0,0]=4 2772 B12R1.28 FCCCNc1nccc(n1)Cl 3a1ae801f740c170c65fcdbf33719cdd [0,1,0,0,0,0|3,0,0]=4 2773 B12R1.28 FCCCNc1nccc(n1)F 5094524dc346035a2894d15cadd5e26b [0,1,0,0,0,0|3,0,0]=4 2774 B12R1.28 FCCCNc1nccc(n1)I daea3ea1f60a165812556d0b88854203 [0,1,0,0,0,0|3,0,0]=4 2775 B12R1.28 FCCCNc1nccc(n1)S ab25a33eb076b5db01e74e30834f8848 [0,1,0,0,0,0|3,0,0]=4 2776 B12R1.28 FCCCOc1cc(ccn1)Br 4fcdd560e6d5026c903f0da0b54230c8 [0,1,0,0,0,0|2,0,0]=3 2777 B12R1.28 FCCCOc1cc(ccn1)Cl f0a471f7fef3b4cb15a0f20b8c10b6e8 [0,1,0,0,0,0|2,0,0]=3 2778 B12R1.28 FCCCOc1cc(ccn1)F 666e5ca75b34671f5bf51d98f9214a45 [0,1,0,0,0,0|2,0,0]=3 2779 B12R1.28 FCCCOc1cc(ncn1)Br 3dbb20bffa607a6fa86b85c006ada579 [0,1,0,0,0,0|3,0,0]=4 2780 B12R1.28 FCCCOc1cc(ncn1)Cl b9e3b3440d5aef6442d557212d0919c6 [0,1,0,0,0,0|3,0,0]=4 2781 B12R1.28 FCCCOc1cccc(c1)Br f93da663360a7fce01815877b2ea7f4c [0,1,0,0,0,0|3,0,0]=4 2782 B12R1.28 FCCCOc1cccc(c1)Cl 9f9989d3848ba74e066cf951a1173a5f [0,1,0,0,0,0|3,0,0]=4 2783 B12R1.28 FCCCOc1cccc(c1)F b1ad24f8520f67d0652853b88fb39a17 [0,1,0,0,0,0|3,0,0]=4 2784 B12R1.28 FCCCOc1cccc(c1)I 6c9f8788789d6b83d54430480d289a2c [0,1,0,0,0,0|3,0,0]=4 2785 B12R1.28 FCCCOc1cccc(c1)S ca68aa5dd7281fae8def9ff54c271d26 [0,1,0,0,0,0|3,0,0]=4 2786 B12R1.28 FCCCOc1cccc(n1)Br eac71a92f7708f46aedcf642601655cb [0,1,0,0,0,0|2,0,0]=3 2787 B12R1.28 FCCCOc1cccc(n1)F 7a567548ae8bb368ca1ebcd10294acdb [0,1,0,0,0,0|2,0,0]=3 2788 B12R1.28 FCCCOc1ccnc(n1)Cl 54271a53f12c66a62214895a92d01e02 [0,1,0,0,0,0|3,0,0]=4 2789 B12R1.28 FCCCOc1cncc(n1)Br 5ecdeafbe53230120f7420353af7822c [0,1,0,0,0,0|3,0,0]=4 2790 B12R1.28 FCCCOc1cncc(n1)Cl 64edd46058767a5acbcd1cf5b3a6ce49 [0,1,0,0,0,0|3,0,0]=4 2791 B12R1.28 FCCCOc1nccc(n1)Cl c252238d97194bfe39011503f9cc6e6f [0,1,0,0,0,0|3,0,0]=4 2792 B12R1.28 FCCCOc1nccc(n1)S 47f33fb1cbb84ee060d74e2f3d9b2245 [0,1,0,0,0,0|3,0,0]=4 2793 B12R1.28 FCCNCc1cc(ccn1)Br 37e292d67e2ddb7dc67b1f343074d036 [0,1,0,0,0,0|2,0,0]=3 2794 B12R1.28 FCCNCc1cc(ccn1)Cl e6e761bbfa935bb14c6c929e1a6ced97 [0,1,0,0,0,0|2,0,0]=3 2795 B12R1.28 FCCNCc1cccc(c1)Br a3f22b0af0f3c7a2fbd6499b3ebe667b [0,1,0,0,0,0|3,0,0]=4 2796 B12R1.28 FCCNCc1cccc(c1)Cl f15db2fa73a775f1ae5fbfc63c655621 [0,1,0,0,0,0|3,0,0]=4 2797 B12R1.28 FCCNCc1cccc(c1)F 0047a9122fdddadabcda076ea5ec82d2 [0,1,0,0,0,0|3,0,0]=4 2798 B12R1.28 FCCNCc1cccc(c1)I 838a45c5d193552ef6deb99293726a1d [0,1,0,0,0,0|3,0,0]=4 2799 B12R1.28 FCCNCc1cccc(n1)Br 5b3d558407727ecb6f03679f628ce636 [0,1,0,0,0,0|2,0,0]=3 2800 B12R1.28 FCCNCc1cccc(n1)Cl acc7022b50e3aa417dc7658c4eb9a367 [0,1,0,0,0,0|2,0,0]=3 2801 B12R1.28 FCCNCc1cccc(n1)F 890b801bd6ff66aefdc8aa338e0b0115 [0,1,0,0,0,0|2,0,0]=3 2802 B12R1.28 FCCNCc1ccnc(n1)Cl 8f16bdf217415c64eee6c2f4f4de0e53 [0,1,0,0,0,0|3,0,0]=4 2803 B12R1.28 FCCNCc1cncc(n1)Cl e921a0868086f807d7a0ecdaf6f35c7b [0,1,0,0,0,0|3,0,0]=4 2804 B12R1.28 FCCNCc1nccc(n1)Cl a15ebb582357c1762fd8685a283ddf96 [0,1,0,0,0,0|3,0,0]=4 2805 B12R1.28 FCCOCc1cc(ccn1)Br ffb7bf79dcb1b96c6bc315c64bd13f57 [0,1,0,0,0,0|2,0,0]=3 2806 B12R1.28 FCCOCc1cc(ccn1)Cl f963a4e998c061339937a466e96be76b [0,1,0,0,0,0|2,0,0]=3 2807 B12R1.28 FCCOCc1cc(ccn1)F b786c1023f18825b27e6450066254021 [0,1,0,0,0,0|2,0,0]=3 2808 B12R1.28 FCCOCc1cc(ccn1)I f0e1b8604f6a5483e627bfe0b9fb8e43 [0,1,0,0,0,0|2,0,0]=3 2809 B12R1.28 FCCOCc1cc(ncn1)Cl 22aceb530a4d3547b5664803e4d7eb83 [0,1,0,0,0,0|3,0,0]=4 2810 B12R1.28 FCCOCc1cccc(c1)Br 132f95e9b8e1e151e4d44f1ee2326667 [0,1,0,0,0,0|3,0,0]=4 2811 B12R1.28 FCCOCc1cccc(c1)Cl f6dced709428e91168328d103e0ea18c [0,1,0,0,0,0|3,0,0]=4 2812 B12R1.28 FCCOCc1cccc(c1)F f562d08b05eaa436a5cc3c15d63d906e [0,1,0,0,0,0|3,0,0]=4 2813 B12R1.28 FCCOCc1cccc(c1)I 2c636c0a42a80a0fdaf46f0fd79e6db4 [0,1,0,0,0,0|3,0,0]=4 2814 B12R1.28 FCCOCc1cccc(n1)Br 88dfce928a8783cb4e0142ff8ef46efb [0,1,0,0,0,0|2,0,0]=3 2815 B12R1.28 FCCOCc1cccc(n1)Cl ce93508e2b15f32fc62bbace70658d2d [0,1,0,0,0,0|2,0,0]=3 2816 B12R1.28 FCCOCc1cccc(n1)F c9e38f290a2fd8051d30094b0aed554f [0,1,0,0,0,0|2,0,0]=3 2817 B12R1.28 FCCOCc1cccc(n1)I 29157cde9268ed718861c6c360e5c3b3 [0,1,0,0,0,0|2,0,0]=3 2818 B12R1.28 FCCOCc1ccnc(n1)Cl 8e05f7930555dfdaf1ae14b493f525c3 [0,1,0,0,0,0|3,0,0]=4 2819 B12R1.28 FCCOCc1cncc(n1)Br cfd0e234817d1907c415ffd7f2dfc350 [0,1,0,0,0,0|3,0,0]=4 2820 B12R1.28 FCCOCc1cncc(n1)Cl 7e10ce0968485d1cdf87c41af745a03d [0,1,0,0,0,0|3,0,0]=4 2821 B12R1.28 FCCOCc1nccc(n1)Cl 54b903320b75ae70787d0aae31d5f979 [0,1,0,0,0,0|3,0,0]=4 2822 B12R1.28 FCNCCc1cccc(c1)Br 63f95ad9afdafac9c0c58398008d9140 [0,1,0,0,0,0|3,0,0]=4 2823 B12R1.28 FCNCCc1cccc(c1)Cl 1a5022cf19c45426af5ea2234f529088 [0,1,0,0,0,0|3,0,0]=4 2824 B12R1.28 FCNCCc1cccc(c1)F 7803834c60c721df84b912fcbd31c5e3 [0,1,0,0,0,0|3,0,0]=4 2825 B12R1.28 FCNCCc1cccc(c1)I 9ad8ab4dfb25921bc02195f41c6a88d6 [0,1,0,0,0,0|3,0,0]=4 2826 B12R1.28 FCOCCc1cc(ccn1)Br 1d67ca73e80c287972ef70c072527093 [0,1,0,0,0,0|2,0,0]=3 2827 B12R1.28 FCOCCc1cccc(c1)Br 4ceda77946fa660e1bde11b804bc61bf [0,1,0,0,0,0|3,0,0]=4 2828 B12R1.28 FCOCCc1cccc(c1)Cl c3312cd6c6d4529fd33e4cdbb4ad83ea [0,1,0,0,0,0|3,0,0]=4 2829 B12R1.28 FCOCCc1cccc(c1)F 3aed3878adb707025955cb0be47782c7 [0,1,0,0,0,0|3,0,0]=4 2830 B12R1.28 FCOCCc1cccc(c1)I 555c4e52e5544fe1560ead1fd2baaa04 [0,1,0,0,0,0|3,0,0]=4 2831 B12R1.28 FCOCCc1cccc(n1)Br 9e2f58cfecc65f95e9eb8abf0ac88104 [0,1,0,0,0,0|2,0,0]=3 2832 B12R1.28 FCOCCc1cccc(n1)Cl 7a6d4f4f18125d0fb13ee8adef0de2ed [0,1,0,0,0,0|2,0,0]=3 2833 B12R1.28 FCOCCc1cncc(n1)Cl 6c2f5d405876b3263d3c1624ce82106d [0,1,0,0,0,0|3,0,0]=4 2834 B12R1.28 Fc1cc(ncn1)NCCCS 2b4e1a2832695d28a83de57cee3c1271 [0,1,0,0,0,0|3,0,0]=4 2835 B12R1.28 Fc1cccc(c1)CNCCBr 506f094ea498024ae966b9d0ba6e14d4 [0,1,0,0,0,0|3,0,0]=4 2836 B12R1.28 Fc1cccc(c1)CNCCI d38c7b33aa5d62a638e183f4f4b82dbf [0,1,0,0,0,0|3,0,0]=4 2837 B12R1.28 Fc1cccc(c1)CNCCS a1f94b181fc0aabeee5680bbd229fcdc [0,1,0,0,0,0|3,0,0]=4 2838 B12R1.28 Fc1cccc(c1)COCCS 8abc65e02dcbf52f4ceee62118cddb07 [0,1,0,0,0,0|3,0,0]=4 2839 B12R1.28 Fc1cccc(c1)NCCCCl 094531d9b3eb8d8a70db119eaf87882b [0,1,0,0,0,0|3,0,0]=4 2840 B12R1.28 Fc1cccc(c1)NCCCS 199ff1ce92a3f647a23e1c1609c39884 [0,1,0,0,0,0|3,0,0]=4 2841 B12R1.28 Fc1cccc(c1)OCCCS 3ff5801d65a6ed1a4402137e97b0da73 [0,1,0,0,0,0|3,0,0]=4 2842 B12R1.28 Fc1cccc(n1)CNCCBr 3905ecb4e4fc0000c318a771636abbff [0,1,0,0,0,0|2,0,0]=3 2843 B12R1.28 Fc1cccc(n1)CNCCI b6449d42531f359f00434bb737df3064 [0,1,0,0,0,0|2,0,0]=3 2844 B12R1.28 Fc1cccc(n1)CNCCS c5947ebb06f1cf2feeb31d9ae5338949 [0,1,0,0,0,0|2,0,0]=3 2845 B12R1.28 Fc1cccc(n1)COCCS 51602e82d1d4a97fade4acd2fcdfa9d8 [0,1,0,0,0,0|2,0,0]=3 2846 B12R1.28 Fc1cccc(n1)NCCCCl 6902a107e7b73d161df237774d1e4a78 [0,1,0,0,0,0|2,0,0]=3 2847 B12R1.28 Fc1cccc(n1)NCCCS 85288a18300949a82a26b0b4a0f21ba4 [0,1,0,0,0,0|2,0,0]=3 2848 B12R1.28 Fc1cccc(n1)OCCCS 0f26c01967ca2db6471d9c623cc23a61 [0,1,0,0,0,0|2,0,0]=3 2849 B12R1.28 Fc1ccnc(c1)COCCS 2e115053b9241b0e7d9ca89fafb71f53 [0,1,0,0,0,0|2,0,0]=3 2850 B12R1.28 Fc1ccnc(c1)NCCCCl c6229e4ba2f5aea87dd35471740c8529 [0,1,0,0,0,0|2,0,0]=3 2851 B12R1.28 Fc1ccnc(c1)NCCCS 2884715b08239f8eb1369eb14859f809 [0,1,0,0,0,0|2,0,0]=3 2852 B12R1.28 Fc1ccnc(c1)OCCCS 13996c3fca7e267d37ea3dfac5e79322 [0,1,0,0,0,0|2,0,0]=3 2853 B12R1.28 Fc1ccnc(n1)NCCCS 7546648e8fa8620726d745c90337104f [0,1,0,0,0,0|3,0,0]=4 2854 B12R1.28 Fc1cncc(n1)NCCCCl fd449fb340d3f4b30d0871aa332dc17f [0,1,0,0,0,0|3,0,0]=4 2855 B12R1.28 Fc1cncc(n1)NCCCS b6602bf5f18f1175e464d7241306ca72 [0,1,0,0,0,0|3,0,0]=4 2856 B12R1.28 Fc1nccc(n1)NCCCS 9314d45ab8f21459e2d7c4be07052eb1 [0,1,0,0,0,0|3,0,0]=4 2857 B12R1.28 ICCNCc1cccc(c1)I 84cafd462cbe5b29022c0af33af91f01 [0,1,0,0,0,0|3,0,0]=4 2858 B12R1.28 N#CCCNc1cc(ccn1)Br f152639236fc0b17d13d3668197751fc [0,1,0,0,0,0|2,0,1]=4 2859 B12R1.28 N#CCCNc1cc(ccn1)Cl 624f855a149d66f35a2a7f27624d2804 [0,1,0,0,0,0|2,0,1]=4 2860 B12R1.28 N#CCCNc1cc(ccn1)F 6c099c0cbe889bd509f16965df107034 [0,1,0,0,0,0|2,0,1]=4 2861 B12R1.28 N#CCCNc1cc(ccn1)I 3771005223721585eedc0acc8503fe60 [0,1,0,0,0,0|2,0,1]=4 2862 B12R1.28 N#CCCNc1cccc(n1)Br a60b5a4c61eab1d33399c98037395d63 [0,1,0,0,0,0|2,0,1]=4 2863 B12R1.28 N#CCCNc1cccc(n1)Cl 3adcaf9bf67c64fc97c8b07814017470 [0,1,0,0,0,0|2,0,1]=4 2864 B12R1.28 N#CCCNc1cccc(n1)F f6b203c5646a33a87e2af9b207222319 [0,1,0,0,0,0|2,0,1]=4 2865 B12R1.28 N#CCCNc1cccc(n1)I 7e22d1ca9e72e83b3ef1497e2a8714c8 [0,1,0,0,0,0|2,0,1]=4 2866 B12R1.28 N#CCCOc1cc(ccn1)Br 343b9394c96b3e31de989173ebe97cd2 [0,1,0,0,0,0|2,0,1]=4 2867 B12R1.28 N#CCCOc1cc(ccn1)Cl 2e574f016e9a0420f055f945f052256f [0,1,0,0,0,0|2,0,1]=4 2868 B12R1.28 N#CCCOc1cc(ccn1)F 876e4b81c35f16774cc87ca42bdc280b [0,1,0,0,0,0|2,0,1]=4 2869 B12R1.28 N#CCCOc1cccc(n1)Br f27c3f9d1fe7b87e50a9de59cdff5193 [0,1,0,0,0,0|2,0,1]=4 2870 B12R1.28 N#CCCOc1cccc(n1)F 2c7437b21d44737d481901b9ea029671 [0,1,0,0,0,0|2,0,1]=4 2871 B12R1.28 N#CCNCc1cc(ccn1)Br c3eaf089fe979e3aa5f6fbcb949f230b [0,1,0,0,0,0|2,0,1]=4 2872 B12R1.28 N#CCNCc1cc(ccn1)Cl f1852d235591fa4c13acff269d265dfb [0,1,0,0,0,0|2,0,1]=4 2873 B12R1.28 N#CCNCc1cccc(n1)Br 1b2873c9dc9c7c7c9c0c6ac918fcb7d4 [0,1,0,0,0,0|2,0,1]=4 2874 B12R1.28 N#CCNCc1cccc(n1)Cl 306e8c9c1401cbbe792785c607373b5e [0,1,0,0,0,0|2,0,1]=4 2875 B12R1.28 N#CCNCc1cccc(n1)F 8e4bb3f748efdd5d382df88ed7814dd8 [0,1,0,0,0,0|2,0,1]=4 2876 B12R1.28 N#CCOCc1cc(ccn1)Br 75b7ff76d451c90a6c3cc81b9fd6f8d1 [0,1,0,0,0,0|2,0,1]=4 2877 B12R1.28 N#CCOCc1cc(ccn1)Cl 8e25323cbe7558ccbddd55f7ac1e74e2 [0,1,0,0,0,0|2,0,1]=4 2878 B12R1.28 N#CCOCc1cc(ccn1)F 7291f1b482cde12122154aae3199853e [0,1,0,0,0,0|2,0,1]=4 2879 B12R1.28 N#CCOCc1cc(ccn1)I 8281f853a08c2aebea211ad5fefaefab [0,1,0,0,0,0|2,0,1]=4 2880 B12R1.28 N#CCOCc1cccc(n1)Br 4cc869187934123fb52e54d598ddca15 [0,1,0,0,0,0|2,0,1]=4 2881 B12R1.28 N#CCOCc1cccc(n1)Cl 0c0c7ec4373b43174a1db23b8f34841a [0,1,0,0,0,0|2,0,1]=4 2882 B12R1.28 N#CCOCc1cccc(n1)F eb0922241aba5fa8ab272895bb88c6f2 [0,1,0,0,0,0|2,0,1]=4 2883 B12R1.28 N#CCOCc1cccc(n1)I 25f6d133682fb39cefae4fbbd44f39ed [0,1,0,0,0,0|2,0,1]=4 2884 B12R1.28 NOCCNc1cc(ccn1)F 2b95d7cadab69555c0b11009e29c218b [0,1,0,0,0,0|3,0,0]=4 2885 B12R1.28 NOCCNc1cc(ccn1)O df9f10fba9de1de7ed36ba5253825ad2 [0,1,0,0,0,0|3,0,0]=4 2886 B12R1.28 NOCCNc1cccc(n1)F af562833e35f92d87e05f342a37d7b7a [0,1,0,0,0,0|3,0,0]=4 2887 B12R1.28 O=CCCNc1cc(ccn1)Br a61157bc0d366e44c25a0034b79ba9ac [0,1,0,0,0,0|2,0,1]=4 2888 B12R1.28 O=CCCNc1cc(ccn1)Cl 372943a97a863fd598c06e25bf6df9ab [0,1,0,0,0,0|2,0,1]=4 2889 B12R1.28 O=CCCNc1cc(ccn1)F b4b2d14a286546bf6ce04a5263dcfa6c [0,1,0,0,0,0|2,0,1]=4 2890 B12R1.28 O=CCCNc1cc(ccn1)I 6a4f1b888bee12ea2ae5654c10a77aad [0,1,0,0,0,0|2,0,1]=4 2891 B12R1.28 O=CCCNc1cccc(n1)Br 9c1ecd9f97cdc40f0c6eb07388aee87e [0,1,0,0,0,0|2,0,1]=4 2892 B12R1.28 O=CCCNc1cccc(n1)Cl 7a9e49423ed69c387c2ad133a4df3c35 [0,1,0,0,0,0|2,0,1]=4 2893 B12R1.28 O=CCCNc1cccc(n1)F 72f2a529b73334374b468144e1701e5e [0,1,0,0,0,0|2,0,1]=4 2894 B12R1.28 O=CCCNc1cccc(n1)I 313f12fad8bad5278ba47055ac7b527b [0,1,0,0,0,0|2,0,1]=4 2895 B12R1.28 O=CCCOc1cc(ccn1)Br af4e77f4c43fafa2ead74ef87569f3af [0,1,0,0,0,0|2,0,1]=4 2896 B12R1.28 O=CCCOc1cc(ccn1)Cl 92c021d6db464d27591b9d10f825d845 [0,1,0,0,0,0|2,0,1]=4 2897 B12R1.28 O=CCCOc1cc(ccn1)F 33499a405564f9918a4dd97234e56085 [0,1,0,0,0,0|2,0,1]=4 2898 B12R1.28 O=CCCOc1cccc(n1)Br 6c3d9baba56cce40c95a9fb265101ff9 [0,1,0,0,0,0|2,0,1]=4 2899 B12R1.28 O=CCCOc1cccc(n1)F 20d3bdcb4beae7130756b9024d6e4a87 [0,1,0,0,0,0|2,0,1]=4 2900 B12R1.28 O=CCNCc1cc(ccn1)Br f87ffb3537684439df2a8408d57fc5bc [0,1,0,0,0,0|2,0,1]=4 2901 B12R1.28 O=CCNCc1cc(ccn1)Cl 48e831ec7765f3bc7eb2f844e3ca2bc4 [0,1,0,0,0,0|2,0,1]=4 2902 B12R1.28 O=CCNCc1cccc(n1)Br 9a82cc9423db4893eef665c07e1426ef [0,1,0,0,0,0|2,0,1]=4 2903 B12R1.28 O=CCNCc1cccc(n1)Cl 09c9869a24a1901f85e77bf026a8738b [0,1,0,0,0,0|2,0,1]=4 2904 B12R1.28 O=CCNCc1cccc(n1)F 241f08b80b557a58d89a30b1035156ba [0,1,0,0,0,0|2,0,1]=4 2905 B12R1.28 O=CCOCc1cc(ccn1)Br ce8112e8c7bd9a0fee691604e5dc28a5 [0,1,0,0,0,0|2,0,1]=4 2906 B12R1.28 O=CCOCc1cc(ccn1)Cl 612330cec3785cd0cd41d3194beb8a04 [0,1,0,0,0,0|2,0,1]=4 2907 B12R1.28 O=CCOCc1cc(ccn1)F 2629f709911d22e61dc1fefb414318a9 [0,1,0,0,0,0|2,0,1]=4 2908 B12R1.28 O=CCOCc1cc(ccn1)I c87103709b332024b65f93580ccc5f9b [0,1,0,0,0,0|2,0,1]=4 2909 B12R1.28 O=CCOCc1cccc(n1)Br 989d9f8c1289f346b4d2d5c8166a2064 [0,1,0,0,0,0|2,0,1]=4 2910 B12R1.28 O=CCOCc1cccc(n1)Cl d163c73a39b19b82f3b3b8a2c0ee7f79 [0,1,0,0,0,0|2,0,1]=4 2911 B12R1.28 O=CCOCc1cccc(n1)F 08966350e6ed422d0f6c945652589f7a [0,1,0,0,0,0|2,0,1]=4 2912 B12R1.28 O=CCOCc1cccc(n1)I c69a65e8e364839844508e39847a5c7b [0,1,0,0,0,0|2,0,1]=4 2913 B12R1.28 O=c1cccc([nH]1)NCCCCl 41b87fa6b7f637a724493c0b2acc8115 [0,1,0,0,0,0|2,0,1]=4 2914 B12R1.28 O=c1cccc([nH]1)NCCCO 4db784e09290c6c0590cfb4b1314a769 [0,1,0,0,0,0|2,0,1]=4 2915 B12R1.28 O=c1cccc([nH]1)OCCCF 6e20b2d9dadf489aba25c3df7dde10a6 [0,1,0,0,0,0|2,0,1]=4 2916 B12R1.28 O=c1cccc([nH]1)OCCCS 4aa2c9d2e6321843f4a96b2f073d65b5 [0,1,0,0,0,0|2,0,1]=4 2917 B12R1.28 O=c1ccnc([nH]1)NCCCF fb13f54dbb9cc3692cdab538e6069a59 [0,1,0,0,0,0|3,0,0]=4 2918 B12R1.28 O=c1ccnc([nH]1)NCCCO aae32b20fd598df97cf8f9274b731906 [0,1,0,0,0,0|3,0,0]=4 2919 B12R1.28 O=c1ccnc([nH]1)NCCCS 9424456425b380f91e5d5a56205d2606 [0,1,0,0,0,0|3,0,0]=4 2920 B12R1.28 O=c1nc(cc[nH]1)CNCCF 637108584ec93fd366b4a1b9ad108916 [0,1,0,0,0,0|3,0,0]=4 2921 B12R1.28 O=c1nc(cc[nH]1)CNCCO 93e32aa2ae2537c9e65da4bd1089d722 [0,1,0,0,0,0|3,0,0]=4 2922 B12R1.28 O=c1nc(cc[nH]1)CNCCS f5ac4e6d72c623ec0d278cdfa8e1ce0e [0,1,0,0,0,0|3,0,0]=4 2923 B12R1.28 O=c1nc(cc[nH]1)NCCCF 7a39cb32e888ea71e5fffa9137953320 [0,1,0,0,0,0|3,0,0]=4 2924 B12R1.28 O=c1nc(cc[nH]1)NCCCO 453a5d82f07c0265fb5c80244da1fbdc [0,1,0,0,0,0|3,0,0]=4 2925 B12R1.28 O=c1nc(cc[nH]1)NCCCS 7eaccbc94fb38765956572e780957f70 [0,1,0,0,0,0|3,0,0]=4 2926 B12R1.28 OCCCNc1cc(ccn1)Br f6a8b8f5d0856eb879339864201cccfd [0,1,0,0,0,0|2,0,0]=3 2927 B12R1.28 OCCCNc1cc(ccn1)Cl 986a88af866116997d00e33b4837e80b [0,1,0,0,0,0|2,0,0]=3 2928 B12R1.28 OCCCNc1cc(ccn1)F 4e027b78c0e645b9253dedb6423f8b54 [0,1,0,0,0,0|2,0,0]=3 2929 B12R1.28 OCCCNc1cc(ccn1)I f59415f31db33e14416d965de8f62ea6 [0,1,0,0,0,0|2,0,0]=3 2930 B12R1.28 OCCCNc1cc(cnn1)Br 964b5b061322ded125ca0ad63b8642bc [0,1,0,0,0,0|3,0,0]=4 2931 B12R1.28 OCCCNc1cc(cnn1)Cl fd30e74dd9cb85451794f16adaf98b41 [0,1,0,0,0,0|3,0,0]=4 2932 B12R1.28 OCCCNc1cc(ncn1)Br 3c2e34576c034b0f72697f8ea7e0fbea [0,1,0,0,0,0|3,0,0]=4 2933 B12R1.28 OCCCNc1cc(ncn1)Cl 516dd84c0b6bc806b994ede8fd60b058 [0,1,0,0,0,0|3,0,0]=4 2934 B12R1.28 OCCCNc1cc(ncn1)F 1733cf9257f3bf6dc34ff73a27cbf811 [0,1,0,0,0,0|3,0,0]=4 2935 B12R1.28 OCCCNc1cc(ncn1)I 8382f947176f3db06ac77448436c8706 [0,1,0,0,0,0|3,0,0]=4 2936 B12R1.28 OCCCNc1cccc(c1)Br cf69fbba1731c7b7b182d73471a01be4 [0,1,0,0,0,0|3,0,0]=4 2937 B12R1.28 OCCCNc1cccc(c1)Cl 88f10fbe375978effa6eebb8a9188619 [0,1,0,0,0,0|3,0,0]=4 2938 B12R1.28 OCCCNc1cccc(c1)F b882697ea65ee7871f3124f2dd496ace [0,1,0,0,0,0|3,0,0]=4 2939 B12R1.28 OCCCNc1cccc(c1)I 78c4085590617010aec0ba4d6ba6f2fe [0,1,0,0,0,0|3,0,0]=4 2940 B12R1.28 OCCCNc1cccc(c1)O b8a1a453f36dea395f53aa0824bf7c84 [0,1,0,0,0,0|3,0,0]=4 2941 B12R1.28 OCCCNc1cccc(c1)S 9ca3bc3286df08cfa7f628c8e1f2aead [0,1,0,0,0,0|3,0,0]=4 2942 B12R1.28 OCCCNc1cccc(n1)Br dfa965d8be0fdaf41f92ed17df92c044 [0,1,0,0,0,0|2,0,0]=3 2943 B12R1.28 OCCCNc1cccc(n1)Cl 45cfeeb39d45507f4813a202326042c2 [0,1,0,0,0,0|2,0,0]=3 2944 B12R1.28 OCCCNc1cccc(n1)F ddedb1ae3d302d51470779bd99ee9b96 [0,1,0,0,0,0|2,0,0]=3 2945 B12R1.28 OCCCNc1cccc(n1)I 6c6d5ee0fd17b1e0ef63e4333240386d [0,1,0,0,0,0|2,0,0]=3 2946 B12R1.28 OCCCNc1ccnc(n1)Br f4c9c1d8dc8229ffb47d49869c3f4f9a [0,1,0,0,0,0|3,0,0]=4 2947 B12R1.28 OCCCNc1ccnc(n1)Cl 5b5eb72cb3642c5f0c7997b6b1bf90b6 [0,1,0,0,0,0|3,0,0]=4 2948 B12R1.28 OCCCNc1ccnc(n1)F 9ef2b696c5b7bfa7ecf0f400574ec28d [0,1,0,0,0,0|3,0,0]=4 2949 B12R1.28 OCCCNc1ccnc(n1)S 6b2c53a807059924946f4b8b2502fa53 [0,1,0,0,0,0|3,0,0]=4 2950 B12R1.28 OCCCNc1cncc(n1)Cl 49bf0be207ed886da175bef4979e68fb [0,1,0,0,0,0|3,0,0]=4 2951 B12R1.28 OCCCNc1cncc(n1)F 116cc826bbc8554390d944017ab96f42 [0,1,0,0,0,0|3,0,0]=4 2952 B12R1.28 OCCCNc1nccc(n1)Br 375ed73209486e221be0f376862b81c6 [0,1,0,0,0,0|3,0,0]=4 2953 B12R1.28 OCCCNc1nccc(n1)Cl 6369d25141e919fa1c959a2b99d943b8 [0,1,0,0,0,0|3,0,0]=4 2954 B12R1.28 OCCCNc1nccc(n1)F 039d4dab7ddef0eb29359d80005bb797 [0,1,0,0,0,0|3,0,0]=4 2955 B12R1.28 OCCCNc1nccc(n1)I ccaab91126730d7437d1c350a4f319ca [0,1,0,0,0,0|3,0,0]=4 2956 B12R1.28 OCCCNc1nccc(n1)S feb69ef59989364772af9c582874aa6f [0,1,0,0,0,0|3,0,0]=4 2957 B12R1.28 OCCNCc1cc(ccn1)Br 811409fa99bfcbd9ae815817e82eb602 [0,1,0,0,0,0|2,0,0]=3 2958 B12R1.28 OCCNCc1cc(ccn1)Cl 9d88225fbe6444326bc46920142c5e97 [0,1,0,0,0,0|2,0,0]=3 2959 B12R1.28 OCCNCc1cccc(c1)Br 269adac2794c703a867a6cdfbdcc4b31 [0,1,0,0,0,0|3,0,0]=4 2960 B12R1.28 OCCNCc1cccc(c1)Cl 12da828289841255f4989b01d4fb368f [0,1,0,0,0,0|3,0,0]=4 2961 B12R1.28 OCCNCc1cccc(c1)F 4b3f9f0d35d39d22594c2266a910e961 [0,1,0,0,0,0|3,0,0]=4 2962 B12R1.28 OCCNCc1cccc(c1)I dabfb0966332881d2eb3473e30b644ce [0,1,0,0,0,0|3,0,0]=4 2963 B12R1.28 OCCNCc1cccc(n1)Br 8a468ffc1995caa8bac2337fcbdcf33b [0,1,0,0,0,0|2,0,0]=3 2964 B12R1.28 OCCNCc1cccc(n1)Cl 25209a0d4e4a1e8774a4b0b324031e5b [0,1,0,0,0,0|2,0,0]=3 2965 B12R1.28 OCCNCc1cccc(n1)F bea4cc6274f92afd7eb8ba5f84a76cc9 [0,1,0,0,0,0|2,0,0]=3 2966 B12R1.28 OCCNCc1ccnc(n1)Cl c6b1f77457dc2fa67fb72b18c89ffdd6 [0,1,0,0,0,0|3,0,0]=4 2967 B12R1.28 OCCNCc1cncc(n1)Cl ae0f72ffcbd97e9b8febff354c344c23 [0,1,0,0,0,0|3,0,0]=4 2968 B12R1.28 OCCNCc1nccc(n1)Cl 1565d47a76f62874ffcc3730791c6c7b [0,1,0,0,0,0|3,0,0]=4 2969 B12R1.28 OCNCCc1cccc(c1)Br 3aa38b14d893ea561c6d7be0b882b46e [0,1,0,0,0,0|3,0,0]=4 2970 B12R1.28 OCNCCc1cccc(c1)Cl 10611e4fe6f0ad3695177e63a8cf825e [0,1,0,0,0,0|3,0,0]=4 2971 B12R1.28 OCNCCc1cccc(c1)F 88d3334a709a0b42373bc0c7574dca21 [0,1,0,0,0,0|3,0,0]=4 2972 B12R1.28 OCNCCc1cccc(c1)I 5daf6c5becb322704670a9c1193bd5a3 [0,1,0,0,0,0|3,0,0]=4 2973 B12R1.28 Oc1cccc(c1)NCCCCl de7bfd3663d7e43e0e8f79d6f6f663e8 [0,1,0,0,0,0|3,0,0]=4 2974 B12R1.28 SCCCNc1cc(ccn1)Br b1707ba86b7002fad5baa013fe9c4ea2 [0,1,0,0,0,0|2,0,0]=3 2975 B12R1.28 SCCCNc1cc(ccn1)Cl b9615b882d0bb25a9296173d1bf2d1af [0,1,0,0,0,0|2,0,0]=3 2976 B12R1.28 SCCCNc1cc(ccn1)I 49bd3faccca08af852a919e959e313cb [0,1,0,0,0,0|2,0,0]=3 2977 B12R1.28 SCCCNc1cc(cnn1)Br af40465c2899191413e99b2baa42fc27 [0,1,0,0,0,0|3,0,0]=4 2978 B12R1.28 SCCCNc1cc(cnn1)Cl 1824eaccacd3e0732c1501561c2e7fff [0,1,0,0,0,0|3,0,0]=4 2979 B12R1.28 SCCCNc1cc(ncn1)Br 5713ca3ef3aeccdb6389516377241cef [0,1,0,0,0,0|3,0,0]=4 2980 B12R1.28 SCCCNc1cc(ncn1)Cl 3d1a4929c1ad65d72a4e7b9287365401 [0,1,0,0,0,0|3,0,0]=4 2981 B12R1.28 SCCCNc1cc(ncn1)I 6fbca83808fc4ee7098145a35c1be622 [0,1,0,0,0,0|3,0,0]=4 2982 B12R1.28 SCCCNc1cccc(c1)Br c5e5a6c29e3438dcb4f6f117c29a1f87 [0,1,0,0,0,0|3,0,0]=4 2983 B12R1.28 SCCCNc1cccc(c1)Cl 7dab5b443edf014f6c5d4a44b2c4ad2a [0,1,0,0,0,0|3,0,0]=4 2984 B12R1.28 SCCCNc1cccc(c1)I 32f6a0335d0e29c8e60b8e6e6b1a46f1 [0,1,0,0,0,0|3,0,0]=4 2985 B12R1.28 SCCCNc1cccc(c1)S 13d71a201fce4434d9fb9f873530dfbe [0,1,0,0,0,0|3,0,0]=4 2986 B12R1.28 SCCCNc1cccc(n1)Br 3fba27e9b4d640f638f5ad677c152f2a [0,1,0,0,0,0|2,0,0]=3 2987 B12R1.28 SCCCNc1cccc(n1)Cl 0304d4ebc57e8070c1b84c7a184fabf8 [0,1,0,0,0,0|2,0,0]=3 2988 B12R1.28 SCCCNc1cccc(n1)I b7ef78719498a9e50d76474b67dd49e5 [0,1,0,0,0,0|2,0,0]=3 2989 B12R1.28 SCCCNc1ccnc(n1)Br 118e10712be14146b2f20297457368b6 [0,1,0,0,0,0|3,0,0]=4 2990 B12R1.28 SCCCNc1ccnc(n1)Cl 0ba27aa2224fde0f7ef8540ae6fd348c [0,1,0,0,0,0|3,0,0]=4 2991 B12R1.28 SCCCNc1ccnc(n1)S c550a373425b4310e24855176ee03293 [0,1,0,0,0,0|3,0,0]=4 2992 B12R1.28 SCCCNc1cncc(n1)Br 501f91c85100c6d057a1082dd82e885c [0,1,0,0,0,0|3,0,0]=4 2993 B12R1.28 SCCCNc1cncc(n1)Cl 4e4d039bcb0394a20c48c9a5fcbce7ef [0,1,0,0,0,0|3,0,0]=4 2994 B12R1.28 SCCCNc1nccc(n1)Br 52079b6798a533416e0e0b84d1c43ef9 [0,1,0,0,0,0|3,0,0]=4 2995 B12R1.28 SCCCNc1nccc(n1)Cl dbc2a6ec6a92dfb9a0f87b00eeaa5bc7 [0,1,0,0,0,0|3,0,0]=4 2996 B12R1.28 SCCCNc1nccc(n1)I e6e5164240cf470e0cca801448a7f831 [0,1,0,0,0,0|3,0,0]=4 2997 B12R1.28 SCCCNc1nccc(n1)S e3be75b6d54e01c2a45404c5ff75daf3 [0,1,0,0,0,0|3,0,0]=4 2998 B12R1.28 SCCCOc1cc(ccn1)Br 6843a6ca0abcb65f90af006bf0e0933d [0,1,0,0,0,0|2,0,0]=3 2999 B12R1.28 SCCCOc1cc(ccn1)Cl 790e4eed3748040b742c7b212401407a [0,1,0,0,0,0|2,0,0]=3 3000 B12R1.28 SCCCOc1cc(ncn1)Br 71e6809551024345c62506829996dea6 [0,1,0,0,0,0|3,0,0]=4 3001 B12R1.28 SCCCOc1cc(ncn1)Cl e65b791eada77626b5089678973c1d31 [0,1,0,0,0,0|3,0,0]=4 3002 B12R1.28 SCCCOc1cccc(c1)Br 694c125cbc9b74e234f907bad21e1476 [0,1,0,0,0,0|3,0,0]=4 3003 B12R1.28 SCCCOc1cccc(c1)Cl a659b4da7bb502926693b2463441ff4a [0,1,0,0,0,0|3,0,0]=4 3004 B12R1.28 SCCCOc1cccc(c1)I 77d5bac49fc2e792054051cdea34586a [0,1,0,0,0,0|3,0,0]=4 3005 B12R1.28 SCCCOc1cccc(c1)S 69671bc5e424420434e35c35bf3a6fd8 [0,1,0,0,0,0|3,0,0]=4 3006 B12R1.28 SCCCOc1cccc(n1)Br 30ab89d5225fd9513ffd5fd2075f3a7a [0,1,0,0,0,0|2,0,0]=3 3007 B12R1.28 SCCCOc1ccnc(n1)Cl 1f9c26521a5e37aa5b0c8da8f751d45b [0,1,0,0,0,0|3,0,0]=4 3008 B12R1.28 SCCCOc1cncc(n1)Br 13ff315ad31551b0542ed23ee25b3071 [0,1,0,0,0,0|3,0,0]=4 3009 B12R1.28 SCCCOc1cncc(n1)Cl 9e72b0531289ce23ba648e09662b0b0f [0,1,0,0,0,0|3,0,0]=4 3010 B12R1.28 SCCCOc1nccc(n1)Cl 465d0d74eb2c505c9e401a304f933859 [0,1,0,0,0,0|3,0,0]=4 3011 B12R1.28 SCCCOc1nccc(n1)S 3edec4767da4611e106d9386d8f31089 [0,1,0,0,0,0|3,0,0]=4 3012 B12R1.28 SCCNCc1cc(ccn1)Br 701f2db0881d081a7ab57fed8da2b5ef [0,1,0,0,0,0|2,0,0]=3 3013 B12R1.28 SCCNCc1cc(ccn1)Cl cd27ba851ad0eb109a5cbf20553cbd17 [0,1,0,0,0,0|2,0,0]=3 3014 B12R1.28 SCCNCc1cccc(c1)Br 5d070a08d4470619e09054ab75a69b02 [0,1,0,0,0,0|3,0,0]=4 3015 B12R1.28 SCCNCc1cccc(c1)Cl fd44b9b3de5f995549bdbe5c45044b5f [0,1,0,0,0,0|3,0,0]=4 3016 B12R1.28 SCCNCc1cccc(c1)I e10eb4f1f6db83bad36826b20d276fa9 [0,1,0,0,0,0|3,0,0]=4 3017 B12R1.28 SCCNCc1cccc(n1)Br b3a0efac633d2ba62bda7d621932b691 [0,1,0,0,0,0|2,0,0]=3 3018 B12R1.28 SCCNCc1cccc(n1)Cl 8f6e90b001f21d9c8f46d448465e4fa0 [0,1,0,0,0,0|2,0,0]=3 3019 B12R1.28 SCCNCc1ccnc(n1)Cl ee3a76921005db318c5f6197e5706252 [0,1,0,0,0,0|3,0,0]=4 3020 B12R1.28 SCCNCc1cncc(n1)Cl ff95ff1204c4924fb1eee7daaeb8cc6e [0,1,0,0,0,0|3,0,0]=4 3021 B12R1.28 SCCNCc1nccc(n1)Cl e6fcb31e096136a082e116f6e2879f9e [0,1,0,0,0,0|3,0,0]=4 3022 B12R1.28 SCCOCc1cc(ccn1)Br 8be98bac35f1e526c63f8be32bc967f1 [0,1,0,0,0,0|2,0,0]=3 3023 B12R1.28 SCCOCc1cc(ccn1)Cl 6fdc9d3530d02acbb441d8c5fcbbca24 [0,1,0,0,0,0|2,0,0]=3 3024 B12R1.28 SCCOCc1cc(ccn1)I 869c4413cd20664aba82b7d39b23183c [0,1,0,0,0,0|2,0,0]=3 3025 B12R1.28 SCCOCc1cc(ncn1)Cl 7c07e8e36826395c82358431a067a1dd [0,1,0,0,0,0|3,0,0]=4 3026 B12R1.28 SCCOCc1cccc(c1)Br 9b0f7e02614b195ce19dbc655b74e8c2 [0,1,0,0,0,0|3,0,0]=4 3027 B12R1.28 SCCOCc1cccc(c1)Cl 3aaede370ad1f6069eaafb0c682e2011 [0,1,0,0,0,0|3,0,0]=4 3028 B12R1.28 SCCOCc1cccc(c1)I 5eeb99910ed72a196d67ee1e0e492959 [0,1,0,0,0,0|3,0,0]=4 3029 B12R1.28 SCCOCc1cccc(n1)Br 220cd10e9b3d9986e6eade2f8f677e84 [0,1,0,0,0,0|2,0,0]=3 3030 B12R1.28 SCCOCc1cccc(n1)Cl 3a44e85fa16815771fecb04ffdf4f439 [0,1,0,0,0,0|2,0,0]=3 3031 B12R1.28 SCCOCc1cccc(n1)I 585e9c89e52c1b724aa72d45714beffe [0,1,0,0,0,0|2,0,0]=3 3032 B12R1.28 SCCOCc1ccnc(n1)Cl cb8e941bdf3e39a7874c3bee156dda6e [0,1,0,0,0,0|3,0,0]=4 3033 B12R1.28 SCCOCc1cncc(n1)Br b8e3d0ae3e04108d216b87ba05a70b87 [0,1,0,0,0,0|3,0,0]=4 3034 B12R1.28 SCCOCc1cncc(n1)Cl 06c8f6d361c6fad0869f3256dd21236b [0,1,0,0,0,0|3,0,0]=4 3035 B12R1.28 SCCOCc1nccc(n1)Cl 79ff6e971c94aa495cb9ed0513c3d87e [0,1,0,0,0,0|3,0,0]=4 3036 B12R1.28 Sc1cccc(c1)NCCCCl 00ff4909bf6ffa253d373787b90982d4 [0,1,0,0,0,0|3,0,0]=4 3037 B12R1.28 [O-][n+]1ccnc(c1)NCCCCl 78d7247085b7264f1bdeb2918a825aab [0,1,0,0,0,0|3,0,0]=4 3038 B12R1.28 [O-][n+]1ccnc(c1)NCCCO 7ebc10f663d3a02583974b1a346d2dff [0,1,0,0,0,0|3,0,0]=4 3039 B12R1.30 C#CCCN(C)c1ccccn1 e23b87292f5a3973f163b54069d74a5a [0,1,0,0,0,0|1,0,2]=4 3040 B12R1.30 C#CCNC(C)c1ccccn1 4298989a128b5a6841bac7e23a0354aa [0,1,0,0,0,0|1,0,2]=4 3041 B12R1.30 C#CCN[C@@H](C)c1ccccn1 341a7b97c54032ef6cc5876956ea059f [0,1,0,0,0,0|1,0,2]=4 3042 B12R1.30 C#CCN[C@H](C)c1ccccn1 6dc8aa600cebb97d8f32894292c6e305 [0,1,0,0,0,0|1,0,2]=4 3043 B12R1.30 C#CCOC(C)c1ccccn1 8def24808c4348444663c62ba62bb945 [0,1,0,0,0,0|1,0,2]=4 3044 B12R1.30 C#CCO[C@@H](C)c1ccccn1 a1f8da7c5d8064f757b9140efba40b08 [0,1,0,0,0,0|1,0,2]=4 3045 B12R1.30 C#CCO[C@H](C)c1ccccn1 daa38fa58a128af6d343fb26f391c887 [0,1,0,0,0,0|1,0,2]=4 3046 B12R1.30 C/C=C/CN(C)c1ccccn1 795ac5a623f8752cd22f4f2bf9f41ed4 [0,1,0,0,0,0|1,0,2]=4 3047 B12R1.30 C/C=C\CN(C)c1ccccn1 e2a3cbca98ab02638f12cd421b8d008c [0,1,0,0,0,0|1,0,2]=4 3048 B12R1.30 C=C(COCC)c1ccccc1 e1174170fb735530ed2c07509ad0f64f [0,1,0,0,0,0|2,0,1]=4 3049 B12R1.30 C=C(COCC)c1ccccn1 f40de5671b29d2ee57d19787ac098e3c [0,1,0,0,0,0|1,0,1]=3 3050 B12R1.30 C=C(COCF)c1ccccn1 a1e2e7eaefd33d18b03307c74614060f [0,1,0,0,0,0|2,0,1]=4 3051 B12R1.30 C=CCCN(C)c1ccccn1 0f1f362072f1bb2897fd5c77161de0e6 [0,1,0,0,0,0|1,0,2]=4 3052 B12R1.30 C=CCNC(C)c1ccccn1 c871e35924d1285dbc4ab72286e49e42 [0,1,0,0,0,0|1,0,2]=4 3053 B12R1.30 C=CCN[C@@H](C)c1ccccn1 0c83b227f7279b700dffa4249ee218bc [0,1,0,0,0,0|1,0,2]=4 3054 B12R1.30 C=CCN[C@H](C)c1ccccn1 5725d2337792d58c3662e47d36012d96 [0,1,0,0,0,0|1,0,2]=4 3055 B12R1.30 C=CCOC(C)c1ccccn1 2c53cb9c7cda21871f7c62bd9f43124b [0,1,0,0,0,0|1,0,2]=4 3056 B12R1.30 C=CCO[C@@H](C)c1ccccn1 5b7bf17d4a8db0cdcc2bae4ca7709554 [0,1,0,0,0,0|1,0,2]=4 3057 B12R1.30 C=CCO[C@H](C)c1ccccn1 d9e7624746bfc75b4b233508a3d3ba17 [0,1,0,0,0,0|1,0,2]=4 3058 B12R1.30 CC(CNCF)c1ccccc1 5f1d9fd84074424c65197fad8c2e5513 [0,1,0,0,0,0|3,0,0]=4 3059 B12R1.30 CC(CNCO)c1ccccc1 462ae9832b5de19cce882c0427ce8c7b [0,1,0,0,0,0|3,0,0]=4 3060 B12R1.30 CC(COCF)c1ccccc1 c129742ad0b3dcb07ba4c78eb9851e3b [0,1,0,0,0,0|3,0,0]=4 3061 B12R1.30 CC(COCF)c1ccccn1 cadf5699bf3656449a20b6c87901461e [0,1,0,0,0,0|2,0,0]=3 3062 B12R1.30 CC(NCC#N)c1ccccn1 a9ec91ed37d65c2c6da5622288d0690e [0,1,0,0,0,0|2,0,1]=4 3063 B12R1.30 CC(NCC=O)c1ccccn1 e51da0a1ec816ae853b050ab1b623ea4 [0,1,0,0,0,0|2,0,1]=4 3064 B12R1.30 CC(NCCF)c1ccccc1 a4890edd7f21677f225a27bfc036a9e4 [0,1,0,0,0,0|3,0,0]=4 3065 B12R1.30 CC(NCCF)c1ccccn1 e4b3c22db6493feb1d8ba5ab52abe2b7 [0,1,0,0,0,0|2,0,0]=3 3066 B12R1.30 CC(NCCF)c1cccnn1 378df68c9b7e2731e03bbd35dd26a778 [0,1,0,0,0,0|3,0,0]=4 3067 B12R1.30 CC(NCCF)c1ccncn1 cdad2bf569a22bfef5ceb1e6eb667372 [0,1,0,0,0,0|3,0,0]=4 3068 B12R1.30 CC(NCCF)c1cnccn1 526b1964cdeb746d09fbb1d3f5b8d550 [0,1,0,0,0,0|3,0,0]=4 3069 B12R1.30 CC(NCCF)c1ncccn1 8b52997c782440c32edcaade9950e2bf [0,1,0,0,0,0|3,0,0]=4 3070 B12R1.30 CC(NCCO)c1ccccc1 15ebe2893003a0c55ecacb3da2e2c5b8 [0,1,0,0,0,0|3,0,0]=4 3071 B12R1.30 CC(NCCO)c1ccccn1 1f2512975bc0cda2de4ebeb90f7dc4c3 [0,1,0,0,0,0|2,0,0]=3 3072 B12R1.30 CC(NCCO)c1cccnn1 71f8c48cc767772398bf86786dbec8a1 [0,1,0,0,0,0|3,0,0]=4 3073 B12R1.30 CC(NCCO)c1ccncn1 81a4e361b9d04ae9e65e9427a3c9f5f2 [0,1,0,0,0,0|3,0,0]=4 3074 B12R1.30 CC(NCCO)c1cnccn1 526a392317240d71c4ff3b0c450c61ac [0,1,0,0,0,0|3,0,0]=4 3075 B12R1.30 CC(NCCO)c1ncccn1 d351757eb55ed505210def43e8d94148 [0,1,0,0,0,0|3,0,0]=4 3076 B12R1.30 CC(NCCS)c1ccccc1 c90c5f78811b5a3e744fa24aabe1d478 [0,1,0,0,0,0|3,0,0]=4 3077 B12R1.30 CC(NCCS)c1ccccn1 bc977812ec4257d304ab2ebe4f44b33d [0,1,0,0,0,0|2,0,0]=3 3078 B12R1.30 CC(NCCS)c1cccnn1 ae071c43d16ef9832a90f7dd78efa121 [0,1,0,0,0,0|3,0,0]=4 3079 B12R1.30 CC(NCCS)c1ccncn1 94db193b730e29c4ab5b4fba158e74c9 [0,1,0,0,0,0|3,0,0]=4 3080 B12R1.30 CC(NCCS)c1cnccn1 c7c7823cf6c81384b646f269fa2e3a66 [0,1,0,0,0,0|3,0,0]=4 3081 B12R1.30 CC(NCCS)c1ncccn1 6e4e0b49a48bdeddc6b2656b7863f046 [0,1,0,0,0,0|3,0,0]=4 3082 B12R1.30 CC(OCC#N)c1ccccn1 55103d5613a0834edea244d4f43155f8 [0,1,0,0,0,0|2,0,1]=4 3083 B12R1.30 CC(OCC=O)c1ccccn1 5e9193ad7845d8e005dcfb3d336fa9c4 [0,1,0,0,0,0|2,0,1]=4 3084 B12R1.30 CC(OCCF)c1ccccc1 296004c8a3c297153de64ff701a708ab [0,1,0,0,0,0|3,0,0]=4 3085 B12R1.30 CC(OCCF)c1ccccn1 1e34d1fd3e0ec6ea60da54fdaef9c85f [0,1,0,0,0,0|2,0,0]=3 3086 B12R1.30 CC(OCCF)c1cccnn1 e61e2d4d5c3415ba82f8c763331a41a4 [0,1,0,0,0,0|3,0,0]=4 3087 B12R1.30 CC(OCCF)c1cnccn1 b8f5dd316068b7d46ab87f8b885f31f8 [0,1,0,0,0,0|3,0,0]=4 3088 B12R1.30 CC(OCCF)c1ncccn1 28831d312976d3be01b916e2d35c6295 [0,1,0,0,0,0|3,0,0]=4 3089 B12R1.30 CC(OCCS)c1ccccc1 8a2d25daddbc7e25b5ea41349af0bdcf [0,1,0,0,0,0|3,0,0]=4 3090 B12R1.30 CC(OCCS)c1ccccn1 6fa6a7898d0d08fa2306db1213a20785 [0,1,0,0,0,0|2,0,0]=3 3091 B12R1.30 CC(OCCS)c1cccnn1 b976386e198d9b1fb41aeef2ee27a93a [0,1,0,0,0,0|3,0,0]=4 3092 B12R1.30 CC(OCCS)c1cnccn1 70ec28368a91664b235930b2355630f4 [0,1,0,0,0,0|3,0,0]=4 3093 B12R1.30 CC(OCCS)c1ncccn1 a11debd31c680eb3ac5629fe409bde93 [0,1,0,0,0,0|3,0,0]=4 3094 B12R1.30 CCCCN(C)c1ccccc1 5138c426816999d109cc4a6b536acc57 [0,1,0,0,0,0|2,0,0]=3 3095 B12R1.30 CCCCN(C)c1ccccn1 28cd8015bdaf9aae9f5fc252e8d2111d [0,1,0,0,0,0|1,0,0]=2 3096 B12R1.30 CCCCN(C)c1cccnc1 088893a35ea97628d677bdb560c104b8 [0,1,0,0,0,0|3,0,0]=4 3097 B12R1.30 CCCCN(C)c1cccnn1 89c1cc84d694607906e57e7e5d8c3a46 [0,1,0,0,0,0|2,0,0]=3 3098 B12R1.30 CCCCN(C)c1ccncc1 75414bf2a6ccb411945f0546844c595b [0,1,0,0,0,0|3,0,0]=4 3099 B12R1.30 CCCCN(C)c1ccncn1 21d8dcf004ed0bbab20f8d430eb68dd3 [0,1,0,0,0,0|2,0,0]=3 3100 B12R1.30 CCCCN(C)c1cnccn1 98c99516c32f82fb99bc5821f007edcf [0,1,0,0,0,0|2,0,0]=3 3101 B12R1.30 CCCCN(C)c1ncccn1 b87cf80f57d561700ef2f63dfae71dda [0,1,0,0,0,0|2,0,0]=3 3102 B12R1.30 CCCCN(C)c1nccnn1 77cdbe657ac86261c49f8ed9a191cf0d [0,1,0,0,0,0|3,0,0]=4 3103 B12R1.30 CCCNC(=O)c1ccccc1 17d55bfe3f14492436164da3d0c80e57 [0,1,0,0,0,0|2,0,1]=4 3104 B12R1.30 CCCNC(=O)c1ccccn1 aec690230b3cc4437d966e9bbbea0961 [0,1,0,0,0,0|1,0,1]=3 3105 B12R1.30 CCCNC(=O)c1cccnn1 d79db48c2c6d122ffd7c966384637b17 [0,1,0,0,0,0|2,0,1]=4 3106 B12R1.30 CCCNC(=O)c1ccncn1 5af7bda680935b060506356f810ba6a3 [0,1,0,0,0,0|2,0,1]=4 3107 B12R1.30 CCCNC(=O)c1cnccn1 4f0c6ad8dfe097ecbbeb03521862c352 [0,1,0,0,0,0|2,0,1]=4 3108 B12R1.30 CCCNC(=O)c1ncccn1 021169bd43c989c25245cf4b32ed4963 [0,1,0,0,0,0|2,0,1]=4 3109 B12R1.30 CCCNC(C)c1ccccc1 37d48536a03c5d64ae70e596dd73ed85 [0,1,0,0,0,0|2,0,0]=3 3110 B12R1.30 CCCNC(C)c1ccccn1 cc14fd04410800b4bd6435a8ddd3bb22 [0,1,0,0,0,0|1,0,0]=2 3111 B12R1.30 CCCNC(C)c1cccnc1 ad711bb62eeb1aee43dc7dd8f93d36ef [0,1,0,0,0,0|3,0,0]=4 3112 B12R1.30 CCCNC(C)c1cccnn1 91bef6ccf7ab5b1ecc37eea930adc6f3 [0,1,0,0,0,0|2,0,0]=3 3113 B12R1.30 CCCNC(C)c1ccncc1 5bbf0ec17de63181b9f984c6ee459099 [0,1,0,0,0,0|3,0,0]=4 3114 B12R1.30 CCCNC(C)c1ccncn1 cabe848c08583fb62240b7ebb28a54d8 [0,1,0,0,0,0|2,0,0]=3 3115 B12R1.30 CCCNC(C)c1cnccn1 4e28ad8415574e3e1ea0b16e481ded74 [0,1,0,0,0,0|2,0,0]=3 3116 B12R1.30 CCCNC(C)c1ncccn1 72735f211b841fff2ba38c4964bdc89e [0,1,0,0,0,0|2,0,0]=3 3117 B12R1.30 CCCN[C@@H](C)c1ccccc1 604408ade040f4a9c55069b166a57921 [0,1,0,0,0,0|2,0,0]=3 3118 B12R1.30 CCCN[C@@H](C)c1ccccn1 03c5378eb87bcbab461643e14036da7b [0,1,0,0,0,0|1,0,0]=2 3119 B12R1.30 CCCN[C@@H](C)c1cccnc1 ebfd88cd08246c9c4c8dd5665a36e4de [0,1,0,0,0,0|3,0,0]=4 3120 B12R1.30 CCCN[C@@H](C)c1ccncc1 247a85b98e9473b8ba80ebe1aa76666d [0,1,0,0,0,0|3,0,0]=4 3121 B12R1.30 CCCN[C@H](C)c1ccccc1 b93dc36e1ac43b4dfb18fc821dba383a [0,1,0,0,0,0|2,0,0]=3 3122 B12R1.30 CCCN[C@H](C)c1ccccn1 b254cf125be5ff667ba0c27b98f7399e [0,1,0,0,0,0|1,0,0]=2 3123 B12R1.30 CCCN[C@H](C)c1cccnc1 336ef7d0edfb76e914cc3e6724738449 [0,1,0,0,0,0|3,0,0]=4 3124 B12R1.30 CCCN[C@H](C)c1ccncc1 c38d0e044de489d76af7664dba013771 [0,1,0,0,0,0|3,0,0]=4 3125 B12R1.30 CCCOC(C)c1ccccc1 b3e8a20aaf9fee6fd90ba3c942d17cbb [0,1,0,0,0,0|2,0,0]=3 3126 B12R1.30 CCCOC(C)c1ccccn1 b39d3fe2e04295201526414ffb8b346f [0,1,0,0,0,0|1,0,0]=2 3127 B12R1.30 CCCOC(C)c1cccnc1 b4a5c4f0d8d2d6a3dec1c8ec47f4f20f [0,1,0,0,0,0|3,0,0]=4 3128 B12R1.30 CCCOC(C)c1cccnn1 dbc29eb8155416655d21726e180a271c [0,1,0,0,0,0|2,0,0]=3 3129 B12R1.30 CCCOC(C)c1ccncc1 23b85e46df5ec55325d031745f8d75b2 [0,1,0,0,0,0|3,0,0]=4 3130 B12R1.30 CCCOC(C)c1cnccn1 4299c6c51693e9ffa4917243495f6064 [0,1,0,0,0,0|2,0,0]=3 3131 B12R1.30 CCCOC(C)c1ncccn1 fb06000019c7617767b94335fe2c0dce [0,1,0,0,0,0|2,0,0]=3 3132 B12R1.30 CCCO[C@@H](C)c1ccccc1 b5a89a5e2269c078fad9874c053ef84d [0,1,0,0,0,0|2,0,0]=3 3133 B12R1.30 CCCO[C@@H](C)c1ccccn1 180a656c513628a596211eb51193e51c [0,1,0,0,0,0|1,0,0]=2 3134 B12R1.30 CCCO[C@@H](C)c1cccnc1 a6442581c5df29535d93cb8f5fa5694f [0,1,0,0,0,0|3,0,0]=4 3135 B12R1.30 CCCO[C@@H](C)c1ccncc1 f346339788fa1f3b54ec1b08208e6598 [0,1,0,0,0,0|3,0,0]=4 3136 B12R1.30 CCCO[C@@H](C)c1ccncn1 3eb8112858fffed2c75f8ad0fdf97d61 [0,1,0,0,0,0|2,0,0]=3 3137 B12R1.30 CCCO[C@@H](C)c1cnccn1 d510915090cb0263183ec6af29fdbf7d [0,1,0,0,0,0|2,0,0]=3 3138 B12R1.30 CCCO[C@@H](C)c1ncccn1 1040378add10d12bd4a753b845a4b1df [0,1,0,0,0,0|2,0,0]=3 3139 B12R1.30 CCCO[C@H](C)c1ccccc1 ae53c06444379dfac4167ac84138cfb9 [0,1,0,0,0,0|2,0,0]=3 3140 B12R1.30 CCCO[C@H](C)c1ccccn1 59ae42f1d2cbb8cb8fe36530c47f41d1 [0,1,0,0,0,0|1,0,0]=2 3141 B12R1.30 CCCO[C@H](C)c1cccnc1 fec7058011aa3e2c96cfd1d3b525aa6e [0,1,0,0,0,0|3,0,0]=4 3142 B12R1.30 CCCO[C@H](C)c1cccnn1 5367bf5d4aa77dfd47ea27bfcee6ea8c [0,1,0,0,0,0|2,0,0]=3 3143 B12R1.30 CCCO[C@H](C)c1ccncc1 cb8ccc8bc89fedd96f0e6231288da52e [0,1,0,0,0,0|3,0,0]=4 3144 B12R1.30 CCCO[C@H](C)c1cnccn1 df70c13c08be6c0da83a94b74bf03245 [0,1,0,0,0,0|2,0,0]=3 3145 B12R1.30 CCCO[C@H](C)c1ncccn1 5ac02d395e6aecd416cc185f1c3ee11f [0,1,0,0,0,0|2,0,0]=3 3146 B12R1.30 CCNCC(=O)c1ccccc1 120782ba76f814e86bdef32896186f08 [0,1,0,0,0,0|2,0,1]=4 3147 B12R1.30 CCNCC(C)c1ccccc1 9cbf919020878038d0809e43f1be15bb [0,1,0,0,0,0|2,0,0]=3 3148 B12R1.30 CCNCC(O)c1ccccc1 2c7684bc90e6b6f2eb9cc788b34e49e9 [0,1,0,0,0,0|2,0,0]=3 3149 B12R1.30 CCNCC(O)c1ccccn1 6b1c434bb8a1b8b261ec43b19c8a9bde [0,1,0,0,0,0|1,0,0]=2 3150 B12R1.30 CCNCC(O)c1cccnc1 855e09cd2dd0a891326c5d3074b7ce5d [0,1,0,0,0,0|3,0,0]=4 3151 B12R1.30 CCNCC(O)c1ccncc1 3f7210030fe9a0f2bae5b80e88f85abe [0,1,0,0,0,0|3,0,0]=4 3152 B12R1.30 CCNC[C@@H](C)c1ccccc1 6865a599cc7f5b285bd8c007b28c9b34 [0,1,0,0,0,0|2,0,0]=3 3153 B12R1.30 CCNC[C@@H](O)c1ccccc1 1fa8d71540df38b9b8cbd54368ff1949 [0,1,0,0,0,0|2,0,0]=3 3154 B12R1.30 CCNC[C@H](C)c1ccccc1 ff4ae3e1c0acb37fe8ab1f33c54ee87a [0,1,0,0,0,0|2,0,0]=3 3155 B12R1.30 CCNC[C@H](O)c1ccccc1 a3ad7a2afde7d6051248f34aaf7ade1e [0,1,0,0,0,0|2,0,0]=3 3156 B12R1.30 CCOCC(=O)c1ccccc1 d10a1656db1ce15c4b0e7531fc2ce741 [0,1,0,0,0,0|2,0,1]=4 3157 B12R1.30 CCOCC(=O)c1ccccn1 dca3a90de36d6da1383fefa302a94393 [0,1,0,0,0,0|1,0,1]=3 3158 B12R1.30 CCOCC(C)c1ccccc1 7d0863132e6f64e2e8f3b829c1ba4213 [0,1,0,0,0,0|2,0,0]=3 3159 B12R1.30 CCOCC(C)c1ccccn1 2d50cc0927617393348c2ce87012ad45 [0,1,0,0,0,0|1,0,0]=2 3160 B12R1.30 CCOCN(C)c1ccccn1 8340951be42ff358eb4cbbdc08f4ab4f [0,1,0,0,0,0|2,0,0]=3 3161 B12R1.30 CCOCN(C)c1ccncn1 1ec6c2f6a439881cf80d79c0e1f6f022 [0,1,0,0,0,0|3,0,0]=4 3162 B12R1.30 CCOCN(C)c1cnccn1 fe59858a45eacfd9118604afce248d1f [0,1,0,0,0,0|3,0,0]=4 3163 B12R1.30 CCOCN(C)c1ncccn1 78f1ee1b24e39798f493c2c5df274664 [0,1,0,0,0,0|3,0,0]=4 3164 B12R1.30 CCOC[C@@H](C)c1ccccc1 5d4adf02715a7dc88fd8e9ed1c1ccac0 [0,1,0,0,0,0|2,0,0]=3 3165 B12R1.30 CCOC[C@H](C)c1ccccc1 71da89b37784dc3a33c9c6970d6f6435 [0,1,0,0,0,0|2,0,0]=3 3166 B12R1.30 CN(CCC#N)c1ccccn1 214304c8c0bceaa3bcfd1e0a98b7ad1d [0,1,0,0,0,0|2,0,1]=4 3167 B12R1.30 CN(CCC=O)c1ccccn1 0466960b9cd011959e32d459076398f7 [0,1,0,0,0,0|2,0,1]=4 3168 B12R1.30 CN(CCCF)c1ccccc1 721389a2fe3a1bc3a7ab8adcc61dc5ff [0,1,0,0,0,0|3,0,0]=4 3169 B12R1.30 CN(CCCF)c1ccccn1 f82732034faff0efb4c76ab215fc2390 [0,1,0,0,0,0|2,0,0]=3 3170 B12R1.30 CN(CCCF)c1cccnn1 16b947ba2ebfbfbdf29b35e3b3a8a80d [0,1,0,0,0,0|3,0,0]=4 3171 B12R1.30 CN(CCCF)c1ccncn1 5e4f1d634e22edd7e6186dce68f9f84f [0,1,0,0,0,0|3,0,0]=4 3172 B12R1.30 CN(CCCF)c1cnccn1 44665d3ed71953645669b29fe19a0ae1 [0,1,0,0,0,0|3,0,0]=4 3173 B12R1.30 CN(CCCF)c1ncccn1 c50025b8f393c8dd38448de7ce8aaaeb [0,1,0,0,0,0|3,0,0]=4 3174 B12R1.30 CN(CCCO)c1ccccc1 99b9f18cd67ae7ad12fedc7e34599859 [0,1,0,0,0,0|3,0,0]=4 3175 B12R1.30 CN(CCCO)c1ccccn1 6a0267938e46dcaa9e7d0d0bdf5a5018 [0,1,0,0,0,0|2,0,0]=3 3176 B12R1.30 CN(CCCO)c1cccnn1 e4f402bf02557c5dbd26cfde2503b4c3 [0,1,0,0,0,0|3,0,0]=4 3177 B12R1.30 CN(CCCO)c1ccncn1 03b5845c3a3e3952ea2f22c5440837ad [0,1,0,0,0,0|3,0,0]=4 3178 B12R1.30 CN(CCCO)c1cnccn1 60ee7b3e95b9ed783f1007d922dbd6a5 [0,1,0,0,0,0|3,0,0]=4 3179 B12R1.30 CN(CCCO)c1ncccn1 c13739bb3f821fb33b99b253b3658bf6 [0,1,0,0,0,0|3,0,0]=4 3180 B12R1.30 CN(CCCS)c1ccccn1 a7513535781e19af129643ad81a737e2 [0,1,0,0,0,0|2,0,0]=3 3181 B12R1.30 CN(CCCS)c1cccnn1 4a60d281166973fceca7bbbb884e5053 [0,1,0,0,0,0|3,0,0]=4 3182 B12R1.30 CN(CCCS)c1ccncn1 33b4385fbf1343a95434af0013588d29 [0,1,0,0,0,0|3,0,0]=4 3183 B12R1.30 CN(CCCS)c1cnccn1 bef7d030d74aa9ec636f360f3fa0a600 [0,1,0,0,0,0|3,0,0]=4 3184 B12R1.30 CN(CCCS)c1ncccn1 fce7c12ba087a241cd98f2d287a0075b [0,1,0,0,0,0|3,0,0]=4 3185 B12R1.30 CN(CCON)c1ccccn1 4ad2f65b6bf22319240009e381b63f09 [0,1,0,0,0,0|3,0,0]=4 3186 B12R1.30 COCCN(C)c1ccccc1 f88ab3abd109b8d6e952f5ff5bda6892 [0,1,0,0,0,0|3,0,0]=4 3187 B12R1.30 COCCN(C)c1ccccn1 376e5b72ea9a7dbdd5aeb5f5bc5cf452 [0,1,0,0,0,0|2,0,0]=3 3188 B12R1.30 COCCN(C)c1cccnn1 936beb091401ab8dd25dcb2b91b6bc6a [0,1,0,0,0,0|3,0,0]=4 3189 B12R1.30 COCCN(C)c1ccncn1 480e6f1619029fc08e1141863e98f792 [0,1,0,0,0,0|3,0,0]=4 3190 B12R1.30 COCCN(C)c1cnccn1 d842e1e462c76605dbc52f08501ed99c [0,1,0,0,0,0|3,0,0]=4 3191 B12R1.30 COCCN(C)c1ncccn1 6b4cf3c01ecd7492b1166cf813593ffb [0,1,0,0,0,0|3,0,0]=4 3192 B12R1.30 COCNC(C)c1ccccc1 da3a97833b329d52bf380d21525de137 [0,1,0,0,0,0|3,0,0]=4 3193 B12R1.30 COCNC(C)c1ccccn1 22800b3ec5673e703cef9baf9917e3d2 [0,1,0,0,0,0|2,0,0]=3 3194 B12R1.30 COCNC(C)c1cccnn1 cf1e0f025ae1123ccfd253eda86c8b19 [0,1,0,0,0,0|3,0,0]=4 3195 B12R1.30 COCNC(C)c1ccncn1 35622b06ce15fedb4e01839c51c495ae [0,1,0,0,0,0|3,0,0]=4 3196 B12R1.30 COCNC(C)c1cnccn1 44f734383c1cb52ec567bd57782cbe4a [0,1,0,0,0,0|3,0,0]=4 3197 B12R1.30 COCNC(C)c1ncccn1 bf3b7d2d23f9f00fcaaf50b0a692dab9 [0,1,0,0,0,0|3,0,0]=4 3198 B12R1.30 COCN[C@@H](C)c1ccccc1 b0afc671726e2aa3bbf25811f588d87b [0,1,0,0,0,0|3,0,0]=4 3199 B12R1.30 COCN[C@@H](C)c1ccccn1 4145c37cf98927207d4b903c5b8dd837 [0,1,0,0,0,0|2,0,0]=3 3200 B12R1.30 COCN[C@H](C)c1ccccc1 9e08f5d5391d04ef9dca8846d7c418b1 [0,1,0,0,0,0|3,0,0]=4 3201 B12R1.30 COCN[C@H](C)c1ccccn1 2342d53c6195e8ed5385640c40678800 [0,1,0,0,0,0|2,0,0]=3 3202 B12R1.30 COCOC(C)c1ccccc1 0b1f9c9cdb2cc63a37919c47ba14afe7 [0,1,0,0,0,0|3,0,0]=4 3203 B12R1.30 COCOC(C)c1ccccn1 96e3f8673063db846b1328064926b8e5 [0,1,0,0,0,0|2,0,0]=3 3204 B12R1.30 COCOC(C)c1cccnn1 89333483d765b95bcfbc5e106c5827d1 [0,1,0,0,0,0|3,0,0]=4 3205 B12R1.30 COCOC(C)c1cnccn1 47d60ede0006ef61790aec4973a16141 [0,1,0,0,0,0|3,0,0]=4 3206 B12R1.30 COCOC(C)c1ncccn1 32791ad8683b8f75865b5523726823c9 [0,1,0,0,0,0|3,0,0]=4 3207 B12R1.30 COCO[C@@H](C)c1ccccc1 4f223b91f36fa3bfe971e90568b0e3b0 [0,1,0,0,0,0|3,0,0]=4 3208 B12R1.30 COCO[C@@H](C)c1ccccn1 2377670b88698f2edbc70d4e18de68ac [0,1,0,0,0,0|2,0,0]=3 3209 B12R1.30 COCO[C@@H](C)c1ccncn1 f9a9c5e84a35074d721101d05d41bdfc [0,1,0,0,0,0|3,0,0]=4 3210 B12R1.30 COCO[C@@H](C)c1cnccn1 d5e8aec4add367d6f8e96a15fb75e361 [0,1,0,0,0,0|3,0,0]=4 3211 B12R1.30 COCO[C@@H](C)c1ncccn1 50c1ecb7bb0fca8a53007fb6c43357ce [0,1,0,0,0,0|3,0,0]=4 3212 B12R1.30 COCO[C@H](C)c1ccccc1 ba83963d37e25f49896a3a9bad50ab4f [0,1,0,0,0,0|3,0,0]=4 3213 B12R1.30 COCO[C@H](C)c1ccccn1 458a21f21c67e992b19f7c56288b02ea [0,1,0,0,0,0|2,0,0]=3 3214 B12R1.30 COCO[C@H](C)c1cccnn1 3240b94cd89f6c142441eafe5286d587 [0,1,0,0,0,0|3,0,0]=4 3215 B12R1.30 COCO[C@H](C)c1cnccn1 aefda3de9ef6b4cf2de0abaf33ce3914 [0,1,0,0,0,0|3,0,0]=4 3216 B12R1.30 COCO[C@H](C)c1ncccn1 4feb3ad7c352f77a2adec633800331a0 [0,1,0,0,0,0|3,0,0]=4 3217 B12R1.30 CSCCN(C)c1ccccc1 e519282dbdf6c8d213fc611d45219205 [0,1,0,0,0,0|3,0,0]=4 3218 B12R1.30 CSCCN(C)c1ccccn1 f4859c90f775cbf4c83f0a7f2a89568d [0,1,0,0,0,0|2,0,0]=3 3219 B12R1.30 CSCCN(C)c1cccnn1 dc9be65b8c2f807a81bea190804e03e4 [0,1,0,0,0,0|3,0,0]=4 3220 B12R1.30 CSCCN(C)c1ccncn1 3895d83d320e848dd16f06c4a910403a [0,1,0,0,0,0|3,0,0]=4 3221 B12R1.30 CSCCN(C)c1cnccn1 5abc869c9e6b40c0e783ff0906d16e3c [0,1,0,0,0,0|3,0,0]=4 3222 B12R1.30 CSCCN(C)c1ncccn1 0e91df3bee797fbbef593792fbd1976f [0,1,0,0,0,0|3,0,0]=4 3223 B12R1.30 CSCNC(C)c1ccccc1 6f92386efe5ddba474bf8f6e5b5463ff [0,1,0,0,0,0|3,0,0]=4 3224 B12R1.30 CSCNC(C)c1ccccn1 ddb2d3f894b38cfc3c20828a85d8aeba [0,1,0,0,0,0|2,0,0]=3 3225 B12R1.30 CSCNC(C)c1cccnn1 40be2c08787180756293c48e3d82b64b [0,1,0,0,0,0|3,0,0]=4 3226 B12R1.30 CSCNC(C)c1ccncn1 00d23cd3d0e84f342e977b2a4443c604 [0,1,0,0,0,0|3,0,0]=4 3227 B12R1.30 CSCNC(C)c1cnccn1 35337a01192eeee3a9d9c4cb495f92d6 [0,1,0,0,0,0|3,0,0]=4 3228 B12R1.30 CSCNC(C)c1ncccn1 27a02ba52a033109dfea595d6e90cab8 [0,1,0,0,0,0|3,0,0]=4 3229 B12R1.30 CSCN[C@@H](C)c1ccccc1 845e66030d932d6618c275454e4a088a [0,1,0,0,0,0|3,0,0]=4 3230 B12R1.30 CSCN[C@@H](C)c1ccccn1 4dfba9ca9a55cc8822f57f2605ede0af [0,1,0,0,0,0|2,0,0]=3 3231 B12R1.30 CSCN[C@H](C)c1ccccc1 30f91454a02398d41f15145ae4807b21 [0,1,0,0,0,0|3,0,0]=4 3232 B12R1.30 CSCN[C@H](C)c1ccccn1 b34c76b9aa83c7d60db5d09418063e93 [0,1,0,0,0,0|2,0,0]=3 3233 B12R1.30 CSCOC(C)c1ccccc1 641ae777302bb1952ab6a4af8532f275 [0,1,0,0,0,0|3,0,0]=4 3234 B12R1.30 CSCOC(C)c1ccccn1 3962a04da2204a1cf7830ac87133888a [0,1,0,0,0,0|2,0,0]=3 3235 B12R1.30 CSCOC(C)c1cccnn1 f330a08c6edc604b62e998c508e568ec [0,1,0,0,0,0|3,0,0]=4 3236 B12R1.30 CSCOC(C)c1cnccn1 cbf12d7406c941077b404eae50b0a441 [0,1,0,0,0,0|3,0,0]=4 3237 B12R1.30 CSCOC(C)c1ncccn1 8407d108bb1c8aac0536fcd0665d901c [0,1,0,0,0,0|3,0,0]=4 3238 B12R1.30 CSCO[C@@H](C)c1ccccc1 4fac534708704f5d5e3429eb46cba8d5 [0,1,0,0,0,0|3,0,0]=4 3239 B12R1.30 CSCO[C@@H](C)c1ccccn1 e9e6ffeb6ad8c32ddf7c2cb22d9b25ee [0,1,0,0,0,0|2,0,0]=3 3240 B12R1.30 CSCO[C@@H](C)c1cnccn1 e5bced7cedda64af26a400c1f4dc4bb8 [0,1,0,0,0,0|3,0,0]=4 3241 B12R1.30 CSCO[C@@H](C)c1ncccn1 21bf6de1ed980a94d0ab0197a384fffd [0,1,0,0,0,0|3,0,0]=4 3242 B12R1.30 CSCO[C@H](C)c1ccccc1 6e65c7d8640db47c99545e1f59d710dc [0,1,0,0,0,0|3,0,0]=4 3243 B12R1.30 CSCO[C@H](C)c1ccccn1 0ecacf74edbb4be90693870fe439bf49 [0,1,0,0,0,0|2,0,0]=3 3244 B12R1.30 CSCO[C@H](C)c1cccnn1 3bc357f7b5772481df158fc6580aa1c9 [0,1,0,0,0,0|3,0,0]=4 3245 B12R1.30 CSCO[C@H](C)c1cnccn1 feb044cfaed34d6881e359261f31e2b1 [0,1,0,0,0,0|3,0,0]=4 3246 B12R1.30 CSCO[C@H](C)c1ncccn1 c9ec6287cad036768e4929ab09c633f3 [0,1,0,0,0,0|3,0,0]=4 3247 B12R1.30 C[C@@H](CNCF)c1ccccc1 796d7cc72a99b25de3cd91eec937f176 [0,1,0,0,0,0|3,0,0]=4 3248 B12R1.30 C[C@@H](CNCO)c1ccccc1 742ee8e739f2ff7dbfa020bf6612568d [0,1,0,0,0,0|3,0,0]=4 3249 B12R1.30 C[C@@H](COCF)c1ccccc1 3ef1be7494a491550febb3ea126e0341 [0,1,0,0,0,0|3,0,0]=4 3250 B12R1.30 C[C@@H](NCC#N)c1ccccn1 31e3a4f8ecfc4a47f723a987c48020d8 [0,1,0,0,0,0|2,0,1]=4 3251 B12R1.30 C[C@@H](NCC=O)c1ccccn1 3847a7eda354f4e826d96e4c676fbe2c [0,1,0,0,0,0|2,0,1]=4 3252 B12R1.30 C[C@@H](NCCF)c1ccccc1 6855a77d5eca1f1b4bab257a19ad71b3 [0,1,0,0,0,0|3,0,0]=4 3253 B12R1.30 C[C@@H](NCCF)c1ccccn1 154a8f5306674b5b4fb86554624d8f02 [0,1,0,0,0,0|2,0,0]=3 3254 B12R1.30 C[C@@H](NCCO)c1ccccc1 4d75c0848045c856d6629664b5c37bb2 [0,1,0,0,0,0|3,0,0]=4 3255 B12R1.30 C[C@@H](NCCO)c1ccccn1 0a16ea94a018ff0b30ce209917ed1b9a [0,1,0,0,0,0|2,0,0]=3 3256 B12R1.30 C[C@@H](NCCS)c1ccccc1 f68ec1897d41d2f78889d11e1a576659 [0,1,0,0,0,0|3,0,0]=4 3257 B12R1.30 C[C@@H](NCCS)c1ccccn1 3c328d281ac093addd2e4f5b2a08326f [0,1,0,0,0,0|2,0,0]=3 3258 B12R1.30 C[C@@H](OCC#N)c1ccccn1 5f86adacac72585b16715679bc57ed2b [0,1,0,0,0,0|2,0,1]=4 3259 B12R1.30 C[C@@H](OCC=O)c1ccccn1 98b7f4428e1a69c9c42b110085c0725b [0,1,0,0,0,0|2,0,1]=4 3260 B12R1.30 C[C@@H](OCCF)c1ccccc1 203a44e775c1adfe6a43ad6321e3d4aa [0,1,0,0,0,0|3,0,0]=4 3261 B12R1.30 C[C@@H](OCCF)c1ccccn1 306dcb258e36cc782fdcf000c106db6f [0,1,0,0,0,0|2,0,0]=3 3262 B12R1.30 C[C@@H](OCCF)c1cccnn1 ae082288a0030792c5075ab9a7abeee8 [0,1,0,0,0,0|3,0,0]=4 3263 B12R1.30 C[C@@H](OCCF)c1cnccn1 6d9407100c24992a3c41eed811798b86 [0,1,0,0,0,0|3,0,0]=4 3264 B12R1.30 C[C@@H](OCCF)c1ncccn1 8114efac6741426a22578547e4678628 [0,1,0,0,0,0|3,0,0]=4 3265 B12R1.30 C[C@@H](OCCS)c1ccccc1 831161e77b199edd57098275b43b0190 [0,1,0,0,0,0|3,0,0]=4 3266 B12R1.30 C[C@@H](OCCS)c1ccccn1 00966c93f3a32971e22b816f853a389e [0,1,0,0,0,0|2,0,0]=3 3267 B12R1.30 C[C@@H](OCCS)c1cccnn1 422172b2b692efa0c97e673789253d78 [0,1,0,0,0,0|3,0,0]=4 3268 B12R1.30 C[C@@H](OCCS)c1cnccn1 7ee6bbc74fefb922ce2b0504e903a8fb [0,1,0,0,0,0|3,0,0]=4 3269 B12R1.30 C[C@@H](OCCS)c1ncccn1 65e62ca81c83068d8740e9acdd28af4f [0,1,0,0,0,0|3,0,0]=4 3270 B12R1.30 C[C@H](CNCF)c1ccccc1 b55b7c71b6efb4d2ef804c8c8ecd1876 [0,1,0,0,0,0|3,0,0]=4 3271 B12R1.30 C[C@H](CNCO)c1ccccc1 348e8a14ee3f664d50cb7fb06a3ca693 [0,1,0,0,0,0|3,0,0]=4 3272 B12R1.30 C[C@H](COCF)c1ccccc1 dfac0c7125baf2c94bf4011a8539eabb [0,1,0,0,0,0|3,0,0]=4 3273 B12R1.30 C[C@H](NCC#N)c1ccccn1 bc5da37c07a0a8a477c4b315b4b99aed [0,1,0,0,0,0|2,0,1]=4 3274 B12R1.30 C[C@H](NCC=O)c1ccccn1 6cfb7096cc21c976fe37a2003ccb317e [0,1,0,0,0,0|2,0,1]=4 3275 B12R1.30 C[C@H](NCCF)c1ccccc1 da1d01952688d248cad72e73d81548b6 [0,1,0,0,0,0|3,0,0]=4 3276 B12R1.30 C[C@H](NCCF)c1ccccn1 f1507c4498e0ea85ccdeaef26b852927 [0,1,0,0,0,0|2,0,0]=3 3277 B12R1.30 C[C@H](NCCO)c1ccccc1 1afbfcd53073af538ea2805bff509aa6 [0,1,0,0,0,0|3,0,0]=4 3278 B12R1.30 C[C@H](NCCO)c1ccccn1 c2fd11dd9f27b634fcee9eaeb69b256c [0,1,0,0,0,0|2,0,0]=3 3279 B12R1.30 C[C@H](NCCS)c1ccccc1 8f0e850ed93fd86c5c98f711b3615cfc [0,1,0,0,0,0|3,0,0]=4 3280 B12R1.30 C[C@H](NCCS)c1ccccn1 f4973bc66b9f31efb5fdc29911ab6563 [0,1,0,0,0,0|2,0,0]=3 3281 B12R1.30 C[C@H](OCC#N)c1ccccn1 e55e2c0a657d5b5f258de98653eef85d [0,1,0,0,0,0|2,0,1]=4 3282 B12R1.30 C[C@H](OCC=O)c1ccccn1 ff146c9da6176c3232b99f0229582805 [0,1,0,0,0,0|2,0,1]=4 3283 B12R1.30 C[C@H](OCCF)c1ccccc1 c0748435be7f607898a504b3471e7402 [0,1,0,0,0,0|3,0,0]=4 3284 B12R1.30 C[C@H](OCCF)c1ccccn1 eb41a7ae9bfefe79c79492164ee8d675 [0,1,0,0,0,0|2,0,0]=3 3285 B12R1.30 C[C@H](OCCF)c1ccncn1 41fd55ea07d370e6966f60886b0a7ca4 [0,1,0,0,0,0|3,0,0]=4 3286 B12R1.30 C[C@H](OCCF)c1cnccn1 75324b1878e3d88bb1d858622d5b3fbf [0,1,0,0,0,0|3,0,0]=4 3287 B12R1.30 C[C@H](OCCF)c1ncccn1 2a62040bfa69982c61004e6817409ab7 [0,1,0,0,0,0|3,0,0]=4 3288 B12R1.30 C[C@H](OCCS)c1ccccc1 37922141bea6d1cffd84b12460e94096 [0,1,0,0,0,0|3,0,0]=4 3289 B12R1.30 C[C@H](OCCS)c1ccccn1 065ed8aaf45ef6ab5be60abd14e2bec7 [0,1,0,0,0,0|2,0,0]=3 3290 B12R1.30 C[C@H](OCCS)c1ccncn1 4d92aa61cb7b4cbe88aa4743c668ab95 [0,1,0,0,0,0|3,0,0]=4 3291 B12R1.30 C[C@H](OCCS)c1cnccn1 9ecaee9a8870d5f521ae5892988e5b0c [0,1,0,0,0,0|3,0,0]=4 3292 B12R1.30 C[C@H](OCCS)c1ncccn1 fa442c8d2d4854c2999f3b110eff2861 [0,1,0,0,0,0|3,0,0]=4 3293 B12R1.30 O=C(COCF)c1ccccn1 d721e2a9100a69c5669bc1ea4a691a11 [0,1,0,0,0,0|2,0,1]=4 3294 B12R1.30 O=C(NCCF)c1ccccn1 4a97f3ab618176ebd6ac2df3dad3b4cc [0,1,0,0,0,0|2,0,1]=4 3295 B12R1.30 O=C(NCCI)c1ccccn1 ac35a1f6684de8e8342f6b05eca2693e [0,1,0,0,0,0|2,0,1]=4 3296 B12R1.30 O=C(NCCO)c1ccccn1 a2021453263d08de31cb9c035df6984e [0,1,0,0,0,0|2,0,1]=4 3297 B12R1.30 O=C(NCCS)c1ccccn1 8988f54408f8c875b5e29488d2a313be [0,1,0,0,0,0|2,0,1]=4 3298 B12R1.30 O=CNCC(O)c1ccccn1 f74fbe719d6356bfc273d26f7795d584 [0,1,0,0,0,0|2,0,1]=4 3299 B12R1.30 OC(CNCF)c1ccccc1 dadff12dfa7b072497d1230db84a7ab0 [0,1,0,0,0,0|3,0,0]=4 3300 B12R1.30 OC(CNCF)c1ccccn1 28b23d2b21264b95b0a73626d3ab73c9 [0,1,0,0,0,0|2,0,0]=3 3301 B12R1.30 OCNCC(O)c1ccccc1 a1873e0f542e845030155bc61f7ab033 [0,1,0,0,0,0|3,0,0]=4 3302 B12R1.30 OCNCC(O)c1ccccn1 ec2dcb570a75423958acfe8c8ceb5bda [0,1,0,0,0,0|2,0,0]=3 3303 B12R1.30 OCNC[C@@H](O)c1ccccc1 6b625a35862ee45205a70adf222a9a23 [0,1,0,0,0,0|3,0,0]=4 3304 B12R1.30 OCNC[C@H](O)c1ccccc1 a19c64470da13d711a93a5da873610b8 [0,1,0,0,0,0|3,0,0]=4 3305 B12R1.30 O[C@@H](CNCF)c1ccccc1 17594babf953eee0d2b4c962daa025ce [0,1,0,0,0,0|3,0,0]=4 3306 B12R1.30 O[C@H](CNCF)c1ccccc1 1fae90a4e809b4254f08900139a841ce [0,1,0,0,0,0|3,0,0]=4 3307 B12R1.32 C#CCN(C)Cc1ccccn1 f145763fba53098f3e320f234a5cab86 [0,1,0,0,0,0|1,0,2]=4 3308 B12R1.32 C=CCN(C)Cc1ccccn1 44b06cd074db6bd74af193897540a655 [0,1,0,0,0,0|1,0,2]=4 3309 B12R1.32 CC(CC#N)Nc1ccccn1 c0975d61d9d4bf949e198e459316e5ac [0,1,0,0,0,0|2,0,1]=4 3310 B12R1.32 CC(CC#N)Oc1ccccn1 fe6032779d6cdf64ba95d6c8168ddd56 [0,1,0,0,0,0|2,0,1]=4 3311 B12R1.32 CC(CCO)Nc1ccccc1 9bf70c52b6fbdda0acbad0fbf8bda5d0 [0,1,0,0,0,0|3,0,0]=4 3312 B12R1.32 CC(CCO)Nc1cccnn1 ce8006e1e3ad3601ec2d3176ae8a0baa [0,1,0,0,0,0|3,0,0]=4 3313 B12R1.32 CC(CCO)Nc1ccncn1 55d7ca76b5ed044f06c0dd71d8dbf294 [0,1,0,0,0,0|3,0,0]=4 3314 B12R1.32 CC(CCO)Nc1cnccn1 fbe36d708c6f04f3ad9b566890739f82 [0,1,0,0,0,0|3,0,0]=4 3315 B12R1.32 CC(CCO)Nc1ncccn1 3094a827b9644842a2e3bc29e115d213 [0,1,0,0,0,0|3,0,0]=4 3316 B12R1.32 CC(Cc1ccccn1)NC=O a741ecaffa437be6e161ee51f0aaadec [0,1,0,0,0,0|2,0,1]=4 3317 B12R1.32 CC(Cc1ccccn1)NCF d5fdd6b98c347b6317b5d0d8cf3c28b6 [0,1,0,0,0,0|2,0,0]=3 3318 B12R1.32 CC(Cc1ccccn1)NCO eb641c414d0b15108bf9321647b7890c [0,1,0,0,0,0|2,0,0]=3 3319 B12R1.32 CC(Cc1ccccn1)OCF d6c424851ea201f763a1418247a6eb34 [0,1,0,0,0,0|2,0,0]=3 3320 B12R1.32 CC(Cc1cnccn1)NCF 162ba9574e5d80553a18bb0728d80865 [0,1,0,0,0,0|3,0,0]=4 3321 B12R1.32 CC(Cc1cnccn1)NCO f86cc27b8a2719a3865d7f92ea5b3f87 [0,1,0,0,0,0|3,0,0]=4 3322 B12R1.32 CC(Cc1cnccn1)OCF 19c4f4c9a50c77974aa8cdac147d1ec7 [0,1,0,0,0,0|3,0,0]=4 3323 B12R1.32 CCCC(=O)Nc1ccccn1 30e4202bb65eed068849d33fec5b876c [0,1,0,0,0,0|1,0,1]=3 3324 B12R1.32 CCCC(=O)Nc1cccnn1 8541b5403eebfa64b99d2e7720e62051 [0,1,0,0,0,0|2,0,1]=4 3325 B12R1.32 CCCC(=O)Nc1ccncn1 2a16a442f7fe13f94b5a68a37da318df [0,1,0,0,0,0|2,0,1]=4 3326 B12R1.32 CCCC(=O)Nc1cnccn1 13c8e9a41da05f49e09855d8ac2fe2c2 [0,1,0,0,0,0|2,0,1]=4 3327 B12R1.32 CCCC(C)Nc1ccccc1 0980d123cfa1556625b2cd315916fb5f [0,1,0,0,0,0|2,0,0]=3 3328 B12R1.32 CCCC(C)Nc1ccccn1 2669f8567b938ac2a918e85bd69bb770 [0,1,0,0,0,0|1,0,0]=2 3329 B12R1.32 CCCC(C)Nc1cccnc1 af2a7472e895c61981327f4b8de00ee9 [0,1,0,0,0,0|3,0,0]=4 3330 B12R1.32 CCCC(C)Nc1cccnn1 4a3b3a4f6b8f10fdeb3fd5d91ccf093d [0,1,0,0,0,0|2,0,0]=3 3331 B12R1.32 CCCC(C)Nc1ccncc1 bc7c26623f29f55d18fe6bfa5e660a5e [0,1,0,0,0,0|3,0,0]=4 3332 B12R1.32 CCCC(C)Nc1ccncn1 bf09bd647cc46ecda3ce4818cf198305 [0,1,0,0,0,0|2,0,0]=3 3333 B12R1.32 CCCC(C)Nc1cnccn1 5e0ac452f66c3352f66df0a830175170 [0,1,0,0,0,0|2,0,0]=3 3334 B12R1.32 CCCC(C)Nc1cnncn1 f5c65a6069a3e94b9d09bb2f558d3604 [0,1,0,0,0,0|3,0,0]=4 3335 B12R1.32 CCCC(C)Nc1ncccn1 f5359d73c3bdd7abf380648d4f2a798d [0,1,0,0,0,0|2,0,0]=3 3336 B12R1.32 CCCC(C)Nc1nccnn1 9841573052077f3d83a1a6f9bea72aa7 [0,1,0,0,0,0|3,0,0]=4 3337 B12R1.32 CCCC(C)Nc1ncncn1 a64c5db19dd4a9fc88088192a604a826 [0,1,0,0,0,0|3,0,0]=4 3338 B12R1.32 CCCC(C)Oc1ccccn1 f14a322e30e4491e36792a6fd64a30e7 [0,1,0,0,0,0|1,0,0]=2 3339 B12R1.32 CCCC(C)Oc1cccnc1 16283b7b4266224a92efdc8338a94776 [0,1,0,0,0,0|3,0,0]=4 3340 B12R1.32 CCCC(C)Oc1ccncc1 b9d7beb71b6c3dd797277820c00f9552 [0,1,0,0,0,0|3,0,0]=4 3341 B12R1.32 CCCC(C)Oc1cnccn1 1992d4e0d8a70e195f806a9236813dfa [0,1,0,0,0,0|2,0,0]=3 3342 B12R1.32 CCCC(C)Oc1cncnn1 553999684558bed819adcd5a002c7963 [0,1,0,0,0,0|3,0,0]=4 3343 B12R1.32 CCCC(C)Oc1ncccn1 d3295436c2eb03b3c01a07b1fcfb9cf9 [0,1,0,0,0,0|2,0,0]=3 3344 B12R1.32 CCCN(C)Cc1ccccc1 4eed5f3692a34dc05deac3e14f757f4f [0,1,0,0,0,0|2,0,0]=3 3345 B12R1.32 CCCN(C)Cc1ccccn1 2ba7f31870dc6781d668ec555cfac4b5 [0,1,0,0,0,0|1,0,0]=2 3346 B12R1.32 CCCN(C)Cc1cccnc1 60746a1075dd28e04eb10086fae0b820 [0,1,0,0,0,0|3,0,0]=4 3347 B12R1.32 CCCN(C)Cc1cccnn1 de5c0eb74cd9abbe9449532ba3643c60 [0,1,0,0,0,0|2,0,0]=3 3348 B12R1.32 CCCN(C)Cc1ccncc1 a69c5a082934587e8fadc56e06a02243 [0,1,0,0,0,0|3,0,0]=4 3349 B12R1.32 CCCN(C)Cc1ccncn1 78a7bf5a92439733e2b906d9c64899e7 [0,1,0,0,0,0|2,0,0]=3 3350 B12R1.32 CCCN(C)Cc1cnccn1 3b47eeecf77069f5bfd14dcb1d5a3e6b [0,1,0,0,0,0|2,0,0]=3 3351 B12R1.32 CCCN(C)Cc1ncccn1 91898f0226343ba16725efb2855aaaa9 [0,1,0,0,0,0|2,0,0]=3 3352 B12R1.32 CCC[C@H](C)Nc1ccccc1 14114dc7aca9a95d33818d8f8cfafa73 [0,1,0,0,0,0|2,0,0]=3 3353 B12R1.32 CCNC(C)Cc1ccccn1 3f739570fdaf944ffb41444c69149a83 [0,1,0,0,0,0|1,0,0]=2 3354 B12R1.32 CCNC(C)Cc1cccnc1 1c73ce06501092b14624237b8eaa830e [0,1,0,0,0,0|3,0,0]=4 3355 B12R1.32 CCNC(C)Cc1ccncc1 1ac39eab33f6c8633237d01993a17382 [0,1,0,0,0,0|3,0,0]=4 3356 B12R1.32 CCNC(C)Cc1cnccn1 bda15725b23b5e321786fab09c3daddb [0,1,0,0,0,0|2,0,0]=3 3357 B12R1.32 CCOC(C)Cc1ccccc1 37a2c2b5ef50b1a7cf2088b7456e4451 [0,1,0,0,0,0|2,0,0]=3 3358 B12R1.32 CCOC(C)Cc1ccccn1 144eae020541eabb52d7b3534ceef0a4 [0,1,0,0,0,0|1,0,0]=2 3359 B12R1.32 CCOC(C)Cc1cnccn1 3ecdf3d8e361b30d87e2f6f581391495 [0,1,0,0,0,0|2,0,0]=3 3360 B12R1.32 CCO[C@@H](C)Cc1ccccc1 19276107fa4d022850aeee4089dafd0c [0,1,0,0,0,0|2,0,0]=3 3361 B12R1.32 CCO[C@H](C)Cc1ccccc1 2f8e91d1dc9d2f9667dcff63e87e082c [0,1,0,0,0,0|2,0,0]=3 3362 B12R1.32 CN(CC#N)Cc1ccccn1 2b328196452f779fb0aa2a69f9df754d [0,1,0,0,0,0|2,0,1]=4 3363 B12R1.32 CN(CC=O)Cc1ccccn1 3cb19ec3f58df3186949ce7fc1c48ebf [0,1,0,0,0,0|2,0,1]=4 3364 B12R1.32 CN(CCF)Cc1ccccc1 c2bce3f6897fd6361961da43db186c6c [0,1,0,0,0,0|3,0,0]=4 3365 B12R1.32 CN(CCF)Cc1ccccn1 e5e3987aa096f716f04001ec62a0de3c [0,1,0,0,0,0|2,0,0]=3 3366 B12R1.32 CN(CCF)Cc1cccnn1 01cafd5e183c78f25edc0f5b45769d27 [0,1,0,0,0,0|3,0,0]=4 3367 B12R1.32 CN(CCF)Cc1ccncn1 9f53e88507cbab33797c49e88211f8c2 [0,1,0,0,0,0|3,0,0]=4 3368 B12R1.32 CN(CCF)Cc1cnccn1 fbfce4e42f774aa0592e2d34ac42fa5f [0,1,0,0,0,0|3,0,0]=4 3369 B12R1.32 CN(CCF)Cc1ncccn1 0a5e75118dcdd835fdbe14626f6f3cd4 [0,1,0,0,0,0|3,0,0]=4 3370 B12R1.32 CN(CCO)Cc1ccccc1 757bf36fdf4b02517da3241e86467be6 [0,1,0,0,0,0|3,0,0]=4 3371 B12R1.32 CN(CCO)Cc1ccccn1 e6506de41dc1aa2a0101e326b7b68e93 [0,1,0,0,0,0|2,0,0]=3 3372 B12R1.32 CN(CCO)Cc1cccnn1 7ec1319ca1cdee0b7fbbec8ca65b84b4 [0,1,0,0,0,0|3,0,0]=4 3373 B12R1.32 CN(CCO)Cc1ccncn1 442473b76f52d002f5db55edcca25e5b [0,1,0,0,0,0|3,0,0]=4 3374 B12R1.32 CN(CCO)Cc1cnccn1 975c82527d963422732ef53161de26e5 [0,1,0,0,0,0|3,0,0]=4 3375 B12R1.32 CN(CCO)Cc1ncccn1 8b6b166d4fd536e99dd0071a0c265abd [0,1,0,0,0,0|3,0,0]=4 3376 B12R1.32 CN(CCS)Cc1ccccc1 8e8f744accb260bbf35bc2715f513a4e [0,1,0,0,0,0|3,0,0]=4 3377 B12R1.32 CN(CCS)Cc1ccccn1 738efb58845b6d328d324778a901dac1 [0,1,0,0,0,0|2,0,0]=3 3378 B12R1.32 CN(CCS)Cc1cnccn1 71023342df27587d4aedac6471fae373 [0,1,0,0,0,0|3,0,0]=4 3379 B12R1.32 CN(CCS)Cc1ncccn1 32fbb77863d3629492d4e6a82b2b72b2 [0,1,0,0,0,0|3,0,0]=4 3380 B12R1.32 COCC(=O)Nc1ccccn1 f9e6fd9fc57ce0d213e8a8a98f19e960 [0,1,0,0,0,0|2,0,1]=4 3381 B12R1.32 COCC(C)Nc1ccccc1 918c3e9faef698920f78ca93350fda53 [0,1,0,0,0,0|3,0,0]=4 3382 B12R1.32 COCC(C)Nc1ccccn1 b87c4274a798014c5caa22801a140abd [0,1,0,0,0,0|2,0,0]=3 3383 B12R1.32 COCC(C)Nc1cccnn1 706a02eb6ddc599c7da65191d8bff4aa [0,1,0,0,0,0|3,0,0]=4 3384 B12R1.32 COCC(C)Nc1ccncn1 5f719d5ba83ffe96b94fa9664f636602 [0,1,0,0,0,0|3,0,0]=4 3385 B12R1.32 COCC(C)Nc1cnccn1 889b7cc55a844b93564b89b38cf0517e [0,1,0,0,0,0|3,0,0]=4 3386 B12R1.32 COCC(C)Nc1ncccn1 ed074a007ddb3aaecb983c3f1308f4eb [0,1,0,0,0,0|3,0,0]=4 3387 B12R1.32 COCC(C)Oc1ccccn1 668fa5e1f0515f975b72eaca09bba005 [0,1,0,0,0,0|2,0,0]=3 3388 B12R1.32 COCC(C)Oc1cnccn1 0c9552f56f369faf7edd37c2f274a26c [0,1,0,0,0,0|3,0,0]=4 3389 B12R1.32 COCC(C)Oc1ncccn1 ac382cecf32b2f838ef531f80c1fdd40 [0,1,0,0,0,0|3,0,0]=4 3390 B12R1.32 COCN(C)Cc1ccccc1 4d05c3d6ddf3ecec9a6b681c1068023b [0,1,0,0,0,0|3,0,0]=4 3391 B12R1.32 COCN(C)Cc1ccccn1 be6855095994cc4fb8e97c0a5352a8a9 [0,1,0,0,0,0|2,0,0]=3 3392 B12R1.32 COCN(C)Cc1cnccn1 b71aa0573c49daf69cc2f163b159c115 [0,1,0,0,0,0|3,0,0]=4 3393 B12R1.32 COCN(C)Cc1ncccn1 809c437b916af26b6a2bcc039099351b [0,1,0,0,0,0|3,0,0]=4 3394 B12R1.32 COC[C@@H](C)Nc1ccccc1 b6337fbd6f770477a80a235354ba550b [0,1,0,0,0,0|3,0,0]=4 3395 B12R1.32 COC[C@@H](C)Nc1cccnn1 ccee5bf26bb2372a5999a0b0af733626 [0,1,0,0,0,0|3,0,0]=4 3396 B12R1.32 COC[C@@H](C)Nc1ccncn1 e5a429e6965c597cb7c868a083c3ea07 [0,1,0,0,0,0|3,0,0]=4 3397 B12R1.32 COC[C@H](C)Nc1ccccc1 6b0bb5bdf147fc56918f57a798a463a2 [0,1,0,0,0,0|3,0,0]=4 3398 B12R1.32 COC[C@H](C)Nc1cccnn1 9fd5102cd92dfa039072b660fc3d61c4 [0,1,0,0,0,0|3,0,0]=4 3399 B12R1.32 COC[C@H](C)Nc1ccncn1 c8f27b99cc25e16a1494f4e3f4ad4898 [0,1,0,0,0,0|3,0,0]=4 3400 B12R1.32 CSCC(=O)Nc1ccccn1 2d7cc7e6303b185d13666b92f5dbb824 [0,1,0,0,0,0|2,0,1]=4 3401 B12R1.32 CSCN(C)Cc1ccccc1 d9791fc92d257d5436d9d59fe9a2c04e [0,1,0,0,0,0|3,0,0]=4 3402 B12R1.32 CSCN(C)Cc1ccccn1 800949e21971faefc87feb49b8f46bb4 [0,1,0,0,0,0|2,0,0]=3 3403 B12R1.32 CSCN(C)Cc1cnccn1 22c787cc661e446c84cc5d566a7816b6 [0,1,0,0,0,0|3,0,0]=4 3404 B12R1.32 CSCN(C)Cc1ncccn1 dc7a8709f445866cd59b4006be085050 [0,1,0,0,0,0|3,0,0]=4 3405 B12R1.32 C[C@@H](CCO)Nc1ccccc1 fc83b26b05d5bb1e6a4de978429a6aa3 [0,1,0,0,0,0|3,0,0]=4 3406 B12R1.32 C[C@H](CCO)Nc1ccccc1 83604672ebfdf7df8b733c8cb4f2aa8a [0,1,0,0,0,0|3,0,0]=4 3407 B12R1.32 O=C(CCF)Nc1ccccn1 ea4bc5548f168ed71070545911778e1d [0,1,0,0,0,0|2,0,1]=4 3408 B12R1.32 O=C(CCO)Nc1ccccn1 21dc9f5a4df84121109c1b09cc607124 [0,1,0,0,0,0|2,0,1]=4 3409 B12R1.32 O=C(CCS)Nc1ccccn1 e13765f0524ae0b0a39d40550d3f4621 [0,1,0,0,0,0|2,0,1]=4 3410 B12R1.252 C/C(=C/CNc1ccccn1)/I 437ee973631c41e00826fe572ef2e5c7 [0,1,0,0,0,0|1,0,2]=4 3411 B12R1.252 C/C(=C/COc1ccccn1)/I 31dad9b4a4a8f375519849e0f44f4f8c [0,1,0,0,0,0|1,0,2]=4 3412 B12R1.252 C/C(=C\CNc1ccccn1)/Cl 590fd3d80d668b7e3a995a436c682a4b [0,1,0,0,0,0|1,0,2]=4 3413 B12R1.252 C/C(=C\COc1ccccn1)/Cl 29080526a74108644cb2d8ec861a4a93 [0,1,0,0,0,0|1,0,2]=4 3414 B12R1.252 C=C(Br)CNCc1ccccn1 67d939c73d87b28f1bc54c010261b742 [0,1,0,0,0,0|1,0,2]=4 3415 B12R1.252 C=C(Br)COCc1ccccn1 428f0161770f0d2a43f3d33f9792d16c [0,1,0,0,0,0|1,0,2]=4 3416 B12R1.252 C=C(C)CCNc1ccccc1 6b5b9510ef6be8f5a83e582e3308e56d [0,1,0,0,0,0|2,0,1]=4 3417 B12R1.252 C=C(C)CCNc1ccccn1 5994b7e570337056fbe6b8ee68c83a74 [0,1,0,0,0,0|1,0,1]=3 3418 B12R1.252 C=C(C)CCNc1cccnn1 1142fc3815c0c0a4be5a2da159184e71 [0,1,0,0,0,0|2,0,1]=4 3419 B12R1.252 C=C(C)CCNc1ccncn1 b2df7db76a86ff0e4b4a36daf0213972 [0,1,0,0,0,0|2,0,1]=4 3420 B12R1.252 C=C(C)CCNc1cnccn1 488d6fc5224e139e798a82d78cec8ab1 [0,1,0,0,0,0|2,0,1]=4 3421 B12R1.252 C=C(C)CCNc1ncccn1 78d252700d872dbb97f912a5dea876c1 [0,1,0,0,0,0|2,0,1]=4 3422 B12R1.252 C=C(C)CCOc1ccccn1 b9dcf3d8853aa13bb161ef3e0a8cb2ac [0,1,0,0,0,0|1,0,1]=3 3423 B12R1.252 C=C(C)CCOc1cnccn1 df3bef4bcd441d1fbe12ccd26bb8814c [0,1,0,0,0,0|2,0,1]=4 3424 B12R1.252 C=C(C)CCOc1ncccn1 f229305dff7d817983e31b04d9ef381e [0,1,0,0,0,0|2,0,1]=4 3425 B12R1.252 C=C(C)CNCc1ccccc1 5d90204cfd05ab0918bdacf95677a05b [0,1,0,0,0,0|2,0,1]=4 3426 B12R1.252 C=C(C)CNCc1ccccn1 788a85ae04da57a30dfed7c4f6861e88 [0,1,0,0,0,0|1,0,1]=3 3427 B12R1.252 C=C(C)CNCc1cccnn1 87e0837390bda5f83e6a58db0f24ac15 [0,1,0,0,0,0|2,0,1]=4 3428 B12R1.252 C=C(C)CNCc1ccncn1 57a705fee15e48a8d6bf460af31ce16f [0,1,0,0,0,0|2,0,1]=4 3429 B12R1.252 C=C(C)CNCc1cnccn1 c16bee16c7973a4152d1802e4e514e6b [0,1,0,0,0,0|2,0,1]=4 3430 B12R1.252 C=C(C)CNCc1ncccn1 983db4ebe33fde2ee94a943919269fd5 [0,1,0,0,0,0|2,0,1]=4 3431 B12R1.252 C=C(C)COCc1ccccc1 f4499d14dd2f7bb4726f716f15e929df [0,1,0,0,0,0|2,0,1]=4 3432 B12R1.252 C=C(C)COCc1ccccn1 6969eb42119ffe7768529c61d80d21e6 [0,1,0,0,0,0|1,0,1]=3 3433 B12R1.252 C=C(C)COCc1cccnn1 66ea9a4a1f978fe2b65d3deaaed51360 [0,1,0,0,0,0|2,0,1]=4 3434 B12R1.252 C=C(C)COCc1ccncn1 6d6b42ed021f4ca2366a432131da633f [0,1,0,0,0,0|2,0,1]=4 3435 B12R1.252 C=C(C)COCc1cnccn1 ed2caf369fed63d27d762efb607396bb [0,1,0,0,0,0|2,0,1]=4 3436 B12R1.252 C=C(C)COCc1ncccn1 19fcc57160e78787c6b64c1c61e63bed [0,1,0,0,0,0|2,0,1]=4 3437 B12R1.252 C=C(Cl)CNCc1ccccn1 0008794fd4f1626c1c6b55d2800e023e [0,1,0,0,0,0|1,0,2]=4 3438 B12R1.252 C=C(Cl)COCc1ccccn1 3dfd3349d4541439b261df51a1894809 [0,1,0,0,0,0|1,0,2]=4 3439 B12R1.252 C=C(F)CNCc1ccccn1 009dbde4fc4473f6e0ceac91eab4c9c4 [0,1,0,0,0,0|1,0,2]=4 3440 B12R1.252 C=C(F)COCc1ccccn1 7136f4539075e070270508e4e96606e9 [0,1,0,0,0,0|1,0,2]=4 3441 B12R1.252 C=C(I)COCc1ccccn1 31587212105bb792b4c1deeb09b93dd1 [0,1,0,0,0,0|1,0,2]=4 3442 B12R1.252 CC(=CCNc1ccccn1)C 56e563f46b93659f933bfe2f6122c220 [0,1,0,0,0,0|1,0,2]=4 3443 B12R1.252 CC(=CCNc1ccccn1)Cl 5a2e1f77b2fbb7778ba6a16fff6fa4d5 [0,1,0,0,0,0|1,0,2]=4 3444 B12R1.252 CC(=CCNc1ccccn1)I 808c67d94f67dfaa182a81c605f3c89d [0,1,0,0,0,0|1,0,2]=4 3445 B12R1.252 CC(=CCOc1ccccn1)C 375413cc9583b62c463032d8fc2215ec [0,1,0,0,0,0|1,0,2]=4 3446 B12R1.252 CC(=CCOc1ccccn1)Cl 5defcd22d76b3c173f83b078fc1df9ea [0,1,0,0,0,0|1,0,2]=4 3447 B12R1.252 CC(=CCOc1ccccn1)I b4714aeb2d7e1a51722b709922c2cafb [0,1,0,0,0,0|1,0,2]=4 3448 B12R1.252 CC(=O)CCNc1ccccc1 9b0f0a0043bcfdd99ee44d3d72b922e5 [0,1,0,0,0,0|2,0,1]=4 3449 B12R1.252 CC(=O)CCNc1ccccn1 997919901794ee27201838f3f268a693 [0,1,0,0,0,0|1,0,1]=3 3450 B12R1.252 CC(=O)CCNc1cccnn1 32d799f5ae0f043ddfd98d242d6e2b83 [0,1,0,0,0,0|2,0,1]=4 3451 B12R1.252 CC(=O)CCNc1ccncn1 0028a4c9e1e1e7e2cab45e31e5dcdf1c [0,1,0,0,0,0|2,0,1]=4 3452 B12R1.252 CC(=O)CCNc1cnccn1 8194d0ad6d30ebb45605078893d0b86f [0,1,0,0,0,0|2,0,1]=4 3453 B12R1.252 CC(=O)CCNc1ncccn1 f9af544460838f47ce2dd0d8d6fb8e65 [0,1,0,0,0,0|2,0,1]=4 3454 B12R1.252 CC(=O)CCOc1ccccn1 f0d6b589e7af691479be38abbd6bcdf3 [0,1,0,0,0,0|1,0,1]=3 3455 B12R1.252 CC(=O)CCOc1cnccn1 470130b5fcbc6995e03cec6409a7e88f [0,1,0,0,0,0|2,0,1]=4 3456 B12R1.252 CC(=O)CCOc1ncccn1 cb317663dda387ed6c769a3c84b9ec4a [0,1,0,0,0,0|2,0,1]=4 3457 B12R1.252 CC(=O)CNCc1ccccc1 5e4599c3af112643425e1a35238a896f [0,1,0,0,0,0|2,0,1]=4 3458 B12R1.252 CC(=O)CNCc1ccccn1 6857f6976c347e411d9abdd48f8982fb [0,1,0,0,0,0|1,0,1]=3 3459 B12R1.252 CC(=O)CNCc1cccnn1 69a4573b28e6734fdd6ea189d6e37041 [0,1,0,0,0,0|2,0,1]=4 3460 B12R1.252 CC(=O)CNCc1ccncn1 9280fb5fc212f0e227894d5f435d42d3 [0,1,0,0,0,0|2,0,1]=4 3461 B12R1.252 CC(=O)CNCc1ncccn1 ebcbf993e63f54e2a531cc36cbf3d20b [0,1,0,0,0,0|2,0,1]=4 3462 B12R1.252 CC(=O)COCc1ccccc1 18daaa7c0d669a182de591929c861cbe [0,1,0,0,0,0|2,0,1]=4 3463 B12R1.252 CC(=O)COCc1ccccn1 f8ed3ffb815bee7f1737eacfe042d64f [0,1,0,0,0,0|1,0,1]=3 3464 B12R1.252 CC(=O)COCc1cccnn1 e5ce14b0f3485754a3b54e412cf985cc [0,1,0,0,0,0|2,0,1]=4 3465 B12R1.252 CC(=O)COCc1ccncn1 0d85e9f224c2952d6d7e3faef841c4cd [0,1,0,0,0,0|2,0,1]=4 3466 B12R1.252 CC(=O)COCc1ncccn1 b330e3f5176d6d50393a8f323d76eb16 [0,1,0,0,0,0|2,0,1]=4 3467 B12R1.252 CC(=O)NCCc1ccccc1 1052e9521fedb3e85cab4ef571c55982 [0,1,0,0,0,0|2,0,1]=4 3468 B12R1.252 CC(=O)NCCc1ccccn1 3ad8e2876430ef8ccd3cbeba8ed6119f [0,1,0,0,0,0|1,0,1]=3 3469 B12R1.252 CC(=O)NCCc1ccncn1 fab966eb0085b8e36cdf3d0657da7143 [0,1,0,0,0,0|2,0,1]=4 3470 B12R1.252 CC(=O)NCCc1cnccn1 1cf21aa316ea8133ba87ed31740cb5a0 [0,1,0,0,0,0|2,0,1]=4 3471 B12R1.252 CC(=O)NCCc1ncccn1 6cea7b81fd8f7f4399691623e3b09425 [0,1,0,0,0,0|2,0,1]=4 3472 B12R1.252 CC(=O)OCNc1ccccn1 a41f1b71ededa97eb4355e9af8654026 [0,1,0,0,0,0|2,0,1]=4 3473 B12R1.252 CC(=O)OCOc1ccccn1 86abcd8d807149e2e6ef73302de6ba90 [0,1,0,0,0,0|2,0,1]=4 3474 B12R1.252 CC(C)CCNc1ccccc1 a9665cd268e7b4518a4ee939be46ff28 [0,1,0,0,0,0|2,0,0]=3 3475 B12R1.252 CC(C)CCNc1ccccn1 5b6942b64e33834b458baec7cf378581 [0,1,0,0,0,0|1,0,0]=2 3476 B12R1.252 CC(C)CCNc1cccnc1 69f5877c25712220cf9d8582cf74056f [0,1,0,0,0,0|3,0,0]=4 3477 B12R1.252 CC(C)CCNc1cccnn1 49603a690558b49ae61b3e35c8c0d434 [0,1,0,0,0,0|2,0,0]=3 3478 B12R1.252 CC(C)CCNc1ccncc1 51f5e7e7cccdd7bf4f868dbc1d306bf9 [0,1,0,0,0,0|3,0,0]=4 3479 B12R1.252 CC(C)CCNc1ccncn1 ecd6f70845650d07dedc7bc6c4ecaf3e [0,1,0,0,0,0|2,0,0]=3 3480 B12R1.252 CC(C)CCNc1cnccn1 97e2470ed9c067d0275d682bf33fd1a4 [0,1,0,0,0,0|2,0,0]=3 3481 B12R1.252 CC(C)CCNc1cnncn1 443264a52a34d8b730661d2defb118ce [0,1,0,0,0,0|3,0,0]=4 3482 B12R1.252 CC(C)CCNc1ncccn1 fa06639a03be4eb7f54f05de582700f7 [0,1,0,0,0,0|2,0,0]=3 3483 B12R1.252 CC(C)CCNc1nccnn1 ab73286e31172121b9f2ab5596f94690 [0,1,0,0,0,0|3,0,0]=4 3484 B12R1.252 CC(C)CCNc1ncncn1 cbac2c92e2689ced7a377f32ce0d7708 [0,1,0,0,0,0|3,0,0]=4 3485 B12R1.252 CC(C)CCOc1ccccn1 7f883afab874ab8f83be331ad8cd7edb [0,1,0,0,0,0|1,0,0]=2 3486 B12R1.252 CC(C)CCOc1cccnc1 b89b58f2b508e626016a4b78466a2d25 [0,1,0,0,0,0|3,0,0]=4 3487 B12R1.252 CC(C)CCOc1ccncc1 d280f435e28fd77803bc44ac9ebf5e18 [0,1,0,0,0,0|3,0,0]=4 3488 B12R1.252 CC(C)CCOc1cnccn1 73ba6622223f14158ed8b6786344556e [0,1,0,0,0,0|2,0,0]=3 3489 B12R1.252 CC(C)CCOc1cncnn1 dee774261a720478b4cf30e5783e4173 [0,1,0,0,0,0|3,0,0]=4 3490 B12R1.252 CC(C)CCOc1ncccn1 d292c3b5e983ca259d629766547f8fee [0,1,0,0,0,0|2,0,0]=3 3491 B12R1.252 CC(C)CNCc1ccccc1 c48ab8ad76cb980676fd518bfed01255 [0,1,0,0,0,0|2,0,0]=3 3492 B12R1.252 CC(C)CNCc1ccccn1 6d7ebb6c45d12163344e2670abad50d7 [0,1,0,0,0,0|1,0,0]=2 3493 B12R1.252 CC(C)CNCc1cccnc1 317cc81cae733d174c088ce8c918791e [0,1,0,0,0,0|3,0,0]=4 3494 B12R1.252 CC(C)CNCc1cccnn1 84be549ae7f23e584a9cd16132c3740f [0,1,0,0,0,0|2,0,0]=3 3495 B12R1.252 CC(C)CNCc1ccncc1 e68ace07204ad5f64fa8daf124fe226c [0,1,0,0,0,0|3,0,0]=4 3496 B12R1.252 CC(C)CNCc1ccncn1 7c1867cd40dfe052b1c70621dd586356 [0,1,0,0,0,0|2,0,0]=3 3497 B12R1.252 CC(C)CNCc1cnccn1 0929626c3926e9b5408d0567fa20c060 [0,1,0,0,0,0|2,0,0]=3 3498 B12R1.252 CC(C)CNCc1ncccn1 056b2d50b9d93d6eca9e998d6d806e1a [0,1,0,0,0,0|2,0,0]=3 3499 B12R1.252 CC(C)COCc1ccccc1 5769ac6c29ea9be863f0068a3148d1e9 [0,1,0,0,0,0|2,0,0]=3 3500 B12R1.252 CC(C)COCc1ccccn1 41f471be8d0443a395a59a6edd4b2170 [0,1,0,0,0,0|1,0,0]=2 3501 B12R1.252 CC(C)COCc1cccnc1 e949ee90c476dd3afee631c02891b751 [0,1,0,0,0,0|3,0,0]=4 3502 B12R1.252 CC(C)COCc1cccnn1 bcec46c8daa86302f285ba1f41a4db4d [0,1,0,0,0,0|2,0,0]=3 3503 B12R1.252 CC(C)COCc1ccncc1 243716518cbf836169ff83c6e87d1a68 [0,1,0,0,0,0|3,0,0]=4 3504 B12R1.252 CC(C)COCc1ccncn1 504e9144090fa54e034f83efb4a8bc6c [0,1,0,0,0,0|2,0,0]=3 3505 B12R1.252 CC(C)COCc1cnccn1 54d1f572f89be35af98ac5c6d0a00bd4 [0,1,0,0,0,0|2,0,0]=3 3506 B12R1.252 CC(C)COCc1ncccn1 33688b887bd33e4027684b65bbdc620c [0,1,0,0,0,0|2,0,0]=3 3507 B12R1.252 CC(C)NCCc1ccccc1 800f62166be48d31d0f1f8e8246a3d11 [0,1,0,0,0,0|2,0,0]=3 3508 B12R1.252 CC(C)NCCc1ccccn1 60db3ccccaed87369474311fbbb2ee61 [0,1,0,0,0,0|1,0,0]=2 3509 B12R1.252 CC(C)NCCc1cccnc1 f39609cf740b878733069b3389a379d4 [0,1,0,0,0,0|3,0,0]=4 3510 B12R1.252 CC(C)NCCc1ccncc1 2e03fedf55e71e95c0abd0f4865dc22e [0,1,0,0,0,0|3,0,0]=4 3511 B12R1.252 CC(C)NCCc1ccncn1 f7502abf563207bb5d53cb2d326dbabf [0,1,0,0,0,0|2,0,0]=3 3512 B12R1.252 CC(C)NCCc1cnccn1 35c3b70c1897dffd7b3a32c2343123fc [0,1,0,0,0,0|2,0,0]=3 3513 B12R1.252 CC(C)NCCc1ncccn1 794cc03a494745a4fc8f3acdee35c851 [0,1,0,0,0,0|2,0,0]=3 3514 B12R1.252 CC(C)OCCc1ccccc1 cd2036e50db53ec52d80c5b70290b19c [0,1,0,0,0,0|2,0,0]=3 3515 B12R1.252 CC(C)OCCc1ccccn1 618810b4708a73ec52035c34c4054b87 [0,1,0,0,0,0|1,0,0]=2 3516 B12R1.252 CC(C)OCCc1cccnc1 ad83d4217e0420d4f686447a978fc953 [0,1,0,0,0,0|3,0,0]=4 3517 B12R1.252 CC(C)OCCc1ccncc1 07cefd4f30952a7fff1efa12f3f8cb0e [0,1,0,0,0,0|3,0,0]=4 3518 B12R1.252 CC(C)OCCc1ccncn1 f1ce6c97a497c9e91937eebb9f30c7a6 [0,1,0,0,0,0|2,0,0]=3 3519 B12R1.252 CC(C)OCCc1cnccn1 ae26b65e22ea6fcf5c22fdff048110ff [0,1,0,0,0,0|2,0,0]=3 3520 B12R1.252 CC(C)OCCc1ncccn1 c1c5cf56502b5e60b3dba4a7a219c587 [0,1,0,0,0,0|2,0,0]=3 3521 B12R1.252 CC(C)OCNc1ccccc1 4ab9f406843d3d3dea8c678f7ec5fd29 [0,1,0,0,0,0|3,0,0]=4 3522 B12R1.252 CC(C)OCNc1ccccn1 f79533e956cd51a6f0cee4ac927e1136 [0,1,0,0,0,0|2,0,0]=3 3523 B12R1.252 CC(C)OCNc1cccnn1 4233edd1b8acbdda6e2ed07ac97c4f18 [0,1,0,0,0,0|3,0,0]=4 3524 B12R1.252 CC(C)OCNc1ccncn1 1fabcbbfa80bb30d20791ae9f3c3ce8d [0,1,0,0,0,0|3,0,0]=4 3525 B12R1.252 CC(C)OCNc1cnccn1 1ae9e037a0f2b87cad7a04a6488d98a1 [0,1,0,0,0,0|3,0,0]=4 3526 B12R1.252 CC(C)OCNc1ncccn1 0c1046b7f6674f6f89d655b1c355fded [0,1,0,0,0,0|3,0,0]=4 3527 B12R1.252 CC(C)OCOc1ccccn1 1f60fa9657a31d54ae86707f451d8353 [0,1,0,0,0,0|2,0,0]=3 3528 B12R1.252 CC(C)OCOc1cnccn1 8b455fe88e72e81fb797f6202bd7e240 [0,1,0,0,0,0|3,0,0]=4 3529 B12R1.252 CC(C)OCOc1ncccn1 54d4d12d600bf11bfd6c053363cfc867 [0,1,0,0,0,0|3,0,0]=4 3530 B12R1.252 CC(F)COCc1ccccc1 ceaaa348669e5aa8cbad2a4c64558f8e [0,1,0,0,0,0|2,0,0]=3 3531 B12R1.252 CC(F)COCc1ccccn1 476695497df80cb7c084184b5b43d035 [0,1,0,0,0,0|1,0,0]=2 3532 B12R1.252 CC(F)COCc1cccnc1 c074e95bfd5d6d05bfe23c42186cba2a [0,1,0,0,0,0|3,0,0]=4 3533 B12R1.252 CC(F)COCc1cccnn1 a8676d0003d9a388121c44b40728d121 [0,1,0,0,0,0|2,0,0]=3 3534 B12R1.252 CC(F)COCc1ccncn1 e66fcc367d7980f6bc6aae01f6a3dcca [0,1,0,0,0,0|2,0,0]=3 3535 B12R1.252 CC(F)COCc1ncccn1 b164a01eba2e6ffed2b68a89c16a263d [0,1,0,0,0,0|2,0,0]=3 3536 B12R1.252 CC(O)CCNc1ccccc1 5c6c9358fbd8939fc6c9f54dcb2d3a37 [0,1,0,0,0,0|2,0,0]=3 3537 B12R1.252 CC(O)CCNc1ccccn1 97031b4d64979d289ef04acc206d003e [0,1,0,0,0,0|1,0,0]=2 3538 B12R1.252 CC(O)CCNc1cccnc1 ddabe466465a030ebf6055c0cc168740 [0,1,0,0,0,0|3,0,0]=4 3539 B12R1.252 CC(O)CCNc1cccnn1 47b97190e8ab1842f9cd5e0dee7ed3e8 [0,1,0,0,0,0|2,0,0]=3 3540 B12R1.252 CC(O)CCNc1ccncc1 c1ccc95455595767ca368700397c2d43 [0,1,0,0,0,0|3,0,0]=4 3541 B12R1.252 CC(O)CCNc1ccncn1 ebd00d7ab06f73cce67a72b6f0de4119 [0,1,0,0,0,0|2,0,0]=3 3542 B12R1.252 CC(O)CCNc1cnccn1 6eb47df63aaf1411aa20597fd2d69a7f [0,1,0,0,0,0|2,0,0]=3 3543 B12R1.252 CC(O)CCNc1cnncn1 b26836ffce9cf584c150cee5df66e839 [0,1,0,0,0,0|3,0,0]=4 3544 B12R1.252 CC(O)CCNc1ncccn1 225479af487259f3587dee9eb87e8f0e [0,1,0,0,0,0|2,0,0]=3 3545 B12R1.252 CC(O)CCNc1nccnn1 0df909486d4b1b02ba70babde138c59a [0,1,0,0,0,0|3,0,0]=4 3546 B12R1.252 CC(O)CCNc1ncncn1 becc022bb4dfc4bd1f2087cdb263cc29 [0,1,0,0,0,0|3,0,0]=4 3547 B12R1.252 CC(O)CNCc1ccccc1 19d19f96fb686d7cbd72f5df359e9dd8 [0,1,0,0,0,0|2,0,0]=3 3548 B12R1.252 CC(O)CNCc1ccccn1 e28c29c938e18ad1238cd975f89a06a8 [0,1,0,0,0,0|1,0,0]=2 3549 B12R1.252 CC(O)CNCc1cccnc1 0379a455e7b583f17fba58d3189059b6 [0,1,0,0,0,0|3,0,0]=4 3550 B12R1.252 CC(O)CNCc1cccnn1 ca0f502bcc801933ee5c767e5093148e [0,1,0,0,0,0|2,0,0]=3 3551 B12R1.252 CC(O)CNCc1ccncc1 e21fcdc654ebe2a7b579b387cc55b8af [0,1,0,0,0,0|3,0,0]=4 3552 B12R1.252 CC(O)CNCc1ccncn1 7a5d78fb681ded42d2d147fe1c55e164 [0,1,0,0,0,0|2,0,0]=3 3553 B12R1.252 CC(O)CNCc1cnccn1 c8835bddb9845c918606787997b443d4 [0,1,0,0,0,0|2,0,0]=3 3554 B12R1.252 CC(O)CNCc1ncccn1 94e03f4ed43c28d3bc90554d2a7d489e [0,1,0,0,0,0|2,0,0]=3 3555 B12R1.252 CC(S)COCc1ccccc1 a2dbb8c27ced04cd31e27a2a08aed095 [0,1,0,0,0,0|2,0,0]=3 3556 B12R1.252 CC(S)COCc1ccccn1 a4f3c7b4dcc63c52aaa45bb366b1ace4 [0,1,0,0,0,0|1,0,0]=2 3557 B12R1.252 CC(S)COCc1cccnc1 355ce467de5bbf28efe4538348b90e14 [0,1,0,0,0,0|3,0,0]=4 3558 B12R1.252 CC(S)COCc1cccnn1 d2ecb2d0e631a99f442e857229dbdd98 [0,1,0,0,0,0|2,0,0]=3 3559 B12R1.252 CC(S)COCc1ccncn1 950c30d73f3928e6c48b7ade8fe9fd37 [0,1,0,0,0,0|2,0,0]=3 3560 B12R1.252 CC(S)COCc1ncccn1 f43e202e339061758ab99ff5a34648cc [0,1,0,0,0,0|2,0,0]=3 3561 B12R1.252 CN(C)CCNc1ccccc1 d3b2e620d30900fb427915c44cfde5dc [0,1,0,0,0,0|3,0,0]=4 3562 B12R1.252 CN(C)CCNc1ccccn1 3770115323c648ae32f4fd74bb45de81 [0,1,0,0,0,0|2,0,0]=3 3563 B12R1.252 CN(C)CCNc1cccnn1 f51377c01c96fdc88384854f00f73356 [0,1,0,0,0,0|3,0,0]=4 3564 B12R1.252 CN(C)CCNc1ccncn1 2cd4d55888d8939bc08798c6d2948753 [0,1,0,0,0,0|3,0,0]=4 3565 B12R1.252 CN(C)CCNc1cnccn1 99b5e064c6c4102ef678e43c645d6e69 [0,1,0,0,0,0|3,0,0]=4 3566 B12R1.252 CN(C)CCNc1ncccn1 e3fe9f2518c45b2b62ecc9487a8fd94e [0,1,0,0,0,0|3,0,0]=4 3567 B12R1.252 CN(C)CCOc1ccccn1 97e00588b90af414fe2d070a8bfe7282 [0,1,0,0,0,0|2,0,0]=3 3568 B12R1.252 CN(C)CCOc1cnccn1 be4a48ac312e1b2ba1ac35f772f0f9b6 [0,1,0,0,0,0|3,0,0]=4 3569 B12R1.252 CN(C)CCOc1ncccn1 34eb8e7b8b85574aadca6c16e5735743 [0,1,0,0,0,0|3,0,0]=4 3570 B12R1.252 CN(C)CNCc1ccccc1 0202e986c8da8d9c48034425b18c3dfe [0,1,0,0,0,0|3,0,0]=4 3571 B12R1.252 CN(C)CNCc1ccccn1 3e94ae66f4eb87252a917a8d226960eb [0,1,0,0,0,0|2,0,0]=3 3572 B12R1.252 CN(C)CNCc1cccnn1 edb85eed85dffb6aff21e0071b036dad [0,1,0,0,0,0|3,0,0]=4 3573 B12R1.252 CN(C)CNCc1ccncn1 9cbfae7e21c8e5ae4be1bdaf6d3e5fc5 [0,1,0,0,0,0|3,0,0]=4 3574 B12R1.252 CN(C)CNCc1cnccn1 303398dd218f1390f1eac5b97feabe25 [0,1,0,0,0,0|3,0,0]=4 3575 B12R1.252 CN(C)CNCc1ncccn1 fdfb181a4e6f4f1b9fe86f84f07b4b69 [0,1,0,0,0,0|3,0,0]=4 3576 B12R1.252 CN(C)COCc1ccccc1 a063060d7f5ce478c07330412cbf8447 [0,1,0,0,0,0|3,0,0]=4 3577 B12R1.252 CN(C)COCc1ccccn1 3a10a8f32d4655fe62f905c50c31c2d8 [0,1,0,0,0,0|2,0,0]=3 3578 B12R1.252 CN(C)COCc1cccnn1 ac01354b378cf6d9281d0c823aad81fa [0,1,0,0,0,0|3,0,0]=4 3579 B12R1.252 CN(C)COCc1ccncn1 9446e89009038eaf9cd705f7ab1acfe9 [0,1,0,0,0,0|3,0,0]=4 3580 B12R1.252 CN(C)COCc1cnccn1 9470c70b6acb2c5f48e9d9b28b3f08b2 [0,1,0,0,0,0|3,0,0]=4 3581 B12R1.252 CN(C)COCc1ncccn1 c0cf83d068e46c7499100bd0e82240bf [0,1,0,0,0,0|3,0,0]=4 3582 B12R1.252 CS(=O)CCNc1ccccc1 5cc8a55dee9bbafc2b2ae46532475526 [0,1,0,0,0,0|3,0,0]=4 3583 B12R1.252 CS(=O)CCNc1ccccn1 32809cdd694b5d2997184adf79ab8936 [0,1,0,0,0,0|2,0,0]=3 3584 B12R1.252 CS(=O)CCNc1cccnn1 18b0379c659a45e62ddb76dad648babc [0,1,0,0,0,0|3,0,0]=4 3585 B12R1.252 CS(=O)CCNc1ccncn1 36f2b35f2170e71dc8df795020aabc2c [0,1,0,0,0,0|3,0,0]=4 3586 B12R1.252 CS(=O)CCNc1cnccn1 613d5da26611fc04bc995ce59b4bcc6a [0,1,0,0,0,0|3,0,0]=4 3587 B12R1.252 CS(=O)CCNc1ncccn1 9828039aad915f875c79e084f9873f3d [0,1,0,0,0,0|3,0,0]=4 3588 B12R1.252 CS(=O)CCOc1ccccn1 30133f9bf19ef8b3fdfb27b7644f2fa7 [0,1,0,0,0,0|2,0,0]=3 3589 B12R1.252 CS(=O)CCOc1cnccn1 7850768cab756e1072ea30c0dec7b6f0 [0,1,0,0,0,0|3,0,0]=4 3590 B12R1.252 CS(=O)CCOc1ncccn1 ce7a3962c7b784e80292b76737060a3d [0,1,0,0,0,0|3,0,0]=4 3591 B12R1.252 C[C@@H](F)COCc1ccccc1 ba1a50f79e3a1a52d90fe2949f8a3658 [0,1,0,0,0,0|2,0,0]=3 3592 B12R1.252 C[C@@H](F)COCc1ccccn1 25305c43f86a522a8b001eca7d58c6e1 [0,1,0,0,0,0|1,0,0]=2 3593 B12R1.252 C[C@@H](F)COCc1cccnc1 aed0ead164612a30bbdf73120135ebce [0,1,0,0,0,0|3,0,0]=4 3594 B12R1.252 C[C@@H](F)COCc1cccnn1 06cb4b03e5d2138a02ec68b491d736db [0,1,0,0,0,0|2,0,0]=3 3595 B12R1.252 C[C@@H](F)COCc1ccncn1 719b49a72c09f7d762d98352aa2ee153 [0,1,0,0,0,0|2,0,0]=3 3596 B12R1.252 C[C@@H](F)COCc1ncccn1 0be2c0fc83116bf68d16d48e2175abbd [0,1,0,0,0,0|2,0,0]=3 3597 B12R1.252 C[C@@H](O)CCNc1ccccc1 3c324f6ae4acc93f637fccf82ee7ce0d [0,1,0,0,0,0|2,0,0]=3 3598 B12R1.252 C[C@@H](O)CCNc1cccnc1 d2f9effd7c499379710e94d2300db828 [0,1,0,0,0,0|3,0,0]=4 3599 B12R1.252 C[C@@H](O)CCNc1cccnn1 cf73112336214ad7cbf0dc1846b2b8b5 [0,1,0,0,0,0|2,0,0]=3 3600 B12R1.252 C[C@@H](O)CCNc1ccncc1 1357dd9581462a38875d3aa4d1c252b3 [0,1,0,0,0,0|3,0,0]=4 3601 B12R1.252 C[C@@H](O)CCNc1ccncn1 e9c337d98b4124b083ec155c782d5afc [0,1,0,0,0,0|2,0,0]=3 3602 B12R1.252 C[C@@H](O)CCNc1cnccn1 d98d70b012f52698df30b7825b3d3f44 [0,1,0,0,0,0|2,0,0]=3 3603 B12R1.252 C[C@@H](O)CNCc1ccccc1 6c2312c00225852faacfd748f3e179a9 [0,1,0,0,0,0|2,0,0]=3 3604 B12R1.252 C[C@@H](O)CNCc1ccccn1 451f5ffb0f29e3e72e062344afb5a2f0 [0,1,0,0,0,0|1,0,0]=2 3605 B12R1.252 C[C@@H](O)CNCc1cccnc1 b84ffcc76f02e485a00f4000a256d608 [0,1,0,0,0,0|3,0,0]=4 3606 B12R1.252 C[C@@H](O)CNCc1cccnn1 cd1031e294d6f0d361dd47fa33d49ff3 [0,1,0,0,0,0|2,0,0]=3 3607 B12R1.252 C[C@@H](O)CNCc1ccncc1 ae74cf20bb99ef533f01677aac980ef0 [0,1,0,0,0,0|3,0,0]=4 3608 B12R1.252 C[C@@H](O)CNCc1ccncn1 736b6f19c1f730535787b4bd97f49fab [0,1,0,0,0,0|2,0,0]=3 3609 B12R1.252 C[C@@H](O)CNCc1cnccn1 eef2e176f843886c7abc553819e37052 [0,1,0,0,0,0|2,0,0]=3 3610 B12R1.252 C[C@@H](O)CNCc1ncccn1 0624e3b4e312bb88305cee2546fdfafe [0,1,0,0,0,0|2,0,0]=3 3611 B12R1.252 C[C@H](F)COCc1ccccc1 bbc793e84de595855390c7dc0e162e4e [0,1,0,0,0,0|2,0,0]=3 3612 B12R1.252 C[C@H](F)COCc1ccccn1 1c3e68e8b7d209c95b5abd8e99134585 [0,1,0,0,0,0|1,0,0]=2 3613 B12R1.252 C[C@H](F)COCc1cccnc1 0c09d4ffa6c243373fe47064ad603e31 [0,1,0,0,0,0|3,0,0]=4 3614 B12R1.252 C[C@H](F)COCc1cccnn1 2be52db7760fdc7844e251123071f59c [0,1,0,0,0,0|2,0,0]=3 3615 B12R1.252 C[C@H](F)COCc1ccncn1 7bca4df3c29ccb83ca7218b56534d104 [0,1,0,0,0,0|2,0,0]=3 3616 B12R1.252 C[C@H](F)COCc1ncccn1 7af5a27af441f4087010aeedfc65f0ba [0,1,0,0,0,0|2,0,0]=3 3617 B12R1.252 C[C@H](O)CCNc1ccccc1 6e2f4bd6880dfbdf2c0288d2956dbdc6 [0,1,0,0,0,0|2,0,0]=3 3618 B12R1.252 C[C@H](O)CCNc1cccnc1 a74a77e227ccf23689573201eeb443f8 [0,1,0,0,0,0|3,0,0]=4 3619 B12R1.252 C[C@H](O)CCNc1cccnn1 c62b16aa58dfc3c8ac3d7053343062a4 [0,1,0,0,0,0|2,0,0]=3 3620 B12R1.252 C[C@H](O)CCNc1ccncc1 b387b9f25ac0f7430597235bfa1a1caf [0,1,0,0,0,0|3,0,0]=4 3621 B12R1.252 C[C@H](O)CCNc1ccncn1 4320134883fca98ee018037af11033ea [0,1,0,0,0,0|2,0,0]=3 3622 B12R1.252 C[C@H](O)CCNc1cnccn1 5d34a9c581c97e3e5cec72109f7ba47d [0,1,0,0,0,0|2,0,0]=3 3623 B12R1.252 C[C@H](O)CNCc1ccccc1 300dc860ca45284f1e63efe30c8515f8 [0,1,0,0,0,0|2,0,0]=3 3624 B12R1.252 C[C@H](O)CNCc1ccccn1 b271f5c0c0f30c343eeedababca7e2eb [0,1,0,0,0,0|1,0,0]=2 3625 B12R1.252 C[C@H](O)CNCc1cccnc1 4f2f0e9e68ec9a4c8887410d5a461943 [0,1,0,0,0,0|3,0,0]=4 3626 B12R1.252 C[C@H](O)CNCc1cccnn1 30faf4d5d2d2cfc53436874f05fa4323 [0,1,0,0,0,0|2,0,0]=3 3627 B12R1.252 C[C@H](O)CNCc1ccncc1 efb723b5ed38065d1ff8f191a8967ccc [0,1,0,0,0,0|3,0,0]=4 3628 B12R1.252 C[C@H](O)CNCc1ccncn1 f524766be8fbe3d3ed19bfa5c9a61a28 [0,1,0,0,0,0|2,0,0]=3 3629 B12R1.252 C[C@H](O)CNCc1cnccn1 3fe1c33c64283497dd89455f2ff7b9fd [0,1,0,0,0,0|2,0,0]=3 3630 B12R1.252 C[C@H](O)CNCc1ncccn1 76fcffd630239efd786e389061949a13 [0,1,0,0,0,0|2,0,0]=3 3631 B12R1.252 FC(F)CCNc1ccccc1 197e931474a81ea0a384c18be7d88578 [0,1,0,0,0,0|3,0,0]=4 3632 B12R1.252 FC(F)CCNc1ccccn1 cc81dcc876994e19229f366729c14f42 [0,1,0,0,0,0|2,0,0]=3 3633 B12R1.252 FC(F)CCNc1cccnn1 fb3066c06500fd69be9ab14d02af4548 [0,1,0,0,0,0|3,0,0]=4 3634 B12R1.252 FC(F)CCNc1ccncn1 7248a6ad111d937c2203856b460c430e [0,1,0,0,0,0|3,0,0]=4 3635 B12R1.252 FC(F)CNCc1ccccc1 b372a4b49b84fd81f05ebb43fbf5746e [0,1,0,0,0,0|3,0,0]=4 3636 B12R1.252 FC(F)CNCc1ccccn1 77bd5b4958e554940a2488a652c3c227 [0,1,0,0,0,0|2,0,0]=3 3637 B12R1.252 FC(F)CNCc1cccnn1 3199c1c84828a3cb83acfb1e62b7c06d [0,1,0,0,0,0|3,0,0]=4 3638 B12R1.252 FC(F)CNCc1ccncn1 99b861be4184450306efda93b6e89d13 [0,1,0,0,0,0|3,0,0]=4 3639 B12R1.252 FC(F)CNCc1cnccn1 96f07ef1ebf09d794e24044beb43a38a [0,1,0,0,0,0|3,0,0]=4 3640 B12R1.252 FC(F)CNCc1ncccn1 ed915b21844ff2721b588f2a17ccba58 [0,1,0,0,0,0|3,0,0]=4 3641 B12R1.252 FC(F)COCc1ccccc1 2df81e9a81e7d6e6e6f5c475fa361af0 [0,1,0,0,0,0|3,0,0]=4 3642 B12R1.252 FC(F)COCc1ccccn1 0c03e4bfe601ba3a265a9d65726e12d8 [0,1,0,0,0,0|2,0,0]=3 3643 B12R1.252 FC(F)COCc1cccnn1 ed23f04cc5c7d2c58d331f4704d391e5 [0,1,0,0,0,0|3,0,0]=4 3644 B12R1.252 FC(F)COCc1ccncn1 a287813f9e7aa9e1be94d7ded843715a [0,1,0,0,0,0|3,0,0]=4 3645 B12R1.252 FC(F)COCc1cnccn1 e670c2b33bf03d7917ee96f0cfc225d2 [0,1,0,0,0,0|3,0,0]=4 3646 B12R1.252 FC(F)COCc1ncccn1 0b2d07a0575fc28ea0024e9c0143909a [0,1,0,0,0,0|3,0,0]=4 3647 B12R1.252 NC(=O)CCNc1ccccn1 92e4f83573998c2485b8b03f9bb014d7 [0,1,0,0,0,0|2,0,1]=4 3648 B12R1.252 NC(=O)CCOc1ccccn1 ef33f2f40c5695caaa5c50c5e9999f80 [0,1,0,0,0,0|2,0,1]=4 3649 B12R1.252 NC(=O)CNCc1ccccn1 3c1dd420ad69284782fb8583eb56bf60 [0,1,0,0,0,0|2,0,1]=4 3650 B12R1.252 NC(=O)COCc1ccccn1 0d9c0bff99698d95c8b9e9a6d8922eb4 [0,1,0,0,0,0|2,0,1]=4 3651 B12R1.252 NC(=S)CCNc1ccccn1 68fabb9eaf273ac76dacacf1e71feb29 [0,1,0,0,0,0|2,0,1]=4 3652 B12R1.252 NC(=S)COCc1ccccn1 a55f82ed7d973bd9ddc737d4cda83e7b [0,1,0,0,0,0|2,0,1]=4 3653 B12R1.252 O=C(O)CCNc1ccccn1 0537ea6c1dceaf8751238bf02ee3d095 [0,1,0,0,0,0|2,0,1]=4 3654 B12R1.252 O=C(O)CNCc1ccccn1 3c84db281076170db068c06ad4fa1558 [0,1,0,0,0,0|2,0,1]=4 3655 B12R1.252 O=C(O)COCc1ccccn1 23d47dd96051fd1e4e6f2b6ade2c5861 [0,1,0,0,0,0|2,0,1]=4 3656 B12R1.252 O=S(O)CCNc1ccccn1 52912e49a54a8727cdb7fa7cdbaa0329 [0,1,0,0,0,0|3,0,0]=4 3657 B12R1.252 O=S(O)COCc1ccccn1 82f7ef930a26c74110028b3fbc96ff09 [0,1,0,0,0,0|3,0,0]=4 3658 B12R1.252 O=[N+]([O-])CNCc1ccccn1 bf01542fc4ca5dd5051476ac6e6f9fff [0,1,0,0,0,0|3,0,0]=4 3659 B12R1.252 O=[N+]([O-])COCc1ccccn1 9d4a10c31b13c2e55de62850b0633e4b [0,1,0,0,0,0|3,0,0]=4 3660 B12R1.267 BrCCNCc1ccccc1Br ea0d11cb5c5c05c8b45872fc9f05fc12 [0,1,0,0,0,0|3,0,0]=4 3661 B12R1.267 BrCCNCc1ccccc1I 3038a426aa86f4dfd543210d91b43629 [0,1,0,0,0,0|3,0,0]=4 3662 B12R1.267 BrCCNCc1ncccc1Br 2aa287d5a3ff1b284ad68a258fbfc35d [0,1,0,0,0,0|2,0,0]=3 3663 B12R1.267 Brc1ccccc1CNCCI 5143974bbc0a4a35871e2c83139b8e6b [0,1,0,0,0,0|3,0,0]=4 3664 B12R1.267 Brc1cccnc1CNCCI b600d9ff5c5488ed2c88f9a90f7473d7 [0,1,0,0,0,0|2,0,0]=3 3665 B12R1.267 C#CCCNc1ncccc1Br b2d52a010ef848ae671b7e2b95ffc45a [0,1,0,0,0,0|1,0,2]=4 3666 B12R1.267 C#CCCNc1ncccc1C 196f3bb738d188f3592bb1344817428b [0,1,0,0,0,0|1,0,2]=4 3667 B12R1.267 C#CCCNc1ncccc1Cl 1973772c96739e2d59b8a2db19b04e6d [0,1,0,0,0,0|1,0,2]=4 3668 B12R1.267 C#CCCNc1ncccc1F e1b753ae754af3ea224c00841958de25 [0,1,0,0,0,0|1,0,2]=4 3669 B12R1.267 C#CCCNc1ncccc1I 68c6ac78b69bf813d63122acabdc774f [0,1,0,0,0,0|1,0,2]=4 3670 B12R1.267 C#CCCOc1ncccc1Br 0e1b8f3a8f750c9c74f31a9d57952185 [0,1,0,0,0,0|1,0,2]=4 3671 B12R1.267 C#CCCOc1ncccc1C 81a706021e9e8f0030a3bbea00bd139b [0,1,0,0,0,0|1,0,2]=4 3672 B12R1.267 C#CCCOc1ncccc1Cl 7f2e78cde77f0f8057e83be532701b17 [0,1,0,0,0,0|1,0,2]=4 3673 B12R1.267 C#CCCOc1ncccc1F 65077fc6737a84190ce0b5701d135073 [0,1,0,0,0,0|1,0,2]=4 3674 B12R1.267 C#CCNCc1ncccc1Br fb9bc5dff8de8266de02449ef602bed2 [0,1,0,0,0,0|1,0,2]=4 3675 B12R1.267 C#CCNCc1ncccc1C 06103b430739e3fcd4930a8480a83b1f [0,1,0,0,0,0|1,0,2]=4 3676 B12R1.267 C#CCNCc1ncccc1Cl 795f7c8ce197cf4a9db41a5e55242c55 [0,1,0,0,0,0|1,0,2]=4 3677 B12R1.267 C#CCNCc1ncccc1F 4043a38f6cd2315396a990fabdd388ae [0,1,0,0,0,0|1,0,2]=4 3678 B12R1.267 C#CCOCc1ncccc1Br 1e66a4fe4644ea4429313dd3ea89766a [0,1,0,0,0,0|1,0,2]=4 3679 B12R1.267 C#CCOCc1ncccc1C 3cc6e55b678d3f675bcfd08905ac585a [0,1,0,0,0,0|1,0,2]=4 3680 B12R1.267 C#CCOCc1ncccc1Cl 8380b071168e89bead1281f0fe58f454 [0,1,0,0,0,0|1,0,2]=4 3681 B12R1.267 C#CCOCc1ncccc1F e3887ed49237b48c504339d012c6c13e [0,1,0,0,0,0|1,0,2]=4 3682 B12R1.267 C/C=C/CNc1ncccc1Br b8dc3f3cd7543d88800ab52993a452e3 [0,1,0,0,0,0|1,0,2]=4 3683 B12R1.267 C/C=C/CNc1ncccc1C 36775d93dc65e2703bfb1505acd3eb99 [0,1,0,0,0,0|1,0,2]=4 3684 B12R1.267 C/C=C/CNc1ncccc1Cl 2bb3a2bf92747c1db43c1dab04d7dc63 [0,1,0,0,0,0|1,0,2]=4 3685 B12R1.267 C/C=C/CNc1ncccc1F bdc0091737a1eb63a34c31aad0f26440 [0,1,0,0,0,0|1,0,2]=4 3686 B12R1.267 C/C=C/CNc1ncccc1I c6e707eb4972e1755e8718fa07157e02 [0,1,0,0,0,0|1,0,2]=4 3687 B12R1.267 C/C=C/COc1ncccc1Br e2928dd185b00c6e295aa4c4e599e735 [0,1,0,0,0,0|1,0,2]=4 3688 B12R1.267 C/C=C/COc1ncccc1C 036a62ab4a023310d32a1992db2aae8e [0,1,0,0,0,0|1,0,2]=4 3689 B12R1.267 C/C=C/COc1ncccc1Cl 37b22204bf3680931d2d42be65af6f0a [0,1,0,0,0,0|1,0,2]=4 3690 B12R1.267 C/C=C/COc1ncccc1F fec7dd19a9a46c811edaf68c2fb55e5b [0,1,0,0,0,0|1,0,2]=4 3691 B12R1.267 C/C=C\CNc1ncccc1Br dfd9759be831986aa6cd7a9369cec2f1 [0,1,0,0,0,0|1,0,2]=4 3692 B12R1.267 C/C=C\CNc1ncccc1C 5a29eb6c82e5a418d63e58640e76f66a [0,1,0,0,0,0|1,0,2]=4 3693 B12R1.267 C/C=C\CNc1ncccc1Cl 40ab65c654db8b35a269f8e6180f6d43 [0,1,0,0,0,0|1,0,2]=4 3694 B12R1.267 C/C=C\CNc1ncccc1F 5298526ff89f55b7a13a5bdd0f41ef30 [0,1,0,0,0,0|1,0,2]=4 3695 B12R1.267 C/C=C\CNc1ncccc1I 10e86b4580e0fc625c339cd48d36b404 [0,1,0,0,0,0|1,0,2]=4 3696 B12R1.267 C/C=C\COc1ncccc1Br 2a5039e64f06b6776acd170946448f60 [0,1,0,0,0,0|1,0,2]=4 3697 B12R1.267 C/C=C\COc1ncccc1C acb0718af55a390c3e28c63c4e3d023b [0,1,0,0,0,0|1,0,2]=4 3698 B12R1.267 C/C=C\COc1ncccc1Cl 429c2e32fc5c827c08f685d138e67005 [0,1,0,0,0,0|1,0,2]=4 3699 B12R1.267 C/C=C\COc1ncccc1F 5632e6758cea4c70c299081f613a3ab3 [0,1,0,0,0,0|1,0,2]=4 3700 B12R1.267 C=CCCNc1ncccc1Br 3356c3f3f0c9a126690780bc1e6b99cd [0,1,0,0,0,0|1,0,2]=4 3701 B12R1.267 C=CCCNc1ncccc1C 8ebdf829f6fe4b386ec8f364aa9bd568 [0,1,0,0,0,0|1,0,2]=4 3702 B12R1.267 C=CCCNc1ncccc1Cl a8a5fe0e539394e670468d6457c5a016 [0,1,0,0,0,0|1,0,2]=4 3703 B12R1.267 C=CCCNc1ncccc1F c73a9e9692e88e63e5ea1fa18f1bbec6 [0,1,0,0,0,0|1,0,2]=4 3704 B12R1.267 C=CCCNc1ncccc1I 23e9fc0e4636208ff1ca390c59a0036d [0,1,0,0,0,0|1,0,2]=4 3705 B12R1.267 C=CCCNc1ncccc1O 49b5e8a239540cefba9db3cfdb0104f4 [0,1,0,0,0,0|1,0,2]=4 3706 B12R1.267 C=CCCOc1ncccc1Br 8f565553269ec226d1845bd678a20f6b [0,1,0,0,0,0|1,0,2]=4 3707 B12R1.267 C=CCCOc1ncccc1C fc0e1fd929f12fc3859e05e5b2b4e914 [0,1,0,0,0,0|1,0,2]=4 3708 B12R1.267 C=CCCOc1ncccc1Cl 53e4f717f0d993ae9b7ccf58d42f9b58 [0,1,0,0,0,0|1,0,2]=4 3709 B12R1.267 C=CCCOc1ncccc1F 6648f4cf98b17c0356d80bcf6c5502a9 [0,1,0,0,0,0|1,0,2]=4 3710 B12R1.267 C=CCNCc1ncccc1Br adbaa64eaef4b69b58a2504079be09ce [0,1,0,0,0,0|1,0,2]=4 3711 B12R1.267 C=CCNCc1ncccc1C 631f9425f37bbc2453741ed1cadbde18 [0,1,0,0,0,0|1,0,2]=4 3712 B12R1.267 C=CCNCc1ncccc1Cl bbcf5ddc89f1519036906273f161fc68 [0,1,0,0,0,0|1,0,2]=4 3713 B12R1.267 C=CCNCc1ncccc1F 16cdffbe2703362cafaa9907675455e9 [0,1,0,0,0,0|1,0,2]=4 3714 B12R1.267 C=CCOCc1ncccc1Br 7d53091567f2de46e0aace8e74861081 [0,1,0,0,0,0|1,0,2]=4 3715 B12R1.267 C=CCOCc1ncccc1C 8410bcc5ba55708882bc3a36c3689767 [0,1,0,0,0,0|1,0,2]=4 3716 B12R1.267 C=CCOCc1ncccc1Cl 28d4747ba9dbebc1e51d2e4cd888b1fe [0,1,0,0,0,0|1,0,2]=4 3717 B12R1.267 C=CCOCc1ncccc1F d2a5b2786563f0dfbe9f41a960bd7850 [0,1,0,0,0,0|1,0,2]=4 3718 B12R1.267 CC=CCNc1ncccc1C fc44e4230d11bcbc12823914f3547de7 [0,1,0,0,0,0|1,0,2]=4 3719 B12R1.267 CC=CCNc1ncccc1F 1bc3c296f7199d9a2be71d5a8da06feb [0,1,0,0,0,0|1,0,2]=4 3720 B12R1.267 CC=CCNc1ncccc1O a8e552562d9c525157128efefee113b6 [0,1,0,0,0,0|1,0,2]=4 3721 B12R1.267 CCCCNc1c[nH]ccc1=O 2171ac1739f21a07081f9ae550f8b6ac [0,1,0,0,0,0|3,0,0]=4 3722 B12R1.267 CCCCNc1c[nH]ccc1=S 80de505aef21eb5fa7069124342902d9 [0,1,0,0,0,0|3,0,0]=4 3723 B12R1.267 CCCCNc1ccc[nH]c1=O ce3e3dbadb26f7436b51db73de858518 [0,1,0,0,0,0|3,0,0]=4 3724 B12R1.267 CCCCNc1ccc[nH]c1=S b876b48cd50df01bff05030a1adde4c2 [0,1,0,0,0,0|3,0,0]=4 3725 B12R1.267 CCCCNc1cccc[n+]1[O-] 3d4bcbc977ce2351df47fd6e0e521d2c [0,1,0,0,0,0|1,0,1]=3 3726 B12R1.267 CCCCNc1ccccc1C cb964fe2d8cfd23c2726cd74a242470b [0,1,0,0,0,0|2,0,0]=3 3727 B12R1.267 CCCCNc1ccccc1Cl 6e7205e8041766fa9aa32cc4e4316fea [0,1,0,0,0,0|2,0,0]=3 3728 B12R1.267 CCCCNc1ccccc1F 93bd26ef4df061c2dc223f5480ce42a3 [0,1,0,0,0,0|2,0,0]=3 3729 B12R1.267 CCCCNc1ccccc1I 8f5af43ba97bf9951ca4d8417a9a57f0 [0,1,0,0,0,0|2,0,0]=3 3730 B12R1.267 CCCCNc1cccnc1Br d3fec478ced1ff0ac4fbfdd57afe172f [0,1,0,0,0,0|3,0,0]=4 3731 B12R1.267 CCCCNc1cccnc1C fad811ff1fa797428fe957bb5e80f5b5 [0,1,0,0,0,0|3,0,0]=4 3732 B12R1.267 CCCCNc1cccnc1Cl ecd1cb3831f5cdfff9b8af4e60d6c2d2 [0,1,0,0,0,0|3,0,0]=4 3733 B12R1.267 CCCCNc1cccnc1F 7ba1ab80518b5062e828d488462f4a2a [0,1,0,0,0,0|3,0,0]=4 3734 B12R1.267 CCCCNc1cccnc1I 9e5a45eda318e7f3ec1ea2b2b4ca580d [0,1,0,0,0,0|3,0,0]=4 3735 B12R1.267 CCCCNc1ccncc1Br 38b090ca0fa5d237d5610ce2c8b20b98 [0,1,0,0,0,0|3,0,0]=4 3736 B12R1.267 CCCCNc1ccncc1C d67d07991761cc4a161bc3b26e7f4ef8 [0,1,0,0,0,0|3,0,0]=4 3737 B12R1.267 CCCCNc1ccncc1Cl 03f85acdcbfb67330f7a401e47a86f4c [0,1,0,0,0,0|3,0,0]=4 3738 B12R1.267 CCCCNc1ccncc1F aad2d25647de24e38769f9c56e6ccf17 [0,1,0,0,0,0|3,0,0]=4 3739 B12R1.267 CCCCNc1ccncc1I 2b4fd0f3bfb9485f6b76852afd0c3b7b [0,1,0,0,0,0|3,0,0]=4 3740 B12R1.267 CCCCNc1cnccc1Br 46f073a4eb1bd7b603173a59f49e462f [0,1,0,0,0,0|3,0,0]=4 3741 B12R1.267 CCCCNc1cnccc1C d787f90e53c25369bc2f084e970b28cf [0,1,0,0,0,0|3,0,0]=4 3742 B12R1.267 CCCCNc1cnccc1Cl 7a5121c3fe1c8fc7bff0ae3db1f40f96 [0,1,0,0,0,0|3,0,0]=4 3743 B12R1.267 CCCCNc1cnccc1F 8064f0adec282f6830fdf8a889ea69a6 [0,1,0,0,0,0|3,0,0]=4 3744 B12R1.267 CCCCNc1cnccc1I fae1a251059b35a37690087eeb65c0aa [0,1,0,0,0,0|3,0,0]=4 3745 B12R1.267 CCCCNc1ncccc1Br 98d92c92f32632a244bed8738209b7df [0,1,0,0,0,0|1,0,0]=2 3746 B12R1.267 CCCCNc1ncccc1C 2e45a4067d865d7da64955a121039499 [0,1,0,0,0,0|1,0,0]=2 3747 B12R1.267 CCCCNc1ncccc1Cl ed6b56853a49eb692493900894acd752 [0,1,0,0,0,0|1,0,0]=2 3748 B12R1.267 CCCCNc1ncccc1F 58ff30c99c1396a51f881d44eff8cf3a [0,1,0,0,0,0|1,0,0]=2 3749 B12R1.267 CCCCNc1ncccc1I 88b4e5d654855dc8008f4dd0d3d049d8 [0,1,0,0,0,0|1,0,0]=2 3750 B12R1.267 CCCCNc1nccnc1Br b84df34f2e02d04ba7e924039ee6a90f [0,1,0,0,0,0|2,0,0]=3 3751 B12R1.267 CCCCNc1nccnc1C 90bc1b429aae368cae98fb58d90157ff [0,1,0,0,0,0|2,0,0]=3 3752 B12R1.267 CCCCNc1nccnc1Cl 4d647f8003093214a4348441e5a9474f [0,1,0,0,0,0|2,0,0]=3 3753 B12R1.267 CCCCNc1nccnc1I f68a6d7b34f28ff1bebdc1491aad029c [0,1,0,0,0,0|2,0,0]=3 3754 B12R1.267 CCCCNc1ncncc1Br 7ec6e03d939a49d20ea59c47546c84fe [0,1,0,0,0,0|2,0,0]=3 3755 B12R1.267 CCCCNc1ncncc1C 8d8e49f4784b694030e591b2af8126d8 [0,1,0,0,0,0|2,0,0]=3 3756 B12R1.267 CCCCNc1ncncc1Cl b0bff6fafd6e32916a0e1f949bfe575c [0,1,0,0,0,0|2,0,0]=3 3757 B12R1.267 CCCCNc1ncncc1F c8d978988f96fc8f9488230cf1e2cd77 [0,1,0,0,0,0|2,0,0]=3 3758 B12R1.267 CCCCNc1ncncc1I a83bcbfe0cfa08f1ae0b721a291164df [0,1,0,0,0,0|2,0,0]=3 3759 B12R1.267 CCCCNc1nnccc1C cfcb202ba96e64ba206f344372a63d6a [0,1,0,0,0,0|2,0,0]=3 3760 B12R1.267 CCCCOc1ccc[nH]c1=S 1acec24485cc03175cb8a8431599b7e2 [0,1,0,0,0,0|3,0,0]=4 3761 B12R1.267 CCCCOc1cccc[n+]1[O-] d61ca1438e8f234b267eec7da5f851e7 [0,1,0,0,0,0|1,0,1]=3 3762 B12R1.267 CCCCOc1ccccc1Br bcff99237489f480dc72197e24e0097e [0,1,0,0,0,0|2,0,0]=3 3763 B12R1.267 CCCCOc1ccccc1C 803afc2ce1e6d5fa1371cac971668549 [0,1,0,0,0,0|2,0,0]=3 3764 B12R1.267 CCCCOc1ccccc1Cl 6c2563b268f47d5f170b183906091886 [0,1,0,0,0,0|2,0,0]=3 3765 B12R1.267 CCCCOc1ccccc1F 9ca00bd7723e1d9e4d21ded7a0988504 [0,1,0,0,0,0|2,0,0]=3 3766 B12R1.267 CCCCOc1ccccc1I 08781f94c441e6933e92e36c0080d909 [0,1,0,0,0,0|2,0,0]=3 3767 B12R1.267 CCCCOc1ccccc1S 9afce9d077af63044cd79db09184fde8 [0,1,0,0,0,0|2,0,0]=3 3768 B12R1.267 CCCCOc1cccnc1Br e5d363c5971461c9fcf629544bab4835 [0,1,0,0,0,0|3,0,0]=4 3769 B12R1.267 CCCCOc1cccnc1C 84e9fdf2bba58872ffe7a46a67662b35 [0,1,0,0,0,0|3,0,0]=4 3770 B12R1.267 CCCCOc1cccnc1Cl 9c008ed381bbb5af2ccef6dd0c23af47 [0,1,0,0,0,0|3,0,0]=4 3771 B12R1.267 CCCCOc1cccnc1F 672bde3c259012fccfe4ad9ca0ceb365 [0,1,0,0,0,0|3,0,0]=4 3772 B12R1.267 CCCCOc1cccnc1I e5ef7f49bc226e5a4fad393c87867486 [0,1,0,0,0,0|3,0,0]=4 3773 B12R1.267 CCCCOc1cccoc1=O fbc49b8367347726350d6c0059a469cb [0,1,0,0,0,0|3,0,0]=4 3774 B12R1.267 CCCCOc1ccncc1Br aee52df2a25f5eb47bdb9a5385ff595e [0,1,0,0,0,0|3,0,0]=4 3775 B12R1.267 CCCCOc1ccncc1C a8a96a8ae5494e782a1db105dc9138fd [0,1,0,0,0,0|3,0,0]=4 3776 B12R1.267 CCCCOc1ccncc1Cl 556a29a7e2ccee3abfdcecfbab9cf385 [0,1,0,0,0,0|3,0,0]=4 3777 B12R1.267 CCCCOc1ccncc1F 91a66c1733d087c0353d655137a8cc68 [0,1,0,0,0,0|3,0,0]=4 3778 B12R1.267 CCCCOc1cnccc1Br 15aeb91f2b6964d7a4aa2b0cdf8bfd7b [0,1,0,0,0,0|3,0,0]=4 3779 B12R1.267 CCCCOc1cnccc1C 3b15574ad4f3c24340def9d6fb0c9767 [0,1,0,0,0,0|3,0,0]=4 3780 B12R1.267 CCCCOc1cnccc1Cl 90c5da1d6f50a5ee2172bbaea5ccf31b [0,1,0,0,0,0|3,0,0]=4 3781 B12R1.267 CCCCOc1cnccc1F c551281e572f34bcd577ada96b64037e [0,1,0,0,0,0|3,0,0]=4 3782 B12R1.267 CCCCOc1cnccc1I 211b8ac06e4b1aba8882b53002ac707f [0,1,0,0,0,0|3,0,0]=4 3783 B12R1.267 CCCCOc1coccc1=O 04c68206066ebe73f7acc5e776ca1f43 [0,1,0,0,0,0|3,0,0]=4 3784 B12R1.267 CCCCOc1ncccc1Br ab5e0f1b04532e99ed34495b6176c96c [0,1,0,0,0,0|1,0,0]=2 3785 B12R1.267 CCCCOc1ncccc1C 9acd3db19edc794136930ecc9d37d4c9 [0,1,0,0,0,0|1,0,0]=2 3786 B12R1.267 CCCCOc1ncccc1Cl 9da828dc387ebb2b2a0c22f9935c3aab [0,1,0,0,0,0|1,0,0]=2 3787 B12R1.267 CCCCOc1ncccc1F c7e9db1d1b3a07ca21a548585494e143 [0,1,0,0,0,0|1,0,0]=2 3788 B12R1.267 CCCCOc1nccnc1Br c8f7b3a05578c523e0f5795c6407313b [0,1,0,0,0,0|2,0,0]=3 3789 B12R1.267 CCCCOc1nccnc1C 402b39c5e5f48238166c9210830a4ffa [0,1,0,0,0,0|2,0,0]=3 3790 B12R1.267 CCCCOc1ncncc1C e62b7bc1f9187eb7b083965279655896 [0,1,0,0,0,0|2,0,0]=3 3791 B12R1.267 CCCCOc1ncncc1Cl e35d4ebb8614129e98dcc3e9e3fd63de [0,1,0,0,0,0|2,0,0]=3 3792 B12R1.267 CCCCOc1ncncc1F c055ce1a11c6c6a39cdaa22c6ffc32d5 [0,1,0,0,0,0|2,0,0]=3 3793 B12R1.267 CCCCOc1ncncc1I 7dca2edffb9ce050d00d58a4a47ad413 [0,1,0,0,0,0|2,0,0]=3 3794 B12R1.267 CCCCOc1nnccc1C 5749426939f1a8da8c0a8f9d977afa26 [0,1,0,0,0,0|2,0,0]=3 3795 B12R1.267 CCCCOc1nnccc1Cl 41b670bc92bef3fc8fbc5d6b3031bf75 [0,1,0,0,0,0|2,0,0]=3 3796 B12R1.267 CCCCOc1nnccc1I 1b7bb6b2c5bce517dfd3075a263c10ed [0,1,0,0,0,0|2,0,0]=3 3797 B12R1.267 CCCCOn1ccccc1=N 32ad87ebf11ce06103d90b026c61e876 [0,1,0,0,0,0|3,0,0]=4 3798 B12R1.267 CCCCOn1ccccc1=O 42c813425d770bfeb2151f1fa43ba34c [0,1,0,0,0,0|3,0,0]=4 3799 B12R1.267 CCCCOn1ccccc1=S c288e4f8eec520decee2174f91202f93 [0,1,0,0,0,0|3,0,0]=4 3800 B12R1.267 CCCNCc1cccc[n+]1[O-] 3f8d2f3f831024e14ee84f8df0789f0c [0,1,0,0,0,0|1,0,1]=3 3801 B12R1.267 CCCNCc1ccccc1Br bd58bf891f73040a234956b6adaf58b7 [0,1,0,0,0,0|2,0,0]=3 3802 B12R1.267 CCCNCc1ccccc1C 050fe1959a544b7272683da7815962b7 [0,1,0,0,0,0|2,0,0]=3 3803 B12R1.267 CCCNCc1ccccc1Cl 9af8efc228c85cb32fd226498427ad88 [0,1,0,0,0,0|2,0,0]=3 3804 B12R1.267 CCCNCc1ccccc1F 10db1bdfdcada70cdd61f937a45d1f2e [0,1,0,0,0,0|2,0,0]=3 3805 B12R1.267 CCCNCc1ccccc1I a2ce2cbd3d3a9276a9c0f47a371bdac6 [0,1,0,0,0,0|2,0,0]=3 3806 B12R1.267 CCCNCc1cccnc1Br 402a94c70b6d2183e3d722edecb4a5f9 [0,1,0,0,0,0|3,0,0]=4 3807 B12R1.267 CCCNCc1cccnc1C e1b1b5a8410f06279070c8edcdf17240 [0,1,0,0,0,0|3,0,0]=4 3808 B12R1.267 CCCNCc1cccnc1Cl ab3826b70237d838a83d352eac3e41d3 [0,1,0,0,0,0|3,0,0]=4 3809 B12R1.267 CCCNCc1cccnc1F 199c5897eca11fa291c050d6993ed7e7 [0,1,0,0,0,0|3,0,0]=4 3810 B12R1.267 CCCNCc1ccncc1Br e9f9882823e68b48ae4a932d82f6ad11 [0,1,0,0,0,0|3,0,0]=4 3811 B12R1.267 CCCNCc1ccncc1C 2ed7bb25324af023967144bd7385c902 [0,1,0,0,0,0|3,0,0]=4 3812 B12R1.267 CCCNCc1ccncc1Cl ce9529e88997d3947366216f8c47ea6d [0,1,0,0,0,0|3,0,0]=4 3813 B12R1.267 CCCNCc1ccncc1F 527f173d2b758d4a87007c0ecef48b68 [0,1,0,0,0,0|3,0,0]=4 3814 B12R1.267 CCCNCc1cnccc1C 9bead837e92e04248f1f4a17f6bc75bc [0,1,0,0,0,0|3,0,0]=4 3815 B12R1.267 CCCNCc1ncccc1Br 0ca0f3c5a94b1d72a0af3e923ae6aade [0,1,0,0,0,0|1,0,0]=2 3816 B12R1.267 CCCNCc1ncccc1C d2df36c8f920a1d0503e8cfb0b483277 [0,1,0,0,0,0|1,0,0]=2 3817 B12R1.267 CCCNCc1ncccc1Cl 47e4a918c94fbfb20ad65d8ee4ca972e [0,1,0,0,0,0|1,0,0]=2 3818 B12R1.267 CCCNCc1ncccc1F 4525c38f95b8d93501c447beaff3a3d5 [0,1,0,0,0,0|1,0,0]=2 3819 B12R1.267 CCCNCc1nccnc1C 2329748998eb0628f0fe982f13629fb6 [0,1,0,0,0,0|2,0,0]=3 3820 B12R1.267 CCCNCc1nccnc1Cl 06c10d86a742bfca8f9da32908ce475d [0,1,0,0,0,0|2,0,0]=3 3821 B12R1.267 CCCNCc1nnc[nH]c1=O 6ffcbb6452c57116ecf9596bbb0c7ab3 [0,1,0,0,0,0|3,0,0]=4 3822 B12R1.267 CCCNCc1nnccc1C a865ac2d7e93f19991b80fa96de1196e [0,1,0,0,0,0|2,0,0]=3 3823 B12R1.267 CCCOCc1ccc[nH]c1=O e6acbb43398249bcbb739562d726fb3f [0,1,0,0,0,0|3,0,0]=4 3824 B12R1.267 CCCOCc1cccc[n+]1[O-] 61cbe915a919e734a4bcd748d3747d59 [0,1,0,0,0,0|1,0,1]=3 3825 B12R1.267 CCCOCc1ccccc1C 69819a6d99087ea23f1233c6ad1452d2 [0,1,0,0,0,0|2,0,0]=3 3826 B12R1.267 CCCOCc1ccccc1Cl be8fb5e4d0358fc76e083c2c1033dd16 [0,1,0,0,0,0|2,0,0]=3 3827 B12R1.267 CCCOCc1ccccc1F 817daa4caad3d25d218a0e50ef2066fb [0,1,0,0,0,0|2,0,0]=3 3828 B12R1.267 CCCOCc1ccccc1I ce9ddc1d6dd0a2595b0faa5a82ad4942 [0,1,0,0,0,0|2,0,0]=3 3829 B12R1.267 CCCOCc1cccnc1Br 77809bbe385de5a43b12b367d88c71a2 [0,1,0,0,0,0|3,0,0]=4 3830 B12R1.267 CCCOCc1cccnc1C 80f08444768dce951386843ce88fb151 [0,1,0,0,0,0|3,0,0]=4 3831 B12R1.267 CCCOCc1cccnc1Cl 4c16458fea46acd0246b70a5f4d58119 [0,1,0,0,0,0|3,0,0]=4 3832 B12R1.267 CCCOCc1cccnc1F 82e1bbfcda2532af7c2d1073e1466af8 [0,1,0,0,0,0|3,0,0]=4 3833 B12R1.267 CCCOCc1ccncc1Br 64b6d1df5b4d11360abcef9177275c27 [0,1,0,0,0,0|3,0,0]=4 3834 B12R1.267 CCCOCc1ccncc1C 7735e31f03b9348d7e7ebc447c03a04d [0,1,0,0,0,0|3,0,0]=4 3835 B12R1.267 CCCOCc1ccncc1Cl 7f115ca68f6129d35dde1f6128d24c23 [0,1,0,0,0,0|3,0,0]=4 3836 B12R1.267 CCCOCc1ccncc1F 54874f40bf1842d019ae5aa557cd3f64 [0,1,0,0,0,0|3,0,0]=4 3837 B12R1.267 CCCOCc1ccncc1I f9ecfd2dc90caa129d74ba3aa4f216e8 [0,1,0,0,0,0|3,0,0]=4 3838 B12R1.267 CCCOCc1cnccc1Br 1cf6735153beedc757fd6466847c1e0e [0,1,0,0,0,0|3,0,0]=4 3839 B12R1.267 CCCOCc1cnccc1C c5527632473ce43017a4a07048be0b6b [0,1,0,0,0,0|3,0,0]=4 3840 B12R1.267 CCCOCc1cnccc1Cl f11ef4b144489d3c93bb53cdc9f987d4 [0,1,0,0,0,0|3,0,0]=4 3841 B12R1.267 CCCOCc1cnccc1F f2cab6e6a0e3930495040aa86cc52368 [0,1,0,0,0,0|3,0,0]=4 3842 B12R1.267 CCCOCc1ncccc1Br 295e33b84a30fea5fd13900f16d144d8 [0,1,0,0,0,0|1,0,0]=2 3843 B12R1.267 CCCOCc1ncccc1C 7c546d71a2c0070eaea514043b7c3a08 [0,1,0,0,0,0|1,0,0]=2 3844 B12R1.267 CCCOCc1ncccc1Cl 1fac8383dbf1b1b1da43cedc31f90683 [0,1,0,0,0,0|1,0,0]=2 3845 B12R1.267 CCCOCc1ncccc1F 6d94624a107964647d0429a2132b9543 [0,1,0,0,0,0|1,0,0]=2 3846 B12R1.267 CCCOCc1nccnc1C 4f5af91c665324e63db9a5c85cb38147 [0,1,0,0,0,0|2,0,0]=3 3847 B12R1.267 CCCOCc1nccnc1Cl 7ca0fb579f5dc0f906f6579cbde18691 [0,1,0,0,0,0|2,0,0]=3 3848 B12R1.267 CCCOCc1ncncc1Br 412b4dfe443cbc17b5c60097e2eea8a9 [0,1,0,0,0,0|2,0,0]=3 3849 B12R1.267 CCCOCc1nnccc1C b87016607bfae91d7aa5290bcbb41194 [0,1,0,0,0,0|2,0,0]=3 3850 B12R1.267 CCNCCc1ccccc1Cl b462d134ed26b2145f2b3576e4d12230 [0,1,0,0,0,0|2,0,0]=3 3851 B12R1.267 CCNCCc1ccccc1F dee7dcb89926d867dd249445cc929612 [0,1,0,0,0,0|2,0,0]=3 3852 B12R1.267 CCNCCc1ncccc1Br bb73543459a8b8f22656304c282b7a20 [0,1,0,0,0,0|1,0,0]=2 3853 B12R1.267 CCNCCc1ncccc1C 07ded1235abe1d390563f675a302acd3 [0,1,0,0,0,0|1,0,0]=2 3854 B12R1.267 CCNCCn1ccccc1=O 506f5f99c13f40cbc85b2b5102c6d01d [0,1,0,0,0,0|3,0,0]=4 3855 B12R1.267 CCNCCn1ncccc1=O cd95a9d85fe1bb0d59dac7ffae1487b2 [0,1,0,0,0,0|2,0,0]=3 3856 B12R1.267 CCOCCc1ccccc1Br ff423992d371a6fc4a4fd1c88d225519 [0,1,0,0,0,0|2,0,0]=3 3857 B12R1.267 CCOCCc1ccccc1C 60652323b8b6e9b1615ced7c97b2a1b4 [0,1,0,0,0,0|2,0,0]=3 3858 B12R1.267 CCOCCc1ccccc1Cl 69a4003c1b2444e1ffe9dabcded8220b [0,1,0,0,0,0|2,0,0]=3 3859 B12R1.267 CCOCCc1ccccc1F afa3523c66ce915b25923508bd683d81 [0,1,0,0,0,0|2,0,0]=3 3860 B12R1.267 CCOCCc1ccccc1I e3f39fece90b0172c387ddafe972d300 [0,1,0,0,0,0|2,0,0]=3 3861 B12R1.267 CCOCCc1ccncc1C 12f02602e6c331f70a15f40f769e4ea0 [0,1,0,0,0,0|3,0,0]=4 3862 B12R1.267 CCOCCc1ccncc1Cl 153b4f71944f4bedd9c0b4b80c41a4ab [0,1,0,0,0,0|3,0,0]=4 3863 B12R1.267 CCOCCc1ccncc1F 79366eef9c9a11f0763ef0b6ad1ce70e [0,1,0,0,0,0|3,0,0]=4 3864 B12R1.267 CCOCCc1ncccc1C 60823763fced731daa123238a689e3bd [0,1,0,0,0,0|1,0,0]=2 3865 B12R1.267 CCOCCc1ncccc1F 245e4153f4e3b194e41a9f7498437fde [0,1,0,0,0,0|1,0,0]=2 3866 B12R1.267 CCOCCc1nccnc1C 9f8e6c6fd44ab07f126f6b6c2480ac15 [0,1,0,0,0,0|2,0,0]=3 3867 B12R1.267 CCOCCn1ccccc1=O a039d6e7a80464ced710f04fc1b35557 [0,1,0,0,0,0|3,0,0]=4 3868 B12R1.267 CCOCNc1cccc[n+]1[O-] cb8d5f8ad5e8347285b6b772cbc067a2 [0,1,0,0,0,0|2,0,1]=4 3869 B12R1.267 CCOCNc1ccccc1I fbeb8312a82b28075d0bb91d0bdb0eba [0,1,0,0,0,0|3,0,0]=4 3870 B12R1.267 CCOCNc1ncccc1C 1f685d81d3f859df9e58f8f944a4b304 [0,1,0,0,0,0|2,0,0]=3 3871 B12R1.267 CCOCNc1ncccc1Cl 0411c9ef6d0319e9e0e02be783c1cb7e [0,1,0,0,0,0|2,0,0]=3 3872 B12R1.267 CCOCNc1ncccc1F 9374d1017a94d26877185eb13c6ab442 [0,1,0,0,0,0|2,0,0]=3 3873 B12R1.267 CCOCNc1ncccc1I e42384bb9637818d304ad26d4cfc871b [0,1,0,0,0,0|2,0,0]=3 3874 B12R1.267 CCOCNc1nccnc1Br 887c913f06f9e1ef111166567e9ac5a8 [0,1,0,0,0,0|3,0,0]=4 3875 B12R1.267 CCOCNc1nccnc1C 6dfbdc6f29abe266dc632cc085a62c7b [0,1,0,0,0,0|3,0,0]=4 3876 B12R1.267 CCOCNc1nccnc1Cl 346805bc28062ab812ebff7449e28402 [0,1,0,0,0,0|3,0,0]=4 3877 B12R1.267 CCOCNc1nccnc1I 8b30f34fc486866b427a655e0276d639 [0,1,0,0,0,0|3,0,0]=4 3878 B12R1.267 CCOCNc1nnccc1C 5f239723efb8c7722b0dbb146924cd7f [0,1,0,0,0,0|3,0,0]=4 3879 B12R1.267 CCOCOc1ccccc1Cl 6b95252f205acc38cec8fd01d15e5cbf [0,1,0,0,0,0|3,0,0]=4 3880 B12R1.267 CCOCOc1ncccc1C acbd9ed53ac05061c88f7da58dd009a7 [0,1,0,0,0,0|2,0,0]=3 3881 B12R1.267 CCOCOc1ncccc1Cl 584f12693ea71a0764fde3657daac85a [0,1,0,0,0,0|2,0,0]=3 3882 B12R1.267 CCOCOc1ncccc1F 26ba4e2cd1880e64b271c3653ca9aae2 [0,1,0,0,0,0|2,0,0]=3 3883 B12R1.267 CCOCOc1nccnc1Br 343d587c1832e5a19fadfdaa8e0ca4a3 [0,1,0,0,0,0|3,0,0]=4 3884 B12R1.267 CCOCOc1nccnc1C ffd0ba28e5abb4610299b517279a6655 [0,1,0,0,0,0|3,0,0]=4 3885 B12R1.267 CCOCOc1ncncc1F 282e13799bafa2a705cb2659ee99b176 [0,1,0,0,0,0|3,0,0]=4 3886 B12R1.267 CCOCOc1nnccc1C be17fac7d835b3efcc3632c710176a08 [0,1,0,0,0,0|3,0,0]=4 3887 B12R1.267 CCOCOc1nnccc1Cl 8d2fd01508c366784718ad75bb585b8d [0,1,0,0,0,0|3,0,0]=4 3888 B12R1.267 CCOCOc1nnccc1I 20615d1270017e8a0e27b6f4daeee7d3 [0,1,0,0,0,0|3,0,0]=4 3889 B12R1.267 COCCNc1cccc[n+]1[O-] fc538a03217f606ae7256c7f87ff93b0 [0,1,0,0,0,0|2,0,1]=4 3890 B12R1.267 COCCNc1ccccc1Br 2316346ab9c88084bfe847f7f62a0e78 [0,1,0,0,0,0|3,0,0]=4 3891 B12R1.267 COCCNc1ccccc1C 440ffddaa1772446f34e221fdd9eff58 [0,1,0,0,0,0|3,0,0]=4 3892 B12R1.267 COCCNc1ccccc1Cl 22c9cd1bcd1ad7bf6603d76725704441 [0,1,0,0,0,0|3,0,0]=4 3893 B12R1.267 COCCNc1ccccc1F e1818d70eee674628d30c8a4457d7c70 [0,1,0,0,0,0|3,0,0]=4 3894 B12R1.267 COCCNc1ccccc1I d7458fd5683eab62e6e9336c5bd7b7d2 [0,1,0,0,0,0|3,0,0]=4 3895 B12R1.267 COCCNc1ccccc1S ac2543380377bc26937c025a96dacef0 [0,1,0,0,0,0|3,0,0]=4 3896 B12R1.267 COCCNc1ncc[nH]c1=O 972012bfb991f5add56db05438c4ee15 [0,1,0,0,0,0|3,0,0]=4 3897 B12R1.267 COCCNc1ncccc1Br a604ebf2cf2b906d82c9de5b92a8bea1 [0,1,0,0,0,0|2,0,0]=3 3898 B12R1.267 COCCNc1ncccc1C b200439ebeebfb9b80997fa3d6e74c08 [0,1,0,0,0,0|2,0,0]=3 3899 B12R1.267 COCCNc1ncccc1Cl eac58380cc0bde315f54a867360b9693 [0,1,0,0,0,0|2,0,0]=3 3900 B12R1.267 COCCNc1ncccc1F db9e27fceea2d4bcb23689a4f2e4f4ee [0,1,0,0,0,0|2,0,0]=3 3901 B12R1.267 COCCNc1ncccc1I 0bf1d1e5054f49afecfee14ec757f447 [0,1,0,0,0,0|2,0,0]=3 3902 B12R1.267 COCCNc1ncccc1O e8df3468a5d78b0d5e1f950442f68888 [0,1,0,0,0,0|2,0,0]=3 3903 B12R1.267 COCCNc1nccnc1Br 7bc3cf7865cb429729a31252e85d7ef5 [0,1,0,0,0,0|3,0,0]=4 3904 B12R1.267 COCCNc1nccnc1C ac817621162cf95e1423a113f6809b4b [0,1,0,0,0,0|3,0,0]=4 3905 B12R1.267 COCCNc1nccnc1Cl 516dc97be226fb3d57255f5f4ab41ad3 [0,1,0,0,0,0|3,0,0]=4 3906 B12R1.267 COCCNc1nccnc1F 00f82d8ada94a8799377bfeb09be35e3 [0,1,0,0,0,0|3,0,0]=4 3907 B12R1.267 COCCNc1nccnc1I 6b36dc6ab2a41345dd19ff5d43b1a701 [0,1,0,0,0,0|3,0,0]=4 3908 B12R1.267 COCCNc1ncncc1Br d842268b284ca14eac4a627e27827ec9 [0,1,0,0,0,0|3,0,0]=4 3909 B12R1.267 COCCNc1ncncc1C 503e3c1ddd2263ecb001e806c8cb0a5c [0,1,0,0,0,0|3,0,0]=4 3910 B12R1.267 COCCNc1ncncc1Cl d0ff29521f6493e24bbb654bd152b662 [0,1,0,0,0,0|3,0,0]=4 3911 B12R1.267 COCCNc1ncncc1F 982e0de5e9c1a15f38f73dbf26f77603 [0,1,0,0,0,0|3,0,0]=4 3912 B12R1.267 COCCNc1ncncc1I de452048758111b83c7b9a750ce99cce [0,1,0,0,0,0|3,0,0]=4 3913 B12R1.267 COCCNc1nnccc1C 98d7e9c3ba13377bc188ffa15f51acd9 [0,1,0,0,0,0|3,0,0]=4 3914 B12R1.267 COCCNc1nnccc1O 6c9ce4d84c906d351bbaef80e58fd339 [0,1,0,0,0,0|3,0,0]=4 3915 B12R1.267 COCCOc1cccc[n+]1[O-] da17a0e963db3c1f655b4ca490dc3cfd [0,1,0,0,0,0|2,0,1]=4 3916 B12R1.267 COCCOc1ccccc1Br 269ff3ba6771bca876eb0237f38698b5 [0,1,0,0,0,0|3,0,0]=4 3917 B12R1.267 COCCOc1ccccc1C d1a4078b5d8b7f06fefaa8a04a5a197e [0,1,0,0,0,0|3,0,0]=4 3918 B12R1.267 COCCOc1ccccc1Cl 310103c01f49e38bf9b89eb56adc9dcd [0,1,0,0,0,0|3,0,0]=4 3919 B12R1.267 COCCOc1ccccc1F a71971d185ec2566b27b95f9dfa9183e [0,1,0,0,0,0|3,0,0]=4 3920 B12R1.267 COCCOc1ccccc1I 5fb711a5f8e107d6d4a36d7a8a50ed45 [0,1,0,0,0,0|3,0,0]=4 3921 B12R1.267 COCCOc1ccccc1S c61bd9f6f038f9291ed764f12135eb69 [0,1,0,0,0,0|3,0,0]=4 3922 B12R1.267 COCCOc1ncccc1Br 237777dd11fb61b520b4152aaef37661 [0,1,0,0,0,0|2,0,0]=3 3923 B12R1.267 COCCOc1ncccc1C 216a0d3c2273c6e254118577a20283d0 [0,1,0,0,0,0|2,0,0]=3 3924 B12R1.267 COCCOc1ncccc1Cl 506e5d1836d46b9486c7e2f295b70ded [0,1,0,0,0,0|2,0,0]=3 3925 B12R1.267 COCCOc1ncccc1F e1c0d699796f8f5be68de7af5a1324ba [0,1,0,0,0,0|2,0,0]=3 3926 B12R1.267 COCCOc1nccnc1Br 5cc22e0933dc22214e2a9370784420a4 [0,1,0,0,0,0|3,0,0]=4 3927 B12R1.267 COCCOc1nccnc1C fec76c97caa77bf647ad5ba0c1fb533c [0,1,0,0,0,0|3,0,0]=4 3928 B12R1.267 COCCOc1ncncc1C 759fc9b905fe17b2a89eb0b052be3945 [0,1,0,0,0,0|3,0,0]=4 3929 B12R1.267 COCCOc1ncncc1Cl 07c6863f939585c78a247c7f93dd0418 [0,1,0,0,0,0|3,0,0]=4 3930 B12R1.267 COCCOc1ncncc1F 20b910507c6f85107074d0e8624eca9a [0,1,0,0,0,0|3,0,0]=4 3931 B12R1.267 COCCOc1ncncc1I d1b48f9f58d70eff1ecba7bde2f421e3 [0,1,0,0,0,0|3,0,0]=4 3932 B12R1.267 COCCOc1nnccc1C eaf39aa9881d634243df28b101796053 [0,1,0,0,0,0|3,0,0]=4 3933 B12R1.267 COCCOc1nnccc1Cl 21798f1160b5e545f4d2badb87e0a612 [0,1,0,0,0,0|3,0,0]=4 3934 B12R1.267 COCCOc1nnccc1I c603333bd9d7b3565ccd157388e554ea [0,1,0,0,0,0|3,0,0]=4 3935 B12R1.267 COCNCc1cccc[n+]1[O-] d6d65297cd199f36e068b181f57ad367 [0,1,0,0,0,0|2,0,1]=4 3936 B12R1.267 COCNCc1ccccc1Br b237780edc7e0e7084c58a3782b8f3d4 [0,1,0,0,0,0|3,0,0]=4 3937 B12R1.267 COCNCc1ccccc1C 0cee05accc446e8ea1175470ca772094 [0,1,0,0,0,0|3,0,0]=4 3938 B12R1.267 COCNCc1ccccc1Cl 462467d30ed83a7699177d39d3791eb2 [0,1,0,0,0,0|3,0,0]=4 3939 B12R1.267 COCNCc1ccccc1F ccf1619ef238a69fb648cb5390ba9858 [0,1,0,0,0,0|3,0,0]=4 3940 B12R1.267 COCNCc1ccccc1I cbb778473389aa3adf4240ac9b0e4733 [0,1,0,0,0,0|3,0,0]=4 3941 B12R1.267 COCNCc1ncccc1Br 8861e3cb888c88f5e3ff7cf36ac4459c [0,1,0,0,0,0|2,0,0]=3 3942 B12R1.267 COCNCc1ncccc1C cc078bd001157d252ec034e7f311fc3d [0,1,0,0,0,0|2,0,0]=3 3943 B12R1.267 COCNCc1ncccc1Cl 0b7c3ac3dc396d8ebde2008fe6df39be [0,1,0,0,0,0|2,0,0]=3 3944 B12R1.267 COCNCc1ncccc1F a031a9b80ca52defc805ddb3587bb316 [0,1,0,0,0,0|2,0,0]=3 3945 B12R1.267 COCNCc1nccnc1Cl e148d0e0fa0b0914cd995f6f98570bfb [0,1,0,0,0,0|3,0,0]=4 3946 B12R1.267 COCNCc1nnccc1C 4c6302b9d54abf4b24d383c12f037bd3 [0,1,0,0,0,0|3,0,0]=4 3947 B12R1.267 COCOCc1ccccc1Br bfa4b5bd5970ee9c9b7435f6cb7658a4 [0,1,0,0,0,0|3,0,0]=4 3948 B12R1.267 COCOCc1ccccc1C 72d2b2b099b7f2ec40fa5e1d9474c39e [0,1,0,0,0,0|3,0,0]=4 3949 B12R1.267 COCOCc1ccccc1Cl 69343f28b8b2c88962ef03b7c8399d31 [0,1,0,0,0,0|3,0,0]=4 3950 B12R1.267 COCOCc1ccccc1F eebdc39702ad7fc25bd356221ffea205 [0,1,0,0,0,0|3,0,0]=4 3951 B12R1.267 COCOCc1ccccc1I 0eda0999da600bcd5be24d5bcde342f9 [0,1,0,0,0,0|3,0,0]=4 3952 B12R1.267 COCOCc1ccccc1S ac5a2c9358d2dfcc9af283f6bdd670ac [0,1,0,0,0,0|3,0,0]=4 3953 B12R1.267 COCOCc1ncccc1Br 45361cea6ac7c6d48eb1c5de6070ce83 [0,1,0,0,0,0|2,0,0]=3 3954 B12R1.267 COCOCc1ncccc1C 594ada32c6d5e2500358d6514bc9c924 [0,1,0,0,0,0|2,0,0]=3 3955 B12R1.267 COCOCc1ncccc1Cl 89d47458dbea593c980b129190b5ae96 [0,1,0,0,0,0|2,0,0]=3 3956 B12R1.267 COCOCc1ncccc1F 75b94ec0b877f2d9d32457351b90774d [0,1,0,0,0,0|2,0,0]=3 3957 B12R1.267 COCOCc1nccnc1C 526e872ceff4207109745660e2448add [0,1,0,0,0,0|3,0,0]=4 3958 B12R1.267 COCOCc1nccnc1Cl 70cdf6b1abf69428d0ae73db25ceeb50 [0,1,0,0,0,0|3,0,0]=4 3959 B12R1.267 COCOCc1ncncc1Br 7a1e1627ac7b0af63c00bef71fdc0c7c [0,1,0,0,0,0|3,0,0]=4 3960 B12R1.267 COCOCc1nnccc1C 918fbb98a9a84d6d59f8b22e38999e51 [0,1,0,0,0,0|3,0,0]=4 3961 B12R1.267 CSCCNc1cccc[n+]1[O-] e7445d9391d1177ef03f07540787d805 [0,1,0,0,0,0|2,0,1]=4 3962 B12R1.267 CSCCNc1ccccc1Br 89f896b7ac37f3ff5e29ed57ee03acae [0,1,0,0,0,0|3,0,0]=4 3963 B12R1.267 CSCCNc1ccccc1C a602aae8e2436b54decd8465bcef52b3 [0,1,0,0,0,0|3,0,0]=4 3964 B12R1.267 CSCCNc1ccccc1Cl 1e4317efcab81ecd52bdd5935b072af9 [0,1,0,0,0,0|3,0,0]=4 3965 B12R1.267 CSCCNc1ccccc1F e263ac1957660b93601a70cc4e4ea086 [0,1,0,0,0,0|3,0,0]=4 3966 B12R1.267 CSCCNc1ccccc1I 50dc8a75e2dd87829cebe11ed891b3e1 [0,1,0,0,0,0|3,0,0]=4 3967 B12R1.267 CSCCNc1ccccc1S 563a1d81ad072cd0e10bb3bb0a36dcef [0,1,0,0,0,0|3,0,0]=4 3968 B12R1.267 CSCCNc1ncccc1Br fe72f68f85b5446d1e1915022f2afb31 [0,1,0,0,0,0|2,0,0]=3 3969 B12R1.267 CSCCNc1ncccc1C 486fa1822bd36b3b65487e14aff1d631 [0,1,0,0,0,0|2,0,0]=3 3970 B12R1.267 CSCCNc1ncccc1Cl 1800950b5061fb8fee7ef5a75c742122 [0,1,0,0,0,0|2,0,0]=3 3971 B12R1.267 CSCCNc1ncccc1F 7a24ec3a103c99f557b937bd28141615 [0,1,0,0,0,0|2,0,0]=3 3972 B12R1.267 CSCCNc1ncccc1I af0ebe64eda0302a9b1ef6248b528554 [0,1,0,0,0,0|2,0,0]=3 3973 B12R1.267 CSCCNc1nccnc1Br 6df5c7752ca9276f16c03f6487f6bf3b [0,1,0,0,0,0|3,0,0]=4 3974 B12R1.267 CSCCNc1nccnc1C 8a57c5c533dd3195ac4c9545d3327f27 [0,1,0,0,0,0|3,0,0]=4 3975 B12R1.267 CSCCNc1nccnc1Cl 0473a42e02d3cd059e73f82af821cf3f [0,1,0,0,0,0|3,0,0]=4 3976 B12R1.267 CSCCNc1nccnc1I 5f8df8c85c8cfc9e23c210c2acb2d48b [0,1,0,0,0,0|3,0,0]=4 3977 B12R1.267 CSCCNc1ncncc1Br b49620e6d486b1122e76b6e55feb5061 [0,1,0,0,0,0|3,0,0]=4 3978 B12R1.267 CSCCNc1ncncc1C 983c3a4cc15f9f2f74c31e1c84e25e85 [0,1,0,0,0,0|3,0,0]=4 3979 B12R1.267 CSCCNc1ncncc1Cl 6698b826869ce0409ed9f6ffea4fc697 [0,1,0,0,0,0|3,0,0]=4 3980 B12R1.267 CSCCNc1ncncc1F 3fc3042cb54983bd316cf446f373e23d [0,1,0,0,0,0|3,0,0]=4 3981 B12R1.267 CSCCNc1ncncc1I 3ad0e14f7551e7c55827c1fbfe86f3ee [0,1,0,0,0,0|3,0,0]=4 3982 B12R1.267 CSCCNc1nnccc1C 822c90b64bb14bdfed4444232c840e64 [0,1,0,0,0,0|3,0,0]=4 3983 B12R1.267 CSCCOc1cccc[n+]1[O-] 99d4ee6b99228aabd3ee4cd24ffe2db2 [0,1,0,0,0,0|2,0,1]=4 3984 B12R1.267 CSCCOc1ccccc1Br 8581414fdfa463e59db6a516f52cd509 [0,1,0,0,0,0|3,0,0]=4 3985 B12R1.267 CSCCOc1ccccc1C 3a190489aede5345d1d05632cac537ca [0,1,0,0,0,0|3,0,0]=4 3986 B12R1.267 CSCCOc1ccccc1Cl bd29c90b63f15c078d63ef35d2524b5d [0,1,0,0,0,0|3,0,0]=4 3987 B12R1.267 CSCCOc1ccccc1F 5e9c59f726c5c4fa708074cde48b4a7b [0,1,0,0,0,0|3,0,0]=4 3988 B12R1.267 CSCCOc1ccccc1I f7094c1aa5023573c6451d1e7ff86e0d [0,1,0,0,0,0|3,0,0]=4 3989 B12R1.267 CSCCOc1ccccc1S c0b5e2ff8d7489f9bd32e18a82064c65 [0,1,0,0,0,0|3,0,0]=4 3990 B12R1.267 CSCCOc1ncccc1Br fe53e945004e9c562ce3303b927afa69 [0,1,0,0,0,0|2,0,0]=3 3991 B12R1.267 CSCCOc1ncccc1C 287464db5c0583e08e2666fbd87c6efd [0,1,0,0,0,0|2,0,0]=3 3992 B12R1.267 CSCCOc1ncccc1Cl afacb364af23db367f95223d462d0412 [0,1,0,0,0,0|2,0,0]=3 3993 B12R1.267 CSCCOc1ncccc1F aa8d9e96cba89df16831903cd73fc69d [0,1,0,0,0,0|2,0,0]=3 3994 B12R1.267 CSCCOc1nccnc1Br e872b5c02e23ad48637b81453e4008c1 [0,1,0,0,0,0|3,0,0]=4 3995 B12R1.267 CSCCOc1nccnc1C a86016b52a8659f7f1058f830c85bce8 [0,1,0,0,0,0|3,0,0]=4 3996 B12R1.267 CSCCOc1ncncc1C 7eff14efd5d0f0cccf03a4d9aaead07b [0,1,0,0,0,0|3,0,0]=4 3997 B12R1.267 CSCCOc1ncncc1Cl f15d7e8e42624418a00acf5d8214eb69 [0,1,0,0,0,0|3,0,0]=4 3998 B12R1.267 CSCCOc1ncncc1F d38b1d7c6c2b4e34f9a4ace832601012 [0,1,0,0,0,0|3,0,0]=4 3999 B12R1.267 CSCCOc1ncncc1I e65bdb303f852cec47ca03d816f90b7a [0,1,0,0,0,0|3,0,0]=4 4000 B12R1.267 CSCCOc1nnccc1C f2002687ec12917418fdd7afe4f40032 [0,1,0,0,0,0|3,0,0]=4 4001 B12R1.267 CSCCOc1nnccc1Cl c6b88286438d317bcc45926b81bd3c44 [0,1,0,0,0,0|3,0,0]=4 4002 B12R1.267 CSCCOc1nnccc1I 9635bee27c22d0337825dff78c56f2f0 [0,1,0,0,0,0|3,0,0]=4 4003 B12R1.267 CSCNCc1cccc[n+]1[O-] 982c2116778065d566fafe515e72a19f [0,1,0,0,0,0|2,0,1]=4 4004 B12R1.267 CSCNCc1ccccc1Cl 92179a05b0923c81723b70dcc861bfb8 [0,1,0,0,0,0|3,0,0]=4 4005 B12R1.267 CSCNCc1ccccc1F f88a948e935d1f07436a075dc120a40a [0,1,0,0,0,0|3,0,0]=4 4006 B12R1.267 CSCNCc1ccccc1I 980e1aec5f2b58f5eb35e241e05c7f0f [0,1,0,0,0,0|3,0,0]=4 4007 B12R1.267 CSCNCc1ncccc1Br b76de085f30232275bcf02781f6eb062 [0,1,0,0,0,0|2,0,0]=3 4008 B12R1.267 CSCNCc1ncccc1C 94431dc7cf192f5e8ab4ebb7e55e4f51 [0,1,0,0,0,0|2,0,0]=3 4009 B12R1.267 CSCNCc1ncccc1Cl b8d6339f1cf611692d28433ec310d710 [0,1,0,0,0,0|2,0,0]=3 4010 B12R1.267 CSCNCc1ncccc1F b057ad42c041bc25559f55dd5c37c9a8 [0,1,0,0,0,0|2,0,0]=3 4011 B12R1.267 CSCNCc1nccnc1Cl 57c66f7b8b169e00f506176e8ebd1edb [0,1,0,0,0,0|3,0,0]=4 4012 B12R1.267 CSCNCc1nnccc1C e075bb67c751f00b2c7fbd9f80052cc8 [0,1,0,0,0,0|3,0,0]=4 4013 B12R1.267 CSCOCc1ccccc1Cl 1d5a9e1fa52b8915eeebbb38cbfdb556 [0,1,0,0,0,0|3,0,0]=4 4014 B12R1.267 CSCOCc1ccccc1F 4038eb8093f67e51c2eb76b0108c4e61 [0,1,0,0,0,0|3,0,0]=4 4015 B12R1.267 CSCOCc1ccccc1I b3c3bb5963de95894f4aab5be38b7580 [0,1,0,0,0,0|3,0,0]=4 4016 B12R1.267 CSCOCc1ncccc1Br 0b6341eac80e26ac66f45107c4e568a3 [0,1,0,0,0,0|2,0,0]=3 4017 B12R1.267 CSCOCc1ncccc1C 2e4743f86e8cb312b0b1b27d4442304e [0,1,0,0,0,0|2,0,0]=3 4018 B12R1.267 CSCOCc1ncccc1Cl 5799d4128190aaeed21af13f31e6cacc [0,1,0,0,0,0|2,0,0]=3 4019 B12R1.267 CSCOCc1ncccc1F 49311f4bad0a7ccb3fa802ea0692eea3 [0,1,0,0,0,0|2,0,0]=3 4020 B12R1.267 CSCOCc1nccnc1C 045e2ae901e674148ea118e3fd23a55c [0,1,0,0,0,0|3,0,0]=4 4021 B12R1.267 CSCOCc1nccnc1Cl 689cc4d4a102fc02626ce36fdbad8f15 [0,1,0,0,0,0|3,0,0]=4 4022 B12R1.267 CSCOCc1ncncc1Br 8e3580c9a9a823cfe398ed1b390fc4b9 [0,1,0,0,0,0|3,0,0]=4 4023 B12R1.267 CSCOCc1nnccc1C 264c307a9ec1cc833b0eff6df191fd1f [0,1,0,0,0,0|3,0,0]=4 4024 B12R1.267 Cc1ccccc1CCOCF 25f7145d6fc74add80093b665dc4393f [0,1,0,0,0,0|3,0,0]=4 4025 B12R1.267 Cc1ccccc1CNCCBr f77310b29a912c999237b2739aa1210c [0,1,0,0,0,0|3,0,0]=4 4026 B12R1.267 Cc1ccccc1CNCCF 2098ce6c3ac26037f1429812f234d51f [0,1,0,0,0,0|3,0,0]=4 4027 B12R1.267 Cc1ccccc1CNCCI fc22bac86bb7aed276187f2f15c5f39c [0,1,0,0,0,0|3,0,0]=4 4028 B12R1.267 Cc1ccccc1CNCCO 91e2522e5fd17c1e59cb7a4547ef3a2a [0,1,0,0,0,0|3,0,0]=4 4029 B12R1.267 Cc1ccccc1CNCCS 518bc80a508cefc73ae1e4b1db664c64 [0,1,0,0,0,0|3,0,0]=4 4030 B12R1.267 Cc1ccccc1COCCF b62a57d7c0fa269c712aedbbb80a9625 [0,1,0,0,0,0|3,0,0]=4 4031 B12R1.267 Cc1ccccc1COCCS aef395cc1a408662a0ccc964cffa43b5 [0,1,0,0,0,0|3,0,0]=4 4032 B12R1.267 Cc1ccccc1NCCCCl 3f07cd3fee639e67367fcbefe2480469 [0,1,0,0,0,0|3,0,0]=4 4033 B12R1.267 Cc1ccccc1NCCCF cd187669e045c403fa041057668289e1 [0,1,0,0,0,0|3,0,0]=4 4034 B12R1.267 Cc1ccccc1NCCCO 5cbc6801488d8693795187d1801221e4 [0,1,0,0,0,0|3,0,0]=4 4035 B12R1.267 Cc1ccccc1NCCCS 775c2d60048baf56f754562db9cc458f [0,1,0,0,0,0|3,0,0]=4 4036 B12R1.267 Cc1ccccc1OCCCF 17ac468fc98fd39c18bafba1086884be [0,1,0,0,0,0|3,0,0]=4 4037 B12R1.267 Cc1ccccc1OCCCS 6c40726109b118213fac4182f37514c3 [0,1,0,0,0,0|3,0,0]=4 4038 B12R1.267 Cc1cccnc1CCNC=O daae9eebeef1b0efb4c45be0ca0aada8 [0,1,0,0,0,0|2,0,1]=4 4039 B12R1.267 Cc1cccnc1CCNCF eb0717bd4d5ea35d5647008effe15b74 [0,1,0,0,0,0|2,0,0]=3 4040 B12R1.267 Cc1cccnc1CCNCO e253839bc633e5edad49b49eda83a513 [0,1,0,0,0,0|2,0,0]=3 4041 B12R1.267 Cc1cccnc1CCOCF f6173b8916a000e8b7a7bd5b839c7c93 [0,1,0,0,0,0|2,0,0]=3 4042 B12R1.267 Cc1cccnc1CNCC#N cc55c319d24caaa9cd460089e8eefe02 [0,1,0,0,0,0|2,0,1]=4 4043 B12R1.267 Cc1cccnc1CNCC=O f39580ed7fd7333174cf217972b2d53e [0,1,0,0,0,0|2,0,1]=4 4044 B12R1.267 Cc1cccnc1CNCCBr b35b37042e8a1c6a5f9352bc6634afd1 [0,1,0,0,0,0|2,0,0]=3 4045 B12R1.267 Cc1cccnc1CNCCF 11fe506df7edc498f1e18a83f96b32db [0,1,0,0,0,0|2,0,0]=3 4046 B12R1.267 Cc1cccnc1CNCCI 76a7e206f096266587d5090036a38428 [0,1,0,0,0,0|2,0,0]=3 4047 B12R1.267 Cc1cccnc1CNCCO f4a4a15e15a497604f0f30e1f7591ae6 [0,1,0,0,0,0|2,0,0]=3 4048 B12R1.267 Cc1cccnc1CNCCS 23d97bd7ae67cebc44af2f509c49226f [0,1,0,0,0,0|2,0,0]=3 4049 B12R1.267 Cc1cccnc1COCC#N 5b708c6cac91bc6bddbc4efdb13ab957 [0,1,0,0,0,0|2,0,1]=4 4050 B12R1.267 Cc1cccnc1COCC=O eee49a5a4e43c25df40965b64a99876d [0,1,0,0,0,0|2,0,1]=4 4051 B12R1.267 Cc1cccnc1COCCF 3611952ab6ea8221a19acd11bca6ab76 [0,1,0,0,0,0|2,0,0]=3 4052 B12R1.267 Cc1cccnc1COCCS bcd24748e7f4e18eab1f2dd789fa3cbb [0,1,0,0,0,0|2,0,0]=3 4053 B12R1.267 Cc1cccnc1NCCC#N 2445027320f29b528babf729a13e7138 [0,1,0,0,0,0|2,0,1]=4 4054 B12R1.267 Cc1cccnc1NCCC=O 503c1b203bdd1e1e8b55677d0babdd81 [0,1,0,0,0,0|2,0,1]=4 4055 B12R1.267 Cc1cccnc1NCCCCl de0193500aa7dbc92eadd43b1fe66c31 [0,1,0,0,0,0|2,0,0]=3 4056 B12R1.267 Cc1cccnc1NCCCF 12d0d996cc67c4c4ac53b08baace4e71 [0,1,0,0,0,0|2,0,0]=3 4057 B12R1.267 Cc1cccnc1NCCCO 15026fb416ff943623d07e1c8c3b34ad [0,1,0,0,0,0|2,0,0]=3 4058 B12R1.267 Cc1cccnc1NCCCS 324901d4c81096901abfb6b8bd89358a [0,1,0,0,0,0|2,0,0]=3 4059 B12R1.267 Cc1cccnc1NCCON 867993fcfdcdfbc736b8074894ac84d1 [0,1,0,0,0,0|3,0,0]=4 4060 B12R1.267 Cc1cccnc1OCCC#N 2c7ce1de6015c84aafa1111bc66e4f33 [0,1,0,0,0,0|2,0,1]=4 4061 B12R1.267 Cc1cccnc1OCCC=O cf230bbbe58e6e51aa4bcca9ae55a797 [0,1,0,0,0,0|2,0,1]=4 4062 B12R1.267 Cc1cccnc1OCCCF 5b7ddc4f0cd439ce108ebf48fd40b2d8 [0,1,0,0,0,0|2,0,0]=3 4063 B12R1.267 Cc1cccnc1OCCCS 43ddf9f0294cde1bac9fe1c980368a18 [0,1,0,0,0,0|2,0,0]=3 4064 B12R1.267 Cc1ccnnc1CNCCF a9d6b68e9a2ec3ab01a0619a2baadc1f [0,1,0,0,0,0|3,0,0]=4 4065 B12R1.267 Cc1ccnnc1CNCCO 64827c9636bbec17c898ef82ac5d17e0 [0,1,0,0,0,0|3,0,0]=4 4066 B12R1.267 Cc1ccnnc1CNCCS 39c01e385c3ec3165859e8a8bee0e3cb [0,1,0,0,0,0|3,0,0]=4 4067 B12R1.267 Cc1ccnnc1COCCF 0ccdbac2378e6e1b797832ffb4d5bbbf [0,1,0,0,0,0|3,0,0]=4 4068 B12R1.267 Cc1ccnnc1COCCS f2a0b9b903176438e75f88e0fb5c6f25 [0,1,0,0,0,0|3,0,0]=4 4069 B12R1.267 Cc1ccnnc1NCCCF ab5b01e57f8a043d9c32146797a2e3b9 [0,1,0,0,0,0|3,0,0]=4 4070 B12R1.267 Cc1ccnnc1NCCCO 205a612ffcd77b8904f4a629d47fdb33 [0,1,0,0,0,0|3,0,0]=4 4071 B12R1.267 Cc1ccnnc1NCCCS 58dcab2b8df367bf850e910daa38537a [0,1,0,0,0,0|3,0,0]=4 4072 B12R1.267 Cc1ccnnc1OCCCF fc21cfd15f759b01dd7ca3077a5818c3 [0,1,0,0,0,0|3,0,0]=4 4073 B12R1.267 Cc1ccnnc1OCCCS 35c62cc603b1042544545b84280faeb0 [0,1,0,0,0,0|3,0,0]=4 4074 B12R1.267 Cc1cncnc1NCCCF 34219430af88ace9de259ec4860b35c9 [0,1,0,0,0,0|3,0,0]=4 4075 B12R1.267 Cc1cncnc1NCCCO d8156a5c2cc490d43f0fbc78c50c9a73 [0,1,0,0,0,0|3,0,0]=4 4076 B12R1.267 Cc1cncnc1NCCCS f7269845592d3fae2b73eb7eacb1d999 [0,1,0,0,0,0|3,0,0]=4 4077 B12R1.267 Cc1cncnc1OCCCF daa9194aeb93096c9f44358dcad4de68 [0,1,0,0,0,0|3,0,0]=4 4078 B12R1.267 Cc1cncnc1OCCCS 1fd7cc24078a0eb8565fe122945ca3bc [0,1,0,0,0,0|3,0,0]=4 4079 B12R1.267 Cc1nccnc1CCOCF b49884bec985e13fa89cef7da0dbd386 [0,1,0,0,0,0|3,0,0]=4 4080 B12R1.267 Cc1nccnc1CNCCBr ce89332b42ec7ff80314f267352b1a44 [0,1,0,0,0,0|3,0,0]=4 4081 B12R1.267 Cc1nccnc1CNCCF 6acddec3c1ca87e32ca3ccf1cd137335 [0,1,0,0,0,0|3,0,0]=4 4082 B12R1.267 Cc1nccnc1CNCCI cca65e50128be4d0256f45e955e5663f [0,1,0,0,0,0|3,0,0]=4 4083 B12R1.267 Cc1nccnc1CNCCO cd8c0724a8a01ef46ae01793a8454746 [0,1,0,0,0,0|3,0,0]=4 4084 B12R1.267 Cc1nccnc1CNCCS 08980fc7e36248f2dc207035d3f980a2 [0,1,0,0,0,0|3,0,0]=4 4085 B12R1.267 Cc1nccnc1COCCF 9d54f2545d2208e1a3e0de796a6eea67 [0,1,0,0,0,0|3,0,0]=4 4086 B12R1.267 Cc1nccnc1COCCS c975a823607bf999dfc7c957b8fb6339 [0,1,0,0,0,0|3,0,0]=4 4087 B12R1.267 Cc1nccnc1NCCCF 576d3669071c864e67737469ba01a27e [0,1,0,0,0,0|3,0,0]=4 4088 B12R1.267 Cc1nccnc1NCCCO 73ddaee80c6babf167d9427504b9802c [0,1,0,0,0,0|3,0,0]=4 4089 B12R1.267 Cc1nccnc1NCCCS 7ed10fdc12e39280aa1cf12b357f9162 [0,1,0,0,0,0|3,0,0]=4 4090 B12R1.267 Cc1nccnc1OCCCF c3a3cc011849a68c630ad96b935848e0 [0,1,0,0,0,0|3,0,0]=4 4091 B12R1.267 Cc1nccnc1OCCCS 65e44198242a15cab46e679150242de4 [0,1,0,0,0,0|3,0,0]=4 4092 B12R1.267 Clc1ccccc1CNCCBr 9b09944bc517f8abdc4e72ad121b2a36 [0,1,0,0,0,0|3,0,0]=4 4093 B12R1.267 Clc1ccccc1CNCCI c20f3a099731b307fa4ff0374c509584 [0,1,0,0,0,0|3,0,0]=4 4094 B12R1.267 Clc1cccnc1CNCCBr a2b61f32566a12efabeb3b206ef6f610 [0,1,0,0,0,0|2,0,0]=3 4095 B12R1.267 Clc1cccnc1CNCCI b604a2c1e007997d9f18d404d1cc5f6e [0,1,0,0,0,0|2,0,0]=3 4096 B12R1.267 Clc1nccnc1CNCCBr 53d8923fc8d38207d2874840051e73ed [0,1,0,0,0,0|3,0,0]=4 4097 B12R1.267 Clc1nccnc1CNCCI 3bb0d25938bf6722edc328e536f55e9e [0,1,0,0,0,0|3,0,0]=4 4098 B12R1.267 FCCCNc1ccccc1Cl 17fac0f3c0fe16e84554f273210a739d [0,1,0,0,0,0|3,0,0]=4 4099 B12R1.267 FCCCNc1ccccc1F bebe212963a66c49720b2be585ecd4c7 [0,1,0,0,0,0|3,0,0]=4 4100 B12R1.267 FCCCNc1ccccc1I a7a4a61d30d1fccf35b205460629f6d9 [0,1,0,0,0,0|3,0,0]=4 4101 B12R1.267 FCCCNc1ccccc1S 1fc063029a53aaa93c66ffdbd6720722 [0,1,0,0,0,0|3,0,0]=4 4102 B12R1.267 FCCCNc1ncccc1Br 6933b125fcfcc8bac7df4bcb120f6bf7 [0,1,0,0,0,0|2,0,0]=3 4103 B12R1.267 FCCCNc1ncccc1Cl dd792ed4ab2f78e8350d8f36f1637875 [0,1,0,0,0,0|2,0,0]=3 4104 B12R1.267 FCCCNc1ncccc1F 0305dfb0c3b0f85513c1c255bd6471f2 [0,1,0,0,0,0|2,0,0]=3 4105 B12R1.267 FCCCNc1ncccc1I 23a255056a8c0d1fd5278d8a1a36c5c7 [0,1,0,0,0,0|2,0,0]=3 4106 B12R1.267 FCCCNc1nccnc1Br 725c7953785f5d95d37039e317b14d6a [0,1,0,0,0,0|3,0,0]=4 4107 B12R1.267 FCCCNc1nccnc1Cl 56d31132fda42f9c550fa4fb23e76ff0 [0,1,0,0,0,0|3,0,0]=4 4108 B12R1.267 FCCCNc1nccnc1I 0146739a573d21f2ac0f280e2ffc2368 [0,1,0,0,0,0|3,0,0]=4 4109 B12R1.267 FCCCNc1ncncc1Br c3563d14ee44ca08703969624d8d133a [0,1,0,0,0,0|3,0,0]=4 4110 B12R1.267 FCCCNc1ncncc1Cl ca0b0cf9d6a7fa981c66e4ea2947997a [0,1,0,0,0,0|3,0,0]=4 4111 B12R1.267 FCCCNc1ncncc1F 47ece4de0f046d919b83aafd4bf70ce4 [0,1,0,0,0,0|3,0,0]=4 4112 B12R1.267 FCCCNc1ncncc1I a9478d797dd757054e46cbbba0cd0596 [0,1,0,0,0,0|3,0,0]=4 4113 B12R1.267 FCCCOc1ccccc1Br 499e528be31647c2767a23de412a6892 [0,1,0,0,0,0|3,0,0]=4 4114 B12R1.267 FCCCOc1ccccc1Cl df2e97234eeec5aa9e2bf4aa8d930954 [0,1,0,0,0,0|3,0,0]=4 4115 B12R1.267 FCCCOc1ccccc1F 8aac8d2dd21b9c25c2bae9285eb00f79 [0,1,0,0,0,0|3,0,0]=4 4116 B12R1.267 FCCCOc1ccccc1I 4324cc6c6ddc07e001929c58a563257a [0,1,0,0,0,0|3,0,0]=4 4117 B12R1.267 FCCCOc1ccccc1S 33bc119b6d4654961a63ead32803fa79 [0,1,0,0,0,0|3,0,0]=4 4118 B12R1.267 FCCCOc1ncccc1Br 08f7087c8a0295eb23572fcc0af96740 [0,1,0,0,0,0|2,0,0]=3 4119 B12R1.267 FCCCOc1ncccc1Cl afb1aba101f332eaac84729cc869c53b [0,1,0,0,0,0|2,0,0]=3 4120 B12R1.267 FCCCOc1ncccc1F 2fca701423a901b718c3e88656f205fe [0,1,0,0,0,0|2,0,0]=3 4121 B12R1.267 FCCCOc1nccnc1Br 18ce62479df70e9cfe01d792296cd283 [0,1,0,0,0,0|3,0,0]=4 4122 B12R1.267 FCCCOc1ncncc1Cl 23fefa108be448caa81cf83e78764196 [0,1,0,0,0,0|3,0,0]=4 4123 B12R1.267 FCCCOc1ncncc1F 0326147f7d6d40d4782d7bacbcb63e6a [0,1,0,0,0,0|3,0,0]=4 4124 B12R1.267 FCCCOc1ncncc1I 8e400290367f70c55997cfdd35046a4b [0,1,0,0,0,0|3,0,0]=4 4125 B12R1.267 FCCCOc1nnccc1Cl eb5b296a81ef63a81ec6f69e51d1037e [0,1,0,0,0,0|3,0,0]=4 4126 B12R1.267 FCCCOc1nnccc1I 933f498df524df14d8c2224a7bd63f28 [0,1,0,0,0,0|3,0,0]=4 4127 B12R1.267 FCCNCc1ccccc1Br b46fdf31e33910710dd483a85d89d96f [0,1,0,0,0,0|3,0,0]=4 4128 B12R1.267 FCCNCc1ccccc1Cl a14087dde8b7b46255adcf5a803afdbc [0,1,0,0,0,0|3,0,0]=4 4129 B12R1.267 FCCNCc1ccccc1F f832ea6ba744d5ab65af659cd2552ce3 [0,1,0,0,0,0|3,0,0]=4 4130 B12R1.267 FCCNCc1ccccc1I eed8b10184147070559f785fa901c222 [0,1,0,0,0,0|3,0,0]=4 4131 B12R1.267 FCCNCc1ncccc1Br aee4b617813d242428fb0d37da5c1580 [0,1,0,0,0,0|2,0,0]=3 4132 B12R1.267 FCCNCc1ncccc1Cl 0e0f185c31f1835b559d8dc45f71f8a2 [0,1,0,0,0,0|2,0,0]=3 4133 B12R1.267 FCCNCc1ncccc1F e46ff01e14e6bd5968ba1a73a4e8b552 [0,1,0,0,0,0|2,0,0]=3 4134 B12R1.267 FCCNCc1nccnc1Cl c8ec06c3cadc54d5eca1f4e18be10426 [0,1,0,0,0,0|3,0,0]=4 4135 B12R1.267 FCCOCc1ccccc1Br 5a0928a171083f8638f03aacb9dc36dd [0,1,0,0,0,0|3,0,0]=4 4136 B12R1.267 FCCOCc1ccccc1Cl 078ea64bbef33ece9aff7dddc04601a6 [0,1,0,0,0,0|3,0,0]=4 4137 B12R1.267 FCCOCc1ccccc1F 87862c8ddec2c3ff0ce1d65429b7e84b [0,1,0,0,0,0|3,0,0]=4 4138 B12R1.267 FCCOCc1ccccc1I 289e82c65c96603401598d70743f8a2e [0,1,0,0,0,0|3,0,0]=4 4139 B12R1.267 FCCOCc1ncccc1Br abaee447884cc8640177e3face4e4d98 [0,1,0,0,0,0|2,0,0]=3 4140 B12R1.267 FCCOCc1ncccc1Cl 7e1dc05646a8686c91c16a4a31b5d3fb [0,1,0,0,0,0|2,0,0]=3 4141 B12R1.267 FCCOCc1ncccc1F ea3e61613f13d7436889a4020f03984e [0,1,0,0,0,0|2,0,0]=3 4142 B12R1.267 FCCOCc1nccnc1Cl a254a2d40d1239118a54497ec3f4fd42 [0,1,0,0,0,0|3,0,0]=4 4143 B12R1.267 FCCOCc1ncncc1Br c018873bfb3b46a543b9a39668042251 [0,1,0,0,0,0|3,0,0]=4 4144 B12R1.267 FCNCCc1ccccc1Cl 2b7cd31ed4a3052fcd0d18714236530d [0,1,0,0,0,0|3,0,0]=4 4145 B12R1.267 FCNCCc1ccccc1F 6a44669825c83fc6e919b2f10fd8c7d2 [0,1,0,0,0,0|3,0,0]=4 4146 B12R1.267 FCNCCc1ncccc1Br b8dab67bc218450916f84b88f0223845 [0,1,0,0,0,0|2,0,0]=3 4147 B12R1.267 FCOCCc1ccccc1Br 574267660b831959d0794f82b5ef5850 [0,1,0,0,0,0|3,0,0]=4 4148 B12R1.267 FCOCCc1ccccc1Cl 7ea8671364534b09f9e85fd52379f60c [0,1,0,0,0,0|3,0,0]=4 4149 B12R1.267 FCOCCc1ccccc1F 05e5363269f95ae13cad094391096216 [0,1,0,0,0,0|3,0,0]=4 4150 B12R1.267 FCOCCc1ccccc1I 39aabe4ca087b7967fe2111450ba8931 [0,1,0,0,0,0|3,0,0]=4 4151 B12R1.267 FCOCCc1ncccc1F 70e197110844d94f450c9830d53c2c8b [0,1,0,0,0,0|2,0,0]=3 4152 B12R1.267 Fc1ccccc1CNCCBr b7656da594f64afd8a0d67c46781013a [0,1,0,0,0,0|3,0,0]=4 4153 B12R1.267 Fc1ccccc1CNCCI 460bdcbe7f8be048b77e48771c7dd795 [0,1,0,0,0,0|3,0,0]=4 4154 B12R1.267 Fc1ccccc1CNCCS 9654adc193d5f5d14b8b59c65d5b6a3e [0,1,0,0,0,0|3,0,0]=4 4155 B12R1.267 Fc1ccccc1COCCS 22e124a097dce78e916c7bb33db1d360 [0,1,0,0,0,0|3,0,0]=4 4156 B12R1.267 Fc1ccccc1NCCCCl f878bc210a65cbd4c20ec398956dcb58 [0,1,0,0,0,0|3,0,0]=4 4157 B12R1.267 Fc1ccccc1NCCCS 53267566d7f94c139dfab3268962ea80 [0,1,0,0,0,0|3,0,0]=4 4158 B12R1.267 Fc1ccccc1OCCCS 2546371899f430f36ee407a65eb19906 [0,1,0,0,0,0|3,0,0]=4 4159 B12R1.267 Fc1cccnc1CNCCBr a574c30353d46c5154bcc9fde2b7c871 [0,1,0,0,0,0|2,0,0]=3 4160 B12R1.267 Fc1cccnc1CNCCI 29af43562fd4963df5ee81e7ef10a1ea [0,1,0,0,0,0|2,0,0]=3 4161 B12R1.267 Fc1cccnc1CNCCS ed772c7fecd1899bd56d28c76a1ea288 [0,1,0,0,0,0|2,0,0]=3 4162 B12R1.267 Fc1cccnc1COCCS 4f771f7ff64daf1e05a7d0e12fa376b1 [0,1,0,0,0,0|2,0,0]=3 4163 B12R1.267 Fc1cccnc1NCCCS d7a124f3c44cf0084fd88157afd497dd [0,1,0,0,0,0|2,0,0]=3 4164 B12R1.267 Fc1cccnc1OCCCS 967b0cbab34640876a1cfe86707feebb [0,1,0,0,0,0|2,0,0]=3 4165 B12R1.267 Fc1cncnc1NCCCS 109ea32fb8ee3b76ac864f74e58e0fea [0,1,0,0,0,0|3,0,0]=4 4166 B12R1.267 Fc1cncnc1OCCCS 7a1cc06687cb4ecc5ad1c566746d5ad2 [0,1,0,0,0,0|3,0,0]=4 4167 B12R1.267 Fc1nccnc1NCCCCl 4539cc64ec9284430ea1d318f5070ce7 [0,1,0,0,0,0|3,0,0]=4 4168 B12R1.267 ICCNCc1ccccc1I 6524a5da724df7a531f281468be2fcd1 [0,1,0,0,0,0|3,0,0]=4 4169 B12R1.267 N#CCCNc1ncccc1Br d12ec65d1cff7c4669f46a229f2e48fe [0,1,0,0,0,0|2,0,1]=4 4170 B12R1.267 N#CCCNc1ncccc1Cl 81466684a45caaeecb5bc1b08649c79e [0,1,0,0,0,0|2,0,1]=4 4171 B12R1.267 N#CCCNc1ncccc1F 94057a6642937cf7c68e54065caf8e19 [0,1,0,0,0,0|2,0,1]=4 4172 B12R1.267 N#CCCNc1ncccc1I 6b6cf2e0d63fe45473565e23d4f612bd [0,1,0,0,0,0|2,0,1]=4 4173 B12R1.267 N#CCCOc1ncccc1Br b662e3d07e234ba2afab9306f7dd94b1 [0,1,0,0,0,0|2,0,1]=4 4174 B12R1.267 N#CCCOc1ncccc1Cl dfdae11f00c3bc7f6c2ef452d3f71057 [0,1,0,0,0,0|2,0,1]=4 4175 B12R1.267 N#CCCOc1ncccc1F 89059749facf4c07c48af475c6e0dd36 [0,1,0,0,0,0|2,0,1]=4 4176 B12R1.267 N#CCNCc1ncccc1Br c8ce51ef9f4c2add3e605fa87bb42365 [0,1,0,0,0,0|2,0,1]=4 4177 B12R1.267 N#CCNCc1ncccc1Cl 95ac8f0ad9dc8bef1f33fe3c618eda30 [0,1,0,0,0,0|2,0,1]=4 4178 B12R1.267 N#CCNCc1ncccc1F dc9229bb29502f6069ba23f695d05da1 [0,1,0,0,0,0|2,0,1]=4 4179 B12R1.267 N#CCOCc1ncccc1Br d53776818ded09f00b8c2763e5cb004c [0,1,0,0,0,0|2,0,1]=4 4180 B12R1.267 N#CCOCc1ncccc1Cl 070a330241569fd55335f259bac9834d [0,1,0,0,0,0|2,0,1]=4 4181 B12R1.267 N#CCOCc1ncccc1F ff5e01a8844501cc9cbd8858b61b7e61 [0,1,0,0,0,0|2,0,1]=4 4182 B12R1.267 NOCCNc1ncccc1F e249a9c0f198799b818da684a0fcbb0a [0,1,0,0,0,0|3,0,0]=4 4183 B12R1.267 NOCCNc1ncccc1O fdd52441379aeb4614a470e957c2898d [0,1,0,0,0,0|3,0,0]=4 4184 B12R1.267 O=CCCNc1ncccc1Br b5379ac23649dc0551f8a7aa2e8f2aff [0,1,0,0,0,0|2,0,1]=4 4185 B12R1.267 O=CCCNc1ncccc1Cl 9f683d7d5d9daa359ea8eb665f9d609f [0,1,0,0,0,0|2,0,1]=4 4186 B12R1.267 O=CCCNc1ncccc1F 03f416d02f75e6f1d053ab8e50406255 [0,1,0,0,0,0|2,0,1]=4 4187 B12R1.267 O=CCCNc1ncccc1I a1ee3ce097146a0be621021a11438e6c [0,1,0,0,0,0|2,0,1]=4 4188 B12R1.267 O=CCCOc1ncccc1Br 420f7fe568d2db6a98c9e527f56d4cba [0,1,0,0,0,0|2,0,1]=4 4189 B12R1.267 O=CCCOc1ncccc1Cl edba0d87db4232bc8e4b507fc2d95062 [0,1,0,0,0,0|2,0,1]=4 4190 B12R1.267 O=CCCOc1ncccc1F d4c05a68237d443d088955e48d1c86ad [0,1,0,0,0,0|2,0,1]=4 4191 B12R1.267 O=CCNCc1ncccc1Br 25f9613681794a5bb4e65926439c63cc [0,1,0,0,0,0|2,0,1]=4 4192 B12R1.267 O=CCNCc1ncccc1Cl c210aabbcdd49996623348e93964b990 [0,1,0,0,0,0|2,0,1]=4 4193 B12R1.267 O=CCNCc1ncccc1F 3c2e74757f7a00154174ba177f81317c [0,1,0,0,0,0|2,0,1]=4 4194 B12R1.267 O=CCOCc1ncccc1Br b43fef572027ecc69d535403710e9be0 [0,1,0,0,0,0|2,0,1]=4 4195 B12R1.267 O=CCOCc1ncccc1Cl bf1b810205905fcb1d465269f539dee2 [0,1,0,0,0,0|2,0,1]=4 4196 B12R1.267 O=CCOCc1ncccc1F beeb9217f9e52a2303edf2ea809ab210 [0,1,0,0,0,0|2,0,1]=4 4197 B12R1.267 O=CNCCc1ncccc1Br 2a130afb3b2e86d975c783be8608dbcb [0,1,0,0,0,0|2,0,1]=4 4198 B12R1.267 O=c1[nH]ccnc1NCCCCl f66423e20d87efeb0ffdf1f6e8d0257a [0,1,0,0,0,0|3,0,0]=4 4199 B12R1.267 O=c1[nH]ccnc1NCCCO 8db8090b86ef955442ada68e5c310902 [0,1,0,0,0,0|3,0,0]=4 4200 B12R1.267 O=c1cccnn1CCNCF c24f87ae890cf55d820097b01d17f69a [0,1,0,0,0,0|3,0,0]=4 4201 B12R1.267 O=c1cccnn1CCNCO ad87f2afbbbfa9d48ac3c35425d060f7 [0,1,0,0,0,0|3,0,0]=4 4202 B12R1.267 OCCCNc1ccccc1Cl 784289199eb1f667fd138e273b3055b8 [0,1,0,0,0,0|3,0,0]=4 4203 B12R1.267 OCCCNc1ccccc1F dfcb9423e658f0892e1b586f7749e7a5 [0,1,0,0,0,0|3,0,0]=4 4204 B12R1.267 OCCCNc1ccccc1I 9885e0c34ab73fc7eab6f3f5b8cd97c3 [0,1,0,0,0,0|3,0,0]=4 4205 B12R1.267 OCCCNc1ccccc1S 4466a2e5214efe662657c1ef38d6a56d [0,1,0,0,0,0|3,0,0]=4 4206 B12R1.267 OCCCNc1ncccc1Br 097a3dee41eb69f606932e77cbc55cdf [0,1,0,0,0,0|2,0,0]=3 4207 B12R1.267 OCCCNc1ncccc1Cl d20ca6b2bfb48221ba5522aaee8f5fe6 [0,1,0,0,0,0|2,0,0]=3 4208 B12R1.267 OCCCNc1ncccc1F 01c984d483b12222577d26fa58910e26 [0,1,0,0,0,0|2,0,0]=3 4209 B12R1.267 OCCCNc1ncccc1I 4353255d4918cdcf03387d89d6534545 [0,1,0,0,0,0|2,0,0]=3 4210 B12R1.267 OCCCNc1nccnc1Br 96ca096c98b62ee6db8239c2abf09e76 [0,1,0,0,0,0|3,0,0]=4 4211 B12R1.267 OCCCNc1nccnc1Cl 5e80d9c3b8ccda20c2a3cb8c07db313f [0,1,0,0,0,0|3,0,0]=4 4212 B12R1.267 OCCCNc1nccnc1I 56e623591e1a08ec0ab269d701dc58dd [0,1,0,0,0,0|3,0,0]=4 4213 B12R1.267 OCCCNc1ncncc1Br 567cfb2a0af899140d576aa7512429ba [0,1,0,0,0,0|3,0,0]=4 4214 B12R1.267 OCCCNc1ncncc1Cl 532c8c8f4c20f6f3c5892294e9bfdf84 [0,1,0,0,0,0|3,0,0]=4 4215 B12R1.267 OCCCNc1ncncc1F b60d35f919fdb3bd5226d13a4b379a3f [0,1,0,0,0,0|3,0,0]=4 4216 B12R1.267 OCCCNc1ncncc1I c5a633230976dd16c3930b6553b67946 [0,1,0,0,0,0|3,0,0]=4 4217 B12R1.267 OCCNCc1ccccc1Br df94d6734ac0f560fb360e39dd4b947e [0,1,0,0,0,0|3,0,0]=4 4218 B12R1.267 OCCNCc1ccccc1Cl 3a5befb779e389def207bf8ccccf3eb8 [0,1,0,0,0,0|3,0,0]=4 4219 B12R1.267 OCCNCc1ccccc1F ed939a7a48266a2f41cc5e4f1e741af5 [0,1,0,0,0,0|3,0,0]=4 4220 B12R1.267 OCCNCc1ccccc1I ae82480090df47b9736b4a586b9e66c7 [0,1,0,0,0,0|3,0,0]=4 4221 B12R1.267 OCCNCc1ncccc1Br ae3b0296303be2e379469943dd2487bc [0,1,0,0,0,0|2,0,0]=3 4222 B12R1.267 OCCNCc1ncccc1Cl d4b0e166193d8ae34a0e8a3cf74cca46 [0,1,0,0,0,0|2,0,0]=3 4223 B12R1.267 OCCNCc1ncccc1F 663ee241eee75f5ec918f63f4754b803 [0,1,0,0,0,0|2,0,0]=3 4224 B12R1.267 OCCNCc1nccnc1Cl 407884e1019b5fa834e908bd482dd6bb [0,1,0,0,0,0|3,0,0]=4 4225 B12R1.267 OCNCCc1ccccc1Cl 1b84a7a1568849a05b57068c3918906a [0,1,0,0,0,0|3,0,0]=4 4226 B12R1.267 OCNCCc1ccccc1F eb3b5d5f729061dd7d0426963bb11f7c [0,1,0,0,0,0|3,0,0]=4 4227 B12R1.267 OCNCCc1ncccc1Br 59d846cc0f6b983c7c08f6cd4a4433e7 [0,1,0,0,0,0|2,0,0]=3 4228 B12R1.267 SCCCNc1ccccc1Cl c4d03ceb3e538981668d71a7bfd8cbed [0,1,0,0,0,0|3,0,0]=4 4229 B12R1.267 SCCCNc1ccccc1I 88fd34af4dafde9f681eefa4032b9ba4 [0,1,0,0,0,0|3,0,0]=4 4230 B12R1.267 SCCCNc1ccccc1S 8761170f9c7958779f9ac8b8fa337365 [0,1,0,0,0,0|3,0,0]=4 4231 B12R1.267 SCCCNc1ncccc1Br 4338c7ac93231741725f31dd53303e40 [0,1,0,0,0,0|2,0,0]=3 4232 B12R1.267 SCCCNc1ncccc1Cl 037a3d5df7c6d43d112396d6013c1416 [0,1,0,0,0,0|2,0,0]=3 4233 B12R1.267 SCCCNc1ncccc1I 6068952df131723a88558b7cdd621f9b [0,1,0,0,0,0|2,0,0]=3 4234 B12R1.267 SCCCNc1nccnc1Br 8c7764a458cbb1d49640ed2734c39076 [0,1,0,0,0,0|3,0,0]=4 4235 B12R1.267 SCCCNc1nccnc1Cl b56d4090db1e6eff6c58b7ce30844293 [0,1,0,0,0,0|3,0,0]=4 4236 B12R1.267 SCCCNc1nccnc1I e949f63b7a086d81afd2e3c18e73e2f9 [0,1,0,0,0,0|3,0,0]=4 4237 B12R1.267 SCCCNc1ncncc1Br f630508ae0bccc0ff135e878a17caefe [0,1,0,0,0,0|3,0,0]=4 4238 B12R1.267 SCCCNc1ncncc1Cl 3ad87b86559773e0da3887faf8327fc3 [0,1,0,0,0,0|3,0,0]=4 4239 B12R1.267 SCCCNc1ncncc1I a60e293e0fe158895fb753895686be7d [0,1,0,0,0,0|3,0,0]=4 4240 B12R1.267 SCCCOc1ccccc1Cl 35ae5ef6c1318a24833cc2707ca373c3 [0,1,0,0,0,0|3,0,0]=4 4241 B12R1.267 SCCCOc1ncccc1Br 36ef6117b255ffe46aaa5cea561d021b [0,1,0,0,0,0|2,0,0]=3 4242 B12R1.267 SCCCOc1ncccc1Cl 4050597f8e712a705f56473c68c97c13 [0,1,0,0,0,0|2,0,0]=3 4243 B12R1.267 SCCCOc1nccnc1Br 439cb4295c523d413faf736d94407901 [0,1,0,0,0,0|3,0,0]=4 4244 B12R1.267 SCCCOc1ncncc1Cl 244a6773886ce929594f5dd0b1c7b829 [0,1,0,0,0,0|3,0,0]=4 4245 B12R1.267 SCCCOc1ncncc1I 5360d72c0b11764f46ac59792fdf84fa [0,1,0,0,0,0|3,0,0]=4 4246 B12R1.267 SCCCOc1nnccc1Cl 6a399a85a50517d7dc935adf2f5f9f0f [0,1,0,0,0,0|3,0,0]=4 4247 B12R1.267 SCCCOc1nnccc1I 5ade00d3896b619570b47ff9ed777897 [0,1,0,0,0,0|3,0,0]=4 4248 B12R1.267 SCCNCc1ccccc1Br b8209633972813bf1bc7220008967dbd [0,1,0,0,0,0|3,0,0]=4 4249 B12R1.267 SCCNCc1ccccc1Cl ebf258e1c42f497575777369ac95da5f [0,1,0,0,0,0|3,0,0]=4 4250 B12R1.267 SCCNCc1ccccc1I 92d0326fdb78bab0b559a53a956bdcbc [0,1,0,0,0,0|3,0,0]=4 4251 B12R1.267 SCCNCc1ncccc1Br 8a99e089751d61ffeba7641e8730f51c [0,1,0,0,0,0|2,0,0]=3 4252 B12R1.267 SCCNCc1ncccc1Cl 2028135c3489ec37e57f010b86684ec2 [0,1,0,0,0,0|2,0,0]=3 4253 B12R1.267 SCCNCc1nccnc1Cl 127f4b34c44cdaa489b8618260116c64 [0,1,0,0,0,0|3,0,0]=4 4254 B12R1.267 SCCOCc1ccccc1Br 2974a1a34077df01a526c92dc71fe7e1 [0,1,0,0,0,0|3,0,0]=4 4255 B12R1.267 SCCOCc1ccccc1Cl af22fdda4a6aed8dc8854b260c3db265 [0,1,0,0,0,0|3,0,0]=4 4256 B12R1.267 SCCOCc1ccccc1I 7e1445eeb10ec46213921732a4f0c947 [0,1,0,0,0,0|3,0,0]=4 4257 B12R1.267 SCCOCc1ccccc1S f4cf8e5f52b3bfc3ef5c599d397d5f9b [0,1,0,0,0,0|3,0,0]=4 4258 B12R1.267 SCCOCc1ncccc1Br 5cf0bf31395d61e903b02f713e2db072 [0,1,0,0,0,0|2,0,0]=3 4259 B12R1.267 SCCOCc1ncccc1Cl 1d6ec7c1725672ef971b2fc15e14ae41 [0,1,0,0,0,0|2,0,0]=3 4260 B12R1.267 SCCOCc1nccnc1Cl abebbb16e5990c5634b736082ae2089f [0,1,0,0,0,0|3,0,0]=4 4261 B12R1.267 SCCOCc1ncncc1Br d03bb4a40b6d104ee8a6a47b769c99b5 [0,1,0,0,0,0|3,0,0]=4 4262 B12R1.267 Sc1ccccc1NCCCCl daeff88095140f125d25874d90c55a3e [0,1,0,0,0,0|3,0,0]=4 4263 B12R1.267 [O-][n+]1ccccc1CNCCBr f5abefb2ffa3afda7baa5137789ba429 [0,1,0,0,0,0|2,0,1]=4 4264 B12R1.267 [O-][n+]1ccccc1CNCCF 2e47b07fb336c39bfbc24969c15e81a6 [0,1,0,0,0,0|2,0,1]=4 4265 B12R1.267 [O-][n+]1ccccc1CNCCI 2f148e2600116dad184fdfd4e3634d8b [0,1,0,0,0,0|2,0,1]=4 4266 B12R1.267 [O-][n+]1ccccc1CNCCO b170c095dd416d8557039fc7a5edd84b [0,1,0,0,0,0|2,0,1]=4 4267 B12R1.267 [O-][n+]1ccccc1CNCCS ea105e8385aa2cede886893ecc6d761d [0,1,0,0,0,0|2,0,1]=4 4268 B12R1.267 [O-][n+]1ccccc1COCCF c9b775cdd3381db319aa2fa0896d6921 [0,1,0,0,0,0|2,0,1]=4 4269 B12R1.267 [O-][n+]1ccccc1COCCS df45aa71a7e92416d694bb74ddbab193 [0,1,0,0,0,0|2,0,1]=4 4270 B12R1.267 [O-][n+]1ccccc1NCCCCl 91defc2b45ec9f47764627eedec73708 [0,1,0,0,0,0|2,0,1]=4 4271 B12R1.267 [O-][n+]1ccccc1NCCCF 8af7f6e3a79e50d1f329de7532e334d2 [0,1,0,0,0,0|2,0,1]=4 4272 B12R1.267 [O-][n+]1ccccc1NCCCO 649f905117cdd9f6073899d6464e9968 [0,1,0,0,0,0|2,0,1]=4 4273 B12R1.267 [O-][n+]1ccccc1OCCCF 170628b1fb2ad98825b9fef2f85d279f [0,1,0,0,0,0|2,0,1]=4 4274 B12R1.267 [O-][n+]1ccccc1OCCCS 17c2acb9eb47ed2b0128ba3b7a61b5a3 [0,1,0,0,0,0|2,0,1]=4 4275 B10R0.24 C=CCC(C=C)OCCCC 79dcab914f1342c9848dabf2cd4f8cb9 [0,0,1,0,0,0|2,0,1]=4 4276 B10R0.71 C/C=C/C=C/COCCCC 5be7c2b1277a2751ff6b685b75a09aa7 [0,0,1,0,0,0|2,0,1]=4 4277 B10R0.71 C=C/C=C/CCNCCCC 7b723689d9dff35eae75be2429e9c7d8 [0,0,1,0,0,0|2,0,1]=4 4278 B10R0.71 CC=CC=CCOCCCC b2db690d4b1d749e1abe5e187adedbf9 [0,0,1,0,0,0|2,0,1]=4 4279 B10R0.71 CCCCCOC/C=C/C=O dd701f6f2acb2f0b3775b86bb7a39725 [0,0,1,0,0,0|2,0,1]=4 4280 B10R0.91 C=C/C=C/C(=O)NCCCC 10ab5b019fd666fa7fd5d4798cb4be3a [0,0,1,0,0,0|2,0,0]=3 4281 B10R0.91 C=C/C=C/C(=O)NCCCCl 9221da0a5c3e0ddc8cd9ed455e3d3c09 [0,0,1,0,0,0|3,0,0]=4 4282 B10R0.91 C=C/C=C/C(=O)NCCCO 528c7746becfc45c9cd6909e88e91332 [0,0,1,0,0,0|3,0,0]=4 4283 B10R0.91 C=C/C=C/C(=O)NCCOC 351ba5c30d213fd54c2f17a189d04388 [0,0,1,0,0,0|3,0,0]=4 4284 B10R0.91 C=C/C=C/C(=O)NCCSC c13e7c621bf4db18540150cd963cf5ed [0,0,1,0,0,0|3,0,0]=4 4285 B10R0.91 C=C/C=C\C(=O)NCCCC c8a18923925d2c2145bb35dcf37ddb4d [0,0,1,0,0,0|2,0,0]=3 4286 B10R0.91 C=C/C=C\C(=O)NCCCCl ac05ccb5994844b9677dc19e5b45a055 [0,0,1,0,0,0|3,0,0]=4 4287 B10R0.91 C=C/C=C\C(=O)NCCCO d29e2325d1f06a7636145022225ca111 [0,0,1,0,0,0|3,0,0]=4 4288 B10R0.91 C=C/C=C\C(=O)NCCOC 74cd1c11300b875ba10c35c1245ea91d [0,0,1,0,0,0|3,0,0]=4 4289 B10R0.91 C=C/C=C\C(=O)NCCSC d379853bed74c31943de8c2d57b4bf72 [0,0,1,0,0,0|3,0,0]=4 4290 B10R0.91 C=CC=CC(=O)NCCCC 20646493048f04a031bdcfa6bf608cd9 [0,0,1,0,0,0|2,0,0]=3 4291 B10R0.91 C=CC=CC(=O)NCCCCl 6a96d950570b1c17c9a7c169d0f5682f [0,0,1,0,0,0|3,0,0]=4 4292 B10R0.91 C=CC=CC(=O)NCCCO ab938b744097f636a4f9386e13130345 [0,0,1,0,0,0|3,0,0]=4 4293 B10R0.91 C=CC=CC(=O)NCCOC a81a1a536aaf63bef2438638c1ba6b98 [0,0,1,0,0,0|3,0,0]=4 4294 B10R0.91 C=CC=CC(=O)NCCSC 25fa53b9da06a0362fd21b95abbcb80a [0,0,1,0,0,0|3,0,0]=4 4295 B12R2.1 CCN1CCc2c1cccn2 c6dc67a825bc35ffc313764f68fe419e [0,0,0,1,0,0|1,0,0]=2 4296 B12R2.1 CCN1CCc2c1ccnc2 1336a1241175b4a8fca67f4db3577c1b [0,0,0,1,0,0|3,0,0]=4 4297 B12R2.1 CCN1CCc2c1cncc2 28fbe5c10ed83bf591b4c3945d902409 [0,0,0,1,0,0|3,0,0]=4 4298 B12R2.1 CCN1CCc2c1nccc2 12def77c50510f33b92190b9b59aae18 [0,0,0,1,0,0|3,0,0]=4 4299 B12R2.1 CCN1CCc2c1nccn2 3a03a9b80da9220833252a85218386b2 [0,0,0,1,0,0|2,0,0]=3 4300 B12R2.1 FCN1CCc2c1cccn2 4377bfe78ba7f41c2b687c6b1c905846 [0,0,0,1,0,0|2,0,0]=3 4301 B12R2.1 FCN1CCc2c1nccn2 532a8beac2385f30a7dcaf6c6a577405 [0,0,0,1,0,0|3,0,0]=4 4302 B12R2.1 O=CN1CCc2c1cccn2 d2dcd13cafbd9713f3325443b770875f [0,0,0,1,0,0|2,0,1]=4 4303 B12R2.1 OCN1CCc2c1cccc2 b6afa4fa6bad5e1cd18ef7eeaa43164b [0,0,0,1,0,0|3,0,0]=4 4304 B12R2.1 OCN1CCc2c1cccn2 6bc3bb677f88da8fd8301f0c9a392f1b [0,0,0,1,0,0|2,0,0]=3 4305 B12R2.1 OCN1CCc2c1nccn2 f033df3ade04e8da35a0353fed6500eb [0,0,0,1,0,0|3,0,0]=4 4306 B12R2.11 CC1CC1Nc2ccccc2 6c2b1ed9451679c2c2b0f3748602bd6d [0,0,0,1,0,0|2,0,0]=3 4307 B12R2.11 CC1CC1Nc2cccnc2 e0f55178f08b4b2b54d9d876d97d2290 [0,0,0,1,0,0|3,0,0]=4 4308 B12R2.11 F[C@@H]1C[C@@H]1Nc2ccccc2 25c07123a823d9ea2969aff7da72cef4 [0,0,0,1,0,0|3,0,0]=4 4309 B12R2.11 F[C@@H]1C[C@@H]1Nc2ccccn2 fc41faec2161d9bc088f35169f0fc9e1 [0,0,0,1,0,0|2,0,0]=3 4310 B12R2.11 F[C@@H]1C[C@@H]1Nc2ccncn2 a97eeedc63e1e7d9830b83980c492513 [0,0,0,1,0,0|3,0,0]=4 4311 B12R2.11 F[C@@H]1C[C@@H]1Nc2cnccn2 17ad0f6a412e18d1388640b2dd918d1e [0,0,0,1,0,0|3,0,0]=4 4312 B12R2.11 F[C@@H]1C[C@H]1Nc2ccccc2 b0efbced164dabbe532e6255951097b4 [0,0,0,1,0,0|3,0,0]=4 4313 B12R2.11 F[C@@H]1C[C@H]1Nc2ccccn2 fc17ffe1e9ad6aa28e2159d2a121a181 [0,0,0,1,0,0|2,0,0]=3 4314 B12R2.11 F[C@@H]1C[C@H]1Nc2ccncn2 db20e6e5f8bed0c08026296876d7ccc8 [0,0,0,1,0,0|3,0,0]=4 4315 B12R2.11 F[C@@H]1C[C@H]1Nc2cnccn2 847448d513daab96512baf4a4956cf38 [0,0,0,1,0,0|3,0,0]=4 4316 B12R2.11 F[C@H]1C[C@@H]1Nc2ccccc2 e610ffc6a467ed241d6c7f91606b201b [0,0,0,1,0,0|3,0,0]=4 4317 B12R2.11 F[C@H]1C[C@@H]1Nc2ccccn2 59b89bc513bfcbe6b29399fe485506d9 [0,0,0,1,0,0|2,0,0]=3 4318 B12R2.11 F[C@H]1C[C@@H]1Nc2ccncn2 38cf8b56ac7318bbf6a7ae18fa483726 [0,0,0,1,0,0|3,0,0]=4 4319 B12R2.11 F[C@H]1C[C@@H]1Nc2cnccn2 0f117c1c77e8c296447cda49159d8ccc [0,0,0,1,0,0|3,0,0]=4 4320 B12R2.27 CCN1CC1c2ccccc2 9688627107d4117581407497e721ccee [0,0,0,1,0,0|2,0,0]=3 4321 B12R2.27 CCN1C[C@@H]1c2ccccc2 c32dec6f3160b9b7bc8c2839caf72878 [0,0,0,1,0,0|2,0,0]=3 4322 B12R2.27 FCN1CC1c2ccccc2 961cd8c1338ecdce6a27ac300fedcc98 [0,0,0,1,0,0|3,0,0]=4 4323 B12R2.27 FCN1C[C@@H]1c2ccccc2 186c23a739812eaa2456c8641683ea36 [0,0,0,1,0,0|3,0,0]=4 4324 B12R2.27 OCN1CC1c2ccccc2 380946bf56a518a4f82b6f06607820f1 [0,0,0,1,0,0|3,0,0]=4 4325 B12R2.27 OCN1C[C@@H]1c2ccccc2 b0131158d23691f2ccd2899d00b705c5 [0,0,0,1,0,0|3,0,0]=4 4326 B12R2.931 CCOC1Cc2c1cccc2 3c89ff4e209e0c2fdac6354471a794bb [0,0,0,1,0,0|2,0,0]=3 4327 B12R2.931 FCOC1Cc2c1cccc2 8a2a59b07ef62954890e5ca9132b929f [0,0,0,1,0,0|3,0,0]=4 4328 B12R2.2057 c1cc(ccn1)COC2CC2 da3247f4bbaea1ae4c65fbee8045d76d [0,0,0,1,0,0|3,0,0]=4 4329 B12R2.2057 c1cc(ccn1)NCC2CC2 849918da92a0c0498a218bfd0f4ee058 [0,0,0,1,0,0|3,0,0]=4 4330 B12R2.2057 c1cc(ccn1)OCC2CC2 c00853e2b14f5a610ec89d61eadf6a66 [0,0,0,1,0,0|3,0,0]=4 4331 B12R2.2057 c1cc(ncn1)CNC2CC2 607a93e9573f0955e8a4018ddea58dfa [0,0,0,1,0,0|2,0,0]=3 4332 B12R2.2057 c1cc(ncn1)COC2CC2 81da20e8bc039a37530fbd5d1424e639 [0,0,0,1,0,0|2,0,0]=3 4333 B12R2.2057 c1cc(ncn1)NCC2CC2 0b7284e426d35bba207ddb7cef0d63f2 [0,0,0,1,0,0|2,0,0]=3 4334 B12R2.2057 c1ccc(cc1)CNC2CC2 0722218fcfefdcb8b8f0e8dc60326858 [0,0,0,1,0,0|2,0,0]=3 4335 B12R2.2057 c1ccc(cc1)COC2CC2 4f6efb1abdd284b3ec5fbe724b10a332 [0,0,0,1,0,0|2,0,0]=3 4336 B12R2.2057 c1ccc(cc1)NCC2CC2 14003b7d6af1ed476ecb017534f042ad [0,0,0,1,0,0|2,0,0]=3 4337 B12R2.2057 c1ccc(nc1)CNC2CC2 072625a4614190be9cbf10388fa5861b [0,0,0,1,0,0|1,0,0]=2 4338 B12R2.2057 c1ccc(nc1)COC2CC2 abde439d2a0ddaaa61aa7afca3b1da4d [0,0,0,1,0,0|1,0,0]=2 4339 B12R2.2057 c1ccc(nc1)NCC2CC2 a4bb220accadbaa000279249a4daf5cf [0,0,0,1,0,0|1,0,0]=2 4340 B12R2.2057 c1ccc(nc1)OCC2CC2 05ede210d3ae4cc4a2c3f7154d855ada [0,0,0,1,0,0|1,0,0]=2 4341 B12R2.2057 c1cnc(cn1)COC2CC2 fdc47d726f6cd28e1efa561853273f47 [0,0,0,1,0,0|2,0,0]=3 4342 B12R2.2057 c1cnc(cn1)NCC2CC2 a6ff6ae7eefb0681b8e64d1d299083be [0,0,0,1,0,0|2,0,0]=3 4343 B12R2.2057 c1cnc(cn1)OCC2CC2 b2726dc332261b3161c83cefeba4125b [0,0,0,1,0,0|2,0,0]=3 4344 B12R2.2057 c1cnc(nc1)CNC2CC2 7038fd05b2ef00331cb1adfd11eb9677 [0,0,0,1,0,0|2,0,0]=3 4345 B12R2.2057 c1cnc(nc1)COC2CC2 e4bd87d14e894bedbf03d18ff8ef7f2f [0,0,0,1,0,0|2,0,0]=3 4346 B12R2.2057 c1cnc(nc1)NCC2CC2 a4ccd00b4bac58720d9d1f0c5fd2db77 [0,0,0,1,0,0|2,0,0]=3 4347 B12R2.2057 c1cnc(nc1)OCC2CC2 9908e1fbd3e582816905ad7a5e8bbf5a [0,0,0,1,0,0|2,0,0]=3 4348 B12R2.2057 c1cnc(nn1)NCC2CC2 84d7ab3aedeb6ea313ccfe6bcb7dc29e [0,0,0,1,0,0|3,0,0]=4 4349 B12R2.2057 c1cncc(c1)CNC2CC2 de74061854556603c3b7f6c7b31bcca1 [0,0,0,1,0,0|3,0,0]=4 4350 B12R2.2057 c1cncc(c1)COC2CC2 4f1f4bbe9c5cccaf786a2469b1a1b939 [0,0,0,1,0,0|3,0,0]=4 4351 B12R2.2057 c1cncc(c1)NCC2CC2 116af6c2af65d4c96c0cfbf27938bace [0,0,0,1,0,0|3,0,0]=4 4352 B12R2.2057 c1cncc(c1)OCC2CC2 6e3515b4fef3884dcd9b31bc8938b0e1 [0,0,0,1,0,0|3,0,0]=4 4353 B12R2.2057 c1cnnc(c1)CNC2CC2 514c968ed269ecf84ec95620d443c6f3 [0,0,0,1,0,0|2,0,0]=3 4354 B12R2.2057 c1cnnc(c1)COC2CC2 5647e20affbc8a5d9e818133ea4a6290 [0,0,0,1,0,0|2,0,0]=3 4355 B12R2.2057 c1cnnc(c1)NCC2CC2 fd86c67f390e8038e0981f3804df0169 [0,0,0,1,0,0|2,0,0]=3 4356 B12R2.2057 c1ncnc(n1)NCC2CC2 3859ed969f7fea727adc81cc0df876f4 [0,0,0,1,0,0|3,0,0]=4 4357 B12R2.2057 c1nncc(n1)NCC2CC2 e4d7b52d075c0e4498614f6f085ad3ff [0,0,0,1,0,0|3,0,0]=4 4358 B12R2.2058 c1cc(ccn1)NC2CCC2 ff52b84334e7a4aaf2d6969c56a15034 [0,0,0,1,0,0|3,0,0]=4 4359 B12R2.2058 c1cc(ncn1)CN2CCC2 2c3f0723d6a6c39b79fc11c5b6517191 [0,0,0,1,0,0|2,0,0]=3 4360 B12R2.2058 c1ccc(cc1)CN2CCC2 79f0a156a4476249fe3e90dbe2fa6274 [0,0,0,1,0,0|2,0,0]=3 4361 B12R2.2058 c1ccc(cc1)NC2COC2 638d2081ed3e07246cd09300ecb8f6dc [0,0,0,1,0,0|3,0,0]=4 4362 B12R2.2058 c1ccc(nc1)CN2CCC2 ad09a5bf93c910029918799e4e089e07 [0,0,0,1,0,0|1,0,0]=2 4363 B12R2.2058 c1ccc(nc1)NC2CCC2 fb43cdd397450ab6a78add51a3593170 [0,0,0,1,0,0|1,0,0]=2 4364 B12R2.2058 c1ccc(nc1)OC2CCC2 01ad94c84aae3cf4e74cc0f7661c85b5 [0,0,0,1,0,0|1,0,0]=2 4365 B12R2.2058 c1ccc(nc1)OC2COC2 e57c93d451b0b6b991d0fd1596a311ca [0,0,0,1,0,0|2,0,0]=3 4366 B12R2.2058 c1cnc(cn1)NC2CCC2 44336cb13f75395d2c0705f2ea1af01f [0,0,0,1,0,0|2,0,0]=3 4367 B12R2.2058 c1cnc(nc1)CN2CCC2 e49193a30133e7c17126c4ae8f6bba56 [0,0,0,1,0,0|2,0,0]=3 4368 B12R2.2058 c1cnc(nc1)NC2CCC2 87105cdc2fd6ed90dabb412e16866fdf [0,0,0,1,0,0|2,0,0]=3 4369 B12R2.2058 c1cnc(nc1)NC2COC2 9193c846df9ff55a5933be2d90f6c6ee [0,0,0,1,0,0|3,0,0]=4 4370 B12R2.2058 c1cnc(nc1)OC2CCC2 80c1d6d72ca9dfb2721cf7eb39eba55e [0,0,0,1,0,0|2,0,0]=3 4371 B12R2.2058 c1cnc(nn1)NC2CCC2 375a9eb7496564d2fe6680afc30f6913 [0,0,0,1,0,0|3,0,0]=4 4372 B12R2.2058 c1cncc(c1)CN2CCC2 b1361fa162d89a1875554b0e74a89d35 [0,0,0,1,0,0|3,0,0]=4 4373 B12R2.2058 c1cncc(c1)NC2CCC2 dd91e6f1e99e09367d72a057d00ff1a5 [0,0,0,1,0,0|3,0,0]=4 4374 B12R2.2058 c1cncc(c1)OC2CCC2 7a6fdcb9cb0be6f7ba06c65562ff0c48 [0,0,0,1,0,0|3,0,0]=4 4375 B12R2.2058 c1cnnc(c1)CN2CCC2 6ffec972d2f9ac52f4eceae0deced11c [0,0,0,1,0,0|2,0,0]=3 4376 B12R2.2058 c1ncnc(n1)NC2CCC2 5255166dcabb482c430324ad32d58e48 [0,0,0,1,0,0|3,0,0]=4 4377 B10R1.21 BrCCNCc1ccco1 8c5e0347db7e3491c86fcbf95c4451a4 [0,0,0,0,1,0|3,0,0]=4 4378 B10R1.21 BrCCNCc1cccs1 43e40805d56566d68eaea0b456027ed9 [0,0,0,0,1,0|3,0,0]=4 4379 B10R1.21 BrCCNCc1ccon1 0923faacb9d941f957d91a88f348adc2 [0,0,0,0,1,0|3,0,0]=4 4380 B10R1.21 BrCCNCc1ccsc1 743deed463729b1cf9f0830f42336f0a [0,0,0,0,1,0|3,0,0]=4 4381 B10R1.21 BrCCNCc1cocn1 e962152c889218aa18395181b8b2dd18 [0,0,0,0,1,0|3,0,0]=4 4382 B10R1.21 BrCCNCc1cscn1 0b8784bed0cb770202abacaa9d81f339 [0,0,0,0,1,0|3,0,0]=4 4383 B10R1.21 BrCCNCc1ncc[nH]1 cb160b68a5678fc41ba3a3b87f02612e [0,0,0,0,1,0|3,0,0]=4 4384 B10R1.21 BrCCNCc1ncco1 cb7b4723ac24e6794a0928e76b66d36e [0,0,0,0,1,0|3,0,0]=4 4385 B10R1.21 BrCCNCc1nccs1 739ce5adfbb2107019cf5bbf3bfb75ba [0,0,0,0,1,0|3,0,0]=4 4386 B10R1.21 CCCCCN1CC=CC1 f8ff4ce1fc30a8f02a35f223b9ac83c1 [0,0,0,0,1,0|1,0,2]=4 4387 B10R1.21 CCCCNc1c[nH]cn1 c32a5f86e55cb9897330164d8efcb9fe [0,0,0,0,1,0|2,0,0]=3 4388 B10R1.21 CCCCNc1cc[nH]n1 08191c11b8fd0a9b902620d66fe69344 [0,0,0,0,1,0|2,0,0]=3 4389 B10R1.21 CCCCNc1ccco1 59676670e7fa0c04d4e8b3beb240e350 [0,0,0,0,1,0|2,0,0]=3 4390 B10R1.21 CCCCNc1cccs1 d0e1e22576c5f6dbd0951ff409f4ab02 [0,0,0,0,1,0|2,0,0]=3 4391 B10R1.21 CCCCNc1ccno1 6ce6fff15c53db9398481797e3154d0a [0,0,0,0,1,0|3,0,0]=4 4392 B10R1.21 CCCCNc1ccns1 a07df3d7bb3cf2bc4b424479532c48a1 [0,0,0,0,1,0|3,0,0]=4 4393 B10R1.21 CCCCNc1ccoc1 640322940a87afc9d827bccc7d39ae5e [0,0,0,0,1,0|2,0,0]=3 4394 B10R1.21 CCCCNc1ccon1 1d9d6f5bb9f6f4fb68fa3ea6f9775ccf [0,0,0,0,1,0|2,0,0]=3 4395 B10R1.21 CCCCNc1ccsc1 c64d8e4067791c5f42e37c69db44e430 [0,0,0,0,1,0|2,0,0]=3 4396 B10R1.21 CCCCNc1cn[nH]c1 9980fa8e9db0d8f5784bb181a0c0259e [0,0,0,0,1,0|3,0,0]=4 4397 B10R1.21 CCCCNc1cncs1 4a96645b2a572926fbd6e45054b4e3f7 [0,0,0,0,1,0|3,0,0]=4 4398 B10R1.21 CCCCNc1cnoc1 474ec08f2cd5668c618cfc570fa683ea [0,0,0,0,1,0|3,0,0]=4 4399 B10R1.21 CCCCNc1cnon1 5242a73fd72e0171da98849cf678ee84 [0,0,0,0,1,0|3,0,0]=4 4400 B10R1.21 CCCCNc1cnsc1 de1481a58ab3bb7aae08531da62b0b80 [0,0,0,0,1,0|3,0,0]=4 4401 B10R1.21 CCCCNc1cnsn1 fc6525ea9f542f00ebe03160f6632fff [0,0,0,0,1,0|3,0,0]=4 4402 B10R1.21 CCCCNc1cocn1 5e3b989a44937a5b280cf60b71051b69 [0,0,0,0,1,0|2,0,0]=3 4403 B10R1.21 CCCCNc1cscn1 171f3e731934a6d1d3644c2ffd036bf0 [0,0,0,0,1,0|2,0,0]=3 4404 B10R1.21 CCCCNc1nc[nH]n1 cc9df479d73dab60a41e0b2008dc9841 [0,0,0,0,1,0|3,0,0]=4 4405 B10R1.21 CCCCNc1ncc[nH]1 3616ba14c142c28225de2f7de9635479 [0,0,0,0,1,0|2,0,0]=3 4406 B10R1.21 CCCCNc1ncco1 2f1cff45c72424f1dd0699663acbed99 [0,0,0,0,1,0|2,0,0]=3 4407 B10R1.21 CCCCNc1nccs1 12133cb9a1da0d94840ed9a3baf14a9a [0,0,0,0,1,0|2,0,0]=3 4408 B10R1.21 CCCCNc1ncns1 389263cb20a81777b54da7b7929acc60 [0,0,0,0,1,0|3,0,0]=4 4409 B10R1.21 CCCCNc1ncon1 a9873cfacd8cbd6e6f55c2f5bd75771a [0,0,0,0,1,0|3,0,0]=4 4410 B10R1.21 CCCCNc1ncsn1 efd220ad1750f931c5970d7a54bd88e5 [0,0,0,0,1,0|3,0,0]=4 4411 B10R1.21 CCCCNc1nnco1 670187d65c48cc15447592ba7fb271da [0,0,0,0,1,0|3,0,0]=4 4412 B10R1.21 CCCCNc1nncs1 87b2466bf488889c0e12c7d538029e07 [0,0,0,0,1,0|3,0,0]=4 4413 B10R1.21 CCCCOc1c[nH]cn1 2de79fd47cbcb5ac95e2c102e85f22a4 [0,0,0,0,1,0|2,0,0]=3 4414 B10R1.21 CCCCOc1ccco1 69ea1c44ba0b20cb45990b8719447407 [0,0,0,0,1,0|2,0,0]=3 4415 B10R1.21 CCCCOc1cccs1 d524184ff2bb44cbc7ae5ab279df4ef4 [0,0,0,0,1,0|2,0,0]=3 4416 B10R1.21 CCCCOc1ccn[nH]1 624ca312369c33edfb509f311a6b8972 [0,0,0,0,1,0|2,0,1]=4 4417 B10R1.21 CCCCOc1ccsc1 770f8463a70d6c9063754e6f8e52cc5c [0,0,0,0,1,0|2,0,0]=3 4418 B10R1.21 CCCCOc1cn[nH]c1 e3818ba5634dbcf5f133f82fe279db0d [0,0,0,0,1,0|3,0,0]=4 4419 B10R1.21 CCCCOc1cnoc1 6a0fd273c0dcce1610f7a86307d56b4d [0,0,0,0,1,0|3,0,0]=4 4420 B10R1.21 CCCCOc1cnsn1 b13c34607b9120015ad01edce513df6a [0,0,0,0,1,0|3,0,0]=4 4421 B10R1.21 CCCCOc1nccs1 8ff8aac1654c33a390fc90e62ff87a97 [0,0,0,0,1,0|2,0,0]=3 4422 B10R1.21 CCCCOc1nncs1 4230e96c4b5cc0c01197fc90d27ff015 [0,0,0,0,1,0|3,0,0]=4 4423 B10R1.21 CCCCOn1cccn1 d11a05bd6c9f30ec63b2f2090ca17285 [0,0,0,0,1,0|2,0,0]=3 4424 B10R1.21 CCCCOn1ccnc1 1d6871ba1f462335a02edbcc040a9852 [0,0,0,0,1,0|3,0,0]=4 4425 B10R1.21 CCCNCc1c[nH]nn1 c3afef618296bdd2f8e4a68fae8a4131 [0,0,0,0,1,0|3,0,0]=4 4426 B10R1.21 CCCNCc1cc[nH]c1 4f9270308a7b6b414b088262dd2b2c1b [0,0,0,0,1,0|2,0,0]=3 4427 B10R1.21 CCCNCc1ccc[nH]1 389a419bddfc3ec4dd8aa13cc5a47be3 [0,0,0,0,1,0|1,0,1]=3 4428 B10R1.21 CCCNCc1ccco1 de6afd493c9d06f3af6e49358fd71eee [0,0,0,0,1,0|2,0,0]=3 4429 B10R1.21 CCCNCc1cccs1 a6b46c4b7b3d26eb24d84a1cd913df52 [0,0,0,0,1,0|2,0,0]=3 4430 B10R1.21 CCCNCc1ccn[nH]1 e1f08cf28cd911a2d6e8453949209921 [0,0,0,0,1,0|2,0,1]=4 4431 B10R1.21 CCCNCc1ccno1 f5be311df91e7b627912dde86779143b [0,0,0,0,1,0|3,0,0]=4 4432 B10R1.21 CCCNCc1ccns1 3e4e789e7319b5a883a84e0bfa22a0f0 [0,0,0,0,1,0|3,0,0]=4 4433 B10R1.21 CCCNCc1ccoc1 77a12cc2355259eba3cfabf094f8d919 [0,0,0,0,1,0|2,0,0]=3 4434 B10R1.21 CCCNCc1ccon1 b53b608ddf693d3fc343683f463fb7fb [0,0,0,0,1,0|2,0,0]=3 4435 B10R1.21 CCCNCc1ccsc1 66232677ec2023d5a802635b8a1a6d73 [0,0,0,0,1,0|2,0,0]=3 4436 B10R1.21 CCCNCc1ccsn1 8449b0fcfb1c96bf13985551d7845e24 [0,0,0,0,1,0|2,0,0]=3 4437 B10R1.21 CCCNCc1cn[nH]c1 9be69bf3e617fe1744907985c17ab135 [0,0,0,0,1,0|3,0,0]=4 4438 B10R1.21 CCCNCc1cnc[nH]1 60b3cb313d5ecfd3e621a7a5c6c3d86c [0,0,0,0,1,0|2,0,1]=4 4439 B10R1.21 CCCNCc1cnco1 1b5514d0e1b9a006b09cdecb0e0b1d25 [0,0,0,0,1,0|3,0,0]=4 4440 B10R1.21 CCCNCc1cncs1 7dbbaedca623ee435b1934f7c0edf9ce [0,0,0,0,1,0|3,0,0]=4 4441 B10R1.21 CCCNCc1cnoc1 963df51a2c52fd8246246a64fb287d32 [0,0,0,0,1,0|3,0,0]=4 4442 B10R1.21 CCCNCc1cnsc1 b8aa11169d47bcdb024914ba3647677e [0,0,0,0,1,0|3,0,0]=4 4443 B10R1.21 CCCNCc1cocn1 bcb4047e77ac4a450a61a0c44cb5b21f [0,0,0,0,1,0|2,0,0]=3 4444 B10R1.21 CCCNCc1cscn1 261683b974dfe16c7986317d90f5ec65 [0,0,0,0,1,0|2,0,0]=3 4445 B10R1.21 CCCNCc1ncc[nH]1 29bc1bf59da096efc5a106235204e2a9 [0,0,0,0,1,0|2,0,0]=3 4446 B10R1.21 CCCNCc1ncco1 1bbc962d75b7819f240f6938a75188ec [0,0,0,0,1,0|2,0,0]=3 4447 B10R1.21 CCCNCc1nccs1 0ef62e82a5f00529171e41c62f4b4e6d [0,0,0,0,1,0|2,0,0]=3 4448 B10R1.21 CCCNCc1ncn[nH]1 7cbf6d6d7da64d30ab1ae79fb7982c58 [0,0,0,0,1,0|3,0,0]=4 4449 B10R1.21 CCCNCc1ncon1 6e9c8d4e404dbc5902f47667c7bf2712 [0,0,0,0,1,0|3,0,0]=4 4450 B10R1.21 CCCNCc1nnco1 c53d2800892b994382d9643da0042d7e [0,0,0,0,1,0|3,0,0]=4 4451 B10R1.21 CCCNCn1cncn1 a7b1ad87fab29f2b3a78e4cef000553b [0,0,0,0,1,0|3,0,0]=4 4452 B10R1.21 CCCNCn1nccn1 41b59dfea503168093ab9fbc21888f83 [0,0,0,0,1,0|3,0,0]=4 4453 B10R1.21 CCCOCc1cc[nH]c1 1c6e3834cbfb57fddc05135d2d1d0cc0 [0,0,0,0,1,0|2,0,0]=3 4454 B10R1.21 CCCOCc1ccc[nH]1 cd7c6439400e4582d3103a4de108225f [0,0,0,0,1,0|1,0,1]=3 4455 B10R1.21 CCCOCc1ccco1 68fddc7fa2e66c072844daffb93c2167 [0,0,0,0,1,0|2,0,0]=3 4456 B10R1.21 CCCOCc1cccs1 a6f03adf2a826c0d56d546cb620a5207 [0,0,0,0,1,0|2,0,0]=3 4457 B10R1.21 CCCOCc1ccn[nH]1 b5d2f82f81054d8d387d12ac66b15e99 [0,0,0,0,1,0|2,0,1]=4 4458 B10R1.21 CCCOCc1ccno1 870c1a0078df086a024012effc01a45b [0,0,0,0,1,0|3,0,0]=4 4459 B10R1.21 CCCOCc1ccns1 157bfd3a7196eebeb4ab9daef95bdac7 [0,0,0,0,1,0|3,0,0]=4 4460 B10R1.21 CCCOCc1ccoc1 350ab1ab3ec612f4eb7fb879044afc2a [0,0,0,0,1,0|2,0,0]=3 4461 B10R1.21 CCCOCc1ccon1 0508f50b820a2ac57642da204033d6af [0,0,0,0,1,0|2,0,0]=3 4462 B10R1.21 CCCOCc1ccsc1 c1bc026f3b06598ff523439403fe1fe6 [0,0,0,0,1,0|2,0,0]=3 4463 B10R1.21 CCCOCc1ccsn1 8da3d834e265b89cf409f0864056e910 [0,0,0,0,1,0|2,0,0]=3 4464 B10R1.21 CCCOCc1cn[nH]c1 b55ce79aa361ff8f0417aad2fed9d5dd [0,0,0,0,1,0|3,0,0]=4 4465 B10R1.21 CCCOCc1cnc[nH]1 ddc0a3ec6c004ccb97273631b19f7042 [0,0,0,0,1,0|2,0,1]=4 4466 B10R1.21 CCCOCc1cnco1 9d46dd82e2c335d0dac1e9a70ff331b6 [0,0,0,0,1,0|3,0,0]=4 4467 B10R1.21 CCCOCc1cnoc1 13b3b6fb4f7bd579698ee3e4721f7f7a [0,0,0,0,1,0|3,0,0]=4 4468 B10R1.21 CCCOCc1cnsc1 61dc3358dd8e7e8f5f3a86c7961707a6 [0,0,0,0,1,0|3,0,0]=4 4469 B10R1.21 CCCOCc1cnsn1 b6c5e27ca7eda34d00cbc7d96bb79433 [0,0,0,0,1,0|3,0,0]=4 4470 B10R1.21 CCCOCc1cocn1 0f71bb305c19415a7537676a4224728c [0,0,0,0,1,0|2,0,0]=3 4471 B10R1.21 CCCOCc1cscn1 ea802f07371a6193ed62a14232668b20 [0,0,0,0,1,0|2,0,0]=3 4472 B10R1.21 CCCOCc1csnn1 273a67faddfcf47b57e9d3c6e41a0bc5 [0,0,0,0,1,0|3,0,0]=4 4473 B10R1.21 CCCOCc1nc[nH]n1 00e368b8033054f5a22f8ab40e686341 [0,0,0,0,1,0|3,0,0]=4 4474 B10R1.21 CCCOCc1ncc[nH]1 4081ea8f4b95c044a5f35fe6d11581c8 [0,0,0,0,1,0|2,0,0]=3 4475 B10R1.21 CCCOCc1ncco1 71ad9c831053756f6e2d91b3d3cccbb9 [0,0,0,0,1,0|2,0,0]=3 4476 B10R1.21 CCCOCc1nccs1 e8288e9d9343ecc898d267fc4191d27a [0,0,0,0,1,0|2,0,0]=3 4477 B10R1.21 CCCOCc1ncno1 31a68b29768baf8fba73325c80d62c9a [0,0,0,0,1,0|3,0,0]=4 4478 B10R1.21 CCCOCc1ncns1 a007a701741a704f3f826a595574fabe [0,0,0,0,1,0|3,0,0]=4 4479 B10R1.21 CCCOCc1ncon1 61d8bf2514a2dbb05978119ab20883bc [0,0,0,0,1,0|3,0,0]=4 4480 B10R1.21 CCCOCc1nnco1 e8c7540ba9028b6097564ba158e15c33 [0,0,0,0,1,0|3,0,0]=4 4481 B10R1.21 CCCOCn1cccn1 4d821c1d60f9d9d5e30cebd78f621d9d [0,0,0,0,1,0|2,0,0]=3 4482 B10R1.21 CCCOCn1ccnc1 95f7e2cf55cc4382e88a26902bb7a774 [0,0,0,0,1,0|3,0,0]=4 4483 B10R1.21 CCCOCn1cncn1 ad6dffae7e3588acbe42855869ed8ae8 [0,0,0,0,1,0|3,0,0]=4 4484 B10R1.21 CCCOCn1nccn1 8c7229ca11f54b3a58fefafdb5033327 [0,0,0,0,1,0|3,0,0]=4 4485 B10R1.21 CCNCCc1c[nH]cn1 5d8976b386787bb539681dc4bbe582eb [0,0,0,0,1,0|2,0,0]=3 4486 B10R1.21 CCNCCc1cc[nH]n1 19a12fba6307d4d49877f9d3ba8b08dd [0,0,0,0,1,0|2,0,0]=3 4487 B10R1.21 CCNCCc1ccc[nH]1 8213ac8e4b9d94b1198a75f34bf94d78 [0,0,0,0,1,0|1,0,1]=3 4488 B10R1.21 CCNCCc1ccco1 1ad917faeddbc2d8d316341d3d41b62a [0,0,0,0,1,0|2,0,0]=3 4489 B10R1.21 CCNCCc1cccs1 f1bb449dfb857924f62fa7b623b4a581 [0,0,0,0,1,0|2,0,0]=3 4490 B10R1.21 CCNCCc1ccsc1 2ea71ee3ba82753ba2a28e730c57ed02 [0,0,0,0,1,0|2,0,0]=3 4491 B10R1.21 CCNCCc1cn[nH]c1 33b8602a59775cffdef08b48cc6c7bc1 [0,0,0,0,1,0|3,0,0]=4 4492 B10R1.21 CCNCCc1cnoc1 e6be2d5f7b9b433d01736a031aae2856 [0,0,0,0,1,0|3,0,0]=4 4493 B10R1.21 CCNCCc1cscn1 c90d7abebf31b4546037db2893fb081b [0,0,0,0,1,0|2,0,0]=3 4494 B10R1.21 CCNCCc1ncc[nH]1 10739b1151014cf40521e7f6f68f5f08 [0,0,0,0,1,0|2,0,0]=3 4495 B10R1.21 CCNCCc1nccs1 ff3ceb5e0153da3ae8a88aa515d57d9f [0,0,0,0,1,0|2,0,0]=3 4496 B10R1.21 CCNCCc1nncs1 46fd909be39042449bdd58f4109e3885 [0,0,0,0,1,0|3,0,0]=4 4497 B10R1.21 CCNCCn1cccc1 d2c2451b9536ba91b7a45cd25defb648 [0,0,0,0,1,0|2,0,0]=3 4498 B10R1.21 CCNCCn1cccn1 58fbe0f55d79423be74c4217047e7a9d [0,0,0,0,1,0|2,0,0]=3 4499 B10R1.21 CCNCCn1ccnc1 9feed643afaab7c5e89bc13ec1c96875 [0,0,0,0,1,0|3,0,0]=4 4500 B10R1.21 CCNCCn1ccnn1 2943b6ee58c97f9b44d18df460a5611c [0,0,0,0,1,0|3,0,0]=4 4501 B10R1.21 CCNCCn1cncn1 3fdfb18b2dd2a2c5f52dbd1951066ea7 [0,0,0,0,1,0|3,0,0]=4 4502 B10R1.21 CCOCCc1c[nH]cn1 aedba343b36eaee1c14567760ebbcea9 [0,0,0,0,1,0|2,0,0]=3 4503 B10R1.21 CCOCCc1cc[nH]n1 04018fbda8bfe185685a5f55a4225098 [0,0,0,0,1,0|2,0,0]=3 4504 B10R1.21 CCOCCc1ccc[nH]1 8ef61c623e3daff29562378e78c2e3e6 [0,0,0,0,1,0|1,0,1]=3 4505 B10R1.21 CCOCCc1ccco1 bed872e177b1646746b6cb5e6f761166 [0,0,0,0,1,0|2,0,0]=3 4506 B10R1.21 CCOCCc1cccs1 acaaec43fbd0c8ea9b4724789b403b3c [0,0,0,0,1,0|2,0,0]=3 4507 B10R1.21 CCOCCc1ccoc1 036407c3a22d5cc5d73147c1dce3e7e4 [0,0,0,0,1,0|2,0,0]=3 4508 B10R1.21 CCOCCc1ccon1 7d935ca9b30187c624e295d7a3bd3830 [0,0,0,0,1,0|2,0,0]=3 4509 B10R1.21 CCOCCc1ccsc1 ca4812c0bdd5d5c44828e294c88d13c1 [0,0,0,0,1,0|2,0,0]=3 4510 B10R1.21 CCOCCc1cn[nH]c1 887aad48ae6d6990ae2fc264df22acd3 [0,0,0,0,1,0|3,0,0]=4 4511 B10R1.21 CCOCCc1cnoc1 74b82d537593da2024e97b84d80d8fb7 [0,0,0,0,1,0|3,0,0]=4 4512 B10R1.21 CCOCCc1cscn1 1cd5c95d3af30f19b925f6c604b09676 [0,0,0,0,1,0|2,0,0]=3 4513 B10R1.21 CCOCCc1ncc[nH]1 86ab996304566281ad18cdeb99647a8f [0,0,0,0,1,0|2,0,0]=3 4514 B10R1.21 CCOCCc1nccs1 90e0ee1837f8d21c5ec390dafb9ef905 [0,0,0,0,1,0|2,0,0]=3 4515 B10R1.21 CCOCCc1ncon1 6760b5ae9fe551b9e727d09f8c40fca0 [0,0,0,0,1,0|3,0,0]=4 4516 B10R1.21 CCOCCn1cccc1 b8b6f334754cac390d35c493d0f942fe [0,0,0,0,1,0|2,0,0]=3 4517 B10R1.21 CCOCCn1cccn1 8ba965522a54437e6ed1cca019b603d2 [0,0,0,0,1,0|2,0,0]=3 4518 B10R1.21 CCOCCn1ccnc1 70f935f79cf2dd9c6b1fc42b80178e58 [0,0,0,0,1,0|3,0,0]=4 4519 B10R1.21 CCOCCn1ccnn1 23e2130cfa9ed88b5fe07356a20dd416 [0,0,0,0,1,0|3,0,0]=4 4520 B10R1.21 CCOCCn1cncn1 b25160fe7114ce51bebe1798318a5508 [0,0,0,0,1,0|3,0,0]=4 4521 B10R1.21 CCOCCn1nccn1 fad6dd6b56ef8abfc48495db6118bb14 [0,0,0,0,1,0|3,0,0]=4 4522 B10R1.21 CCOCNc1cc[nH]n1 fd0e8838611e9c80ca772c95fec7e66a [0,0,0,0,1,0|3,0,0]=4 4523 B10R1.21 CCOCNc1cccs1 fdc9729af7149ad96898b9c1e1995195 [0,0,0,0,1,0|3,0,0]=4 4524 B10R1.21 CCOCNc1ccsc1 b26cc038bdb1c3e6592d9ff0bb4cc274 [0,0,0,0,1,0|3,0,0]=4 4525 B10R1.21 CCOCNc1cscn1 339bf65de5d890d2a2d219a929e3aabc [0,0,0,0,1,0|3,0,0]=4 4526 B10R1.21 CCOCNc1ncc[nH]1 198968ac86dac0044424d6f220a0ea28 [0,0,0,0,1,0|3,0,0]=4 4527 B10R1.21 CCOCNc1ncco1 250f1feeca8dbd10b67fead60ad657bd [0,0,0,0,1,0|3,0,0]=4 4528 B10R1.21 CCOCNc1nccs1 05bc369ffafa4ca27b9bb6ea52d855c9 [0,0,0,0,1,0|3,0,0]=4 4529 B10R1.21 CCOCOc1c[nH]cn1 77a5a056bda1a382071b8f7d9843f3ed [0,0,0,0,1,0|3,0,0]=4 4530 B10R1.21 CCOCOc1ccco1 50027f11f0ebc3bb1d65662891127453 [0,0,0,0,1,0|3,0,0]=4 4531 B10R1.21 CCOCOc1cccs1 f1905e8f0a82ed892bc2c970faf9dff2 [0,0,0,0,1,0|3,0,0]=4 4532 B10R1.21 CCOCOc1ccsc1 5f5c6ca2bf7fd5ada01a82ef0afd3e4b [0,0,0,0,1,0|3,0,0]=4 4533 B10R1.21 CCOCOc1nccs1 c238b52bf71f44ba06f7605a85433907 [0,0,0,0,1,0|3,0,0]=4 4534 B10R1.21 CCOCOn1cccn1 2e112f575cc6b3f59dff340b7b146eac [0,0,0,0,1,0|3,0,0]=4 4535 B10R1.21 COCCNc1c[nH]cn1 31b5e19647757b8c8ff224c51156209f [0,0,0,0,1,0|3,0,0]=4 4536 B10R1.21 COCCNc1cc[nH]n1 8e13804df54af8b968ee26c161d84f41 [0,0,0,0,1,0|3,0,0]=4 4537 B10R1.21 COCCNc1ccco1 6446037fd2435f1d5d632a2ea17e6335 [0,0,0,0,1,0|3,0,0]=4 4538 B10R1.21 COCCNc1cccs1 4679346317f357faed462ffad2613f4e [0,0,0,0,1,0|3,0,0]=4 4539 B10R1.21 COCCNc1ccoc1 9d6bf01177d31be17a28caf95f550025 [0,0,0,0,1,0|3,0,0]=4 4540 B10R1.21 COCCNc1ccon1 6954b7496643468f7475703d0e035c89 [0,0,0,0,1,0|3,0,0]=4 4541 B10R1.21 COCCNc1ccsc1 fa12ac19f0680dbd0ab3feff8ede4d6f [0,0,0,0,1,0|3,0,0]=4 4542 B10R1.21 COCCNc1ccsn1 8f2a607444523eea96d2a2964919bd0a [0,0,0,0,1,0|3,0,0]=4 4543 B10R1.21 COCCNc1cocn1 158584353c7c2800e7a7976ae871024d [0,0,0,0,1,0|3,0,0]=4 4544 B10R1.21 COCCNc1cscn1 b6ebb9a88d2989f940228f51d24df076 [0,0,0,0,1,0|3,0,0]=4 4545 B10R1.21 COCCNc1ncc[nH]1 e38f19dcac7f98aeb7cbe943254f0b87 [0,0,0,0,1,0|3,0,0]=4 4546 B10R1.21 COCCNc1ncco1 27ef3b5cdb6ddb84737afcdb0a8564a1 [0,0,0,0,1,0|3,0,0]=4 4547 B10R1.21 COCCNc1nccs1 999a710edbc3e1b4131c6168cf4aff5d [0,0,0,0,1,0|3,0,0]=4 4548 B10R1.21 COCCOc1c[nH]cn1 c22d372def312a114ce12682b28da196 [0,0,0,0,1,0|3,0,0]=4 4549 B10R1.21 COCCOc1ccco1 7edab0eeb45cb66520c905082a1511e1 [0,0,0,0,1,0|3,0,0]=4 4550 B10R1.21 COCCOc1cccs1 376aff47162023b820da889700ce60b2 [0,0,0,0,1,0|3,0,0]=4 4551 B10R1.21 COCCOc1ccsc1 e986a4921184eaf2e88bed3033e7fa91 [0,0,0,0,1,0|3,0,0]=4 4552 B10R1.21 COCCOc1nccs1 d38e4915d887bda4d8f4cc1d19b8b69f [0,0,0,0,1,0|3,0,0]=4 4553 B10R1.21 COCCOn1cccn1 ed5cda64fbb03049c23386a66a575e0e [0,0,0,0,1,0|3,0,0]=4 4554 B10R1.21 COCNCc1cc[nH]c1 76f00173f5381901b807ffc69f5b23d6 [0,0,0,0,1,0|3,0,0]=4 4555 B10R1.21 COCNCc1ccc[nH]1 beb90f93b0b4d35af75c15067af5f89f [0,0,0,0,1,0|2,0,1]=4 4556 B10R1.21 COCNCc1ccco1 ab0a134b649505be2ef4a9f4f282a23e [0,0,0,0,1,0|3,0,0]=4 4557 B10R1.21 COCNCc1cccs1 75615c372e8efa80d8b79813eacfd51c [0,0,0,0,1,0|3,0,0]=4 4558 B10R1.21 COCNCc1ccoc1 b9bee659116f1fbfd5e48ad504ac6d3a [0,0,0,0,1,0|3,0,0]=4 4559 B10R1.21 COCNCc1ccon1 7b0726b8ae30de78aa3eea0e48368e4c [0,0,0,0,1,0|3,0,0]=4 4560 B10R1.21 COCNCc1ccsc1 11890153644e1e909af9b7b2120aad7a [0,0,0,0,1,0|3,0,0]=4 4561 B10R1.21 COCNCc1ccsn1 1e48a25f8b06fdc976ba945245ed35bb [0,0,0,0,1,0|3,0,0]=4 4562 B10R1.21 COCNCc1cocn1 aa5fb02551dc1d5f7f2a72b8a48bb34b [0,0,0,0,1,0|3,0,0]=4 4563 B10R1.21 COCNCc1cscn1 bce10801c73dd019748f545bb927f17c [0,0,0,0,1,0|3,0,0]=4 4564 B10R1.21 COCNCc1ncc[nH]1 d722755837fa30e284eb449f205d4537 [0,0,0,0,1,0|3,0,0]=4 4565 B10R1.21 COCNCc1ncco1 d043a8b15ac8e8808dfe091199c948fd [0,0,0,0,1,0|3,0,0]=4 4566 B10R1.21 COCNCc1nccs1 202e41462156ac4af84eb15825fa488f [0,0,0,0,1,0|3,0,0]=4 4567 B10R1.21 COCOCc1cc[nH]c1 5e7354b1e989aa7eb0bc5dc13f8b4885 [0,0,0,0,1,0|3,0,0]=4 4568 B10R1.21 COCOCc1ccc[nH]1 8602fb3b96d0845f62a61e91c638d526 [0,0,0,0,1,0|2,0,1]=4 4569 B10R1.21 COCOCc1ccco1 529eee71e246af8b856ae502514aa81f [0,0,0,0,1,0|3,0,0]=4 4570 B10R1.21 COCOCc1cccs1 8035084dd952e2619b91998ee1e10055 [0,0,0,0,1,0|3,0,0]=4 4571 B10R1.21 COCOCc1ccon1 ff29b1b8d89737fcd8a95436983cc6a5 [0,0,0,0,1,0|3,0,0]=4 4572 B10R1.21 COCOCc1ccsc1 4290534bcd79846327c3dde1810f4ca1 [0,0,0,0,1,0|3,0,0]=4 4573 B10R1.21 COCOCc1ccsn1 b2c63e603f9b324825cbfc1176c52408 [0,0,0,0,1,0|3,0,0]=4 4574 B10R1.21 COCOCc1cocn1 bedb62e7056b6565bcb94d39499d9e5e [0,0,0,0,1,0|3,0,0]=4 4575 B10R1.21 COCOCc1cscn1 102dc771e3273d6b14435080bb9699d5 [0,0,0,0,1,0|3,0,0]=4 4576 B10R1.21 COCOCc1ncc[nH]1 004647102510bf1bf740a135b7848ae8 [0,0,0,0,1,0|3,0,0]=4 4577 B10R1.21 COCOCc1ncco1 17bdc640c34efccfe1e90b9530eec152 [0,0,0,0,1,0|3,0,0]=4 4578 B10R1.21 COCOCc1nccs1 bdcb85494f3e12978e2f5f2474f894bb [0,0,0,0,1,0|3,0,0]=4 4579 B10R1.21 COCOCn1cccn1 e459438f3f7b93503eb426c5cea0a1f4 [0,0,0,0,1,0|3,0,0]=4 4580 B10R1.21 CSCCNc1c[nH]cn1 137b35293b0dc85bb31d2e32ee40a86e [0,0,0,0,1,0|3,0,0]=4 4581 B10R1.21 CSCCNc1cc[nH]n1 07979e79fed44fbdc495303e5ac54ca8 [0,0,0,0,1,0|3,0,0]=4 4582 B10R1.21 CSCCNc1ccco1 16997d2db32ec42d1356855cff785f3f [0,0,0,0,1,0|3,0,0]=4 4583 B10R1.21 CSCCNc1cccs1 01d49ac6e99e11e56f4bd6fc081c9e5f [0,0,0,0,1,0|3,0,0]=4 4584 B10R1.21 CSCCNc1ccoc1 1d0567434f0a48bd98518f53a448361e [0,0,0,0,1,0|3,0,0]=4 4585 B10R1.21 CSCCNc1ccon1 b42f16e3bc83348df538bbf682b3a77d [0,0,0,0,1,0|3,0,0]=4 4586 B10R1.21 CSCCNc1ccsc1 f6c2dced6fbf754bcf5769e0ac76907b [0,0,0,0,1,0|3,0,0]=4 4587 B10R1.21 CSCCNc1cocn1 b3453c494b24e5be45fdb2fe35bec017 [0,0,0,0,1,0|3,0,0]=4 4588 B10R1.21 CSCCNc1cscn1 bd8d18512a72c7948e2c03063ef81eee [0,0,0,0,1,0|3,0,0]=4 4589 B10R1.21 CSCCNc1ncc[nH]1 8e325de0c8c6761662fe5104b8c6cd40 [0,0,0,0,1,0|3,0,0]=4 4590 B10R1.21 CSCCNc1ncco1 8311037a857d62fbb40e2a92bfa36330 [0,0,0,0,1,0|3,0,0]=4 4591 B10R1.21 CSCCNc1nccs1 2daeff1a7635250a3e42d4dd01686512 [0,0,0,0,1,0|3,0,0]=4 4592 B10R1.21 CSCCOc1c[nH]cn1 562e0b23ec0786e0fd18550873f0babf [0,0,0,0,1,0|3,0,0]=4 4593 B10R1.21 CSCCOc1ccco1 5259ce914bbcf53da4292d4e69a6b1eb [0,0,0,0,1,0|3,0,0]=4 4594 B10R1.21 CSCCOc1cccs1 7150bd7e2c4ada0071b0350ef4644150 [0,0,0,0,1,0|3,0,0]=4 4595 B10R1.21 CSCCOc1ccsc1 24a4d86ca0141910d86531f8039bc371 [0,0,0,0,1,0|3,0,0]=4 4596 B10R1.21 CSCCOc1nccs1 cc7a7f6d66d1b43656817f4736f0ab30 [0,0,0,0,1,0|3,0,0]=4 4597 B10R1.21 CSCCOn1cccn1 0876b2802a51221ce46857a22bb0a6c2 [0,0,0,0,1,0|3,0,0]=4 4598 B10R1.21 CSCNCc1cc[nH]c1 47ed8cd436f09b3013d91e46e1b150cc [0,0,0,0,1,0|3,0,0]=4 4599 B10R1.21 CSCNCc1ccc[nH]1 fd07486fc4e4526a8ba8b2968c8e0c70 [0,0,0,0,1,0|2,0,1]=4 4600 B10R1.21 CSCNCc1ccco1 45b3d80d16b3c23ee837399e5f9cf973 [0,0,0,0,1,0|3,0,0]=4 4601 B10R1.21 CSCNCc1cccs1 19102dc4b21db64523b39a937d0f0fcd [0,0,0,0,1,0|3,0,0]=4 4602 B10R1.21 CSCNCc1ccoc1 9ad7cde6fc8060ab0463b8cc53c45142 [0,0,0,0,1,0|3,0,0]=4 4603 B10R1.21 CSCNCc1ccon1 1e01abf3644882325c1d315c695c74c8 [0,0,0,0,1,0|3,0,0]=4 4604 B10R1.21 CSCNCc1ccsc1 5227019be6bbd0bbbe6fefc9148901c2 [0,0,0,0,1,0|3,0,0]=4 4605 B10R1.21 CSCNCc1ccsn1 b51c5b3e96eaf45a94bec82116a84396 [0,0,0,0,1,0|3,0,0]=4 4606 B10R1.21 CSCNCc1cscn1 5259ffe6124310b92ee1aba846e77b47 [0,0,0,0,1,0|3,0,0]=4 4607 B10R1.21 CSCNCc1ncc[nH]1 40c91e5de4eeb94581fc1408816eaf68 [0,0,0,0,1,0|3,0,0]=4 4608 B10R1.21 CSCNCc1ncco1 4798ea10b7d60481da1dae57164d3c95 [0,0,0,0,1,0|3,0,0]=4 4609 B10R1.21 CSCNCc1nccs1 61a6ed90706090a40a3f7ad28c43b182 [0,0,0,0,1,0|3,0,0]=4 4610 B10R1.21 CSCOCc1cc[nH]c1 facfbd7c215ee7ff3015eef21b64acad [0,0,0,0,1,0|3,0,0]=4 4611 B10R1.21 CSCOCc1ccc[nH]1 227018605e900994ca4503decc33cb19 [0,0,0,0,1,0|2,0,1]=4 4612 B10R1.21 CSCOCc1ccco1 d82d2c3aff1c65cd9f5801d7e0281663 [0,0,0,0,1,0|3,0,0]=4 4613 B10R1.21 CSCOCc1cccs1 3cff4a60d95ea1637015dd5821e001bd [0,0,0,0,1,0|3,0,0]=4 4614 B10R1.21 CSCOCc1ccoc1 ba96e166b002fa1da107846027ed2a16 [0,0,0,0,1,0|3,0,0]=4 4615 B10R1.21 CSCOCc1ccon1 1bfe899a804c0f8a80fe1a74afdd3ef5 [0,0,0,0,1,0|3,0,0]=4 4616 B10R1.21 CSCOCc1ccsc1 be2d4b9bddf1d383f22e5bca6b2f8053 [0,0,0,0,1,0|3,0,0]=4 4617 B10R1.21 CSCOCc1ccsn1 42906ad1c89f99a1a9986ff6dd00de56 [0,0,0,0,1,0|3,0,0]=4 4618 B10R1.21 CSCOCc1cocn1 11ac8b5f3bf326c20db7d22284c19ab1 [0,0,0,0,1,0|3,0,0]=4 4619 B10R1.21 CSCOCc1cscn1 28843dfb70f4f0c2d3d34584c2cb29e8 [0,0,0,0,1,0|3,0,0]=4 4620 B10R1.21 CSCOCc1ncc[nH]1 3ce72e4000606ffaa325548b15ce1797 [0,0,0,0,1,0|3,0,0]=4 4621 B10R1.21 CSCOCc1ncco1 ef5ebceba7bbc1aea597ff0fe4b673ab [0,0,0,0,1,0|3,0,0]=4 4622 B10R1.21 CSCOCc1nccs1 f3cea1e7960229421db53c34b57f585e [0,0,0,0,1,0|3,0,0]=4 4623 B10R1.21 CSCOCn1cccn1 492cc4b5f71468aed4acee891d0632cc [0,0,0,0,1,0|3,0,0]=4 4624 B10R1.21 ClCCCNc1c[nH]cn1 bb0220a317ead0c6592b3f7582bc8a4e [0,0,0,0,1,0|3,0,0]=4 4625 B10R1.21 ClCCCNc1cc[nH]n1 3f92b18cad1476af962261eb75b8e597 [0,0,0,0,1,0|3,0,0]=4 4626 B10R1.21 ClCCCNc1ccco1 a6f130c8c0731f6a37b1f6ee951076be [0,0,0,0,1,0|3,0,0]=4 4627 B10R1.21 ClCCCNc1cccs1 fbce81ff25a9f7a9cf998778e28fb8cd [0,0,0,0,1,0|3,0,0]=4 4628 B10R1.21 ClCCCNc1ccoc1 45cbe26bd89149fd3b41290c34621bb6 [0,0,0,0,1,0|3,0,0]=4 4629 B10R1.21 ClCCCNc1ccon1 739ce2e3a3c406a8c80a15b12585adb0 [0,0,0,0,1,0|3,0,0]=4 4630 B10R1.21 ClCCCNc1ccsc1 3f2b42cb684b6ab2d182bb19953e2d11 [0,0,0,0,1,0|3,0,0]=4 4631 B10R1.21 ClCCCNc1ccsn1 a684b4353b73da697821658d89a10f3e [0,0,0,0,1,0|3,0,0]=4 4632 B10R1.21 ClCCCNc1cocn1 a2273b8ac52c13303da3a93d9896945c [0,0,0,0,1,0|3,0,0]=4 4633 B10R1.21 ClCCCNc1ncco1 4017e4f58a0e4152e4ac61177c419a8f [0,0,0,0,1,0|3,0,0]=4 4634 B10R1.21 ClCCCNc1nccs1 e83cede187625d1430c7d79ffea45020 [0,0,0,0,1,0|3,0,0]=4 4635 B10R1.21 FCCCNc1cc[nH]n1 69801cc105ca05935de724bcb4ff1354 [0,0,0,0,1,0|3,0,0]=4 4636 B10R1.21 FCCCNc1cccs1 31ac9134e6d62b97401471d4ea45a70d [0,0,0,0,1,0|3,0,0]=4 4637 B10R1.21 FCCCNc1ccon1 5636118c954be25d3c3aa5e5b64e214d [0,0,0,0,1,0|3,0,0]=4 4638 B10R1.21 FCCCNc1ccsc1 3ee6cbb1cf3abdca53f0740d296c57c4 [0,0,0,0,1,0|3,0,0]=4 4639 B10R1.21 FCCCNc1cocn1 79a75d2104a1f8166f40edc82f333ab6 [0,0,0,0,1,0|3,0,0]=4 4640 B10R1.21 FCCCNc1cscn1 e56e2ef2f5b2d668626dae8135004bf4 [0,0,0,0,1,0|3,0,0]=4 4641 B10R1.21 FCCCNc1ncc[nH]1 e4659d43593386233d5363471b5f7a86 [0,0,0,0,1,0|3,0,0]=4 4642 B10R1.21 FCCCNc1ncco1 9e3bd4cf48e7c0fa13708268fb89b2cb [0,0,0,0,1,0|3,0,0]=4 4643 B10R1.21 FCCCNc1nccs1 26c810bb5491fdad7ee74e1ad30be718 [0,0,0,0,1,0|3,0,0]=4 4644 B10R1.21 FCCCOc1c[nH]cn1 052363ddff55bdbd33b34583095bb26d [0,0,0,0,1,0|3,0,0]=4 4645 B10R1.21 FCCCOc1ccco1 51fe91774b9f4c69189217cc23692685 [0,0,0,0,1,0|3,0,0]=4 4646 B10R1.21 FCCCOc1cccs1 8b580ea4e86b76b5b7438bc561b77a9d [0,0,0,0,1,0|3,0,0]=4 4647 B10R1.21 FCCCOc1ccsc1 438c40c40c45bfa196d08c79e52af258 [0,0,0,0,1,0|3,0,0]=4 4648 B10R1.21 FCCCOc1nccs1 ff55bffc03ac42d25fbeed858a207a29 [0,0,0,0,1,0|3,0,0]=4 4649 B10R1.21 FCCCOn1cccn1 60bda47c80f3ea6cd83c778254f478f2 [0,0,0,0,1,0|3,0,0]=4 4650 B10R1.21 FCCNCc1cc[nH]c1 12b03c5bf60ed345aad949b52a3627a9 [0,0,0,0,1,0|3,0,0]=4 4651 B10R1.21 FCCNCc1ccc[nH]1 fe349d4505b9ed5370e7b07649f649bf [0,0,0,0,1,0|2,0,1]=4 4652 B10R1.21 FCCNCc1ccco1 eb7e2df8659dc52d8124585605ffbbe6 [0,0,0,0,1,0|3,0,0]=4 4653 B10R1.21 FCCNCc1cccs1 64161443947eeac79824d623f6441f8e [0,0,0,0,1,0|3,0,0]=4 4654 B10R1.21 FCCNCc1ccoc1 88527084bc9c645453ef6e2c7422530b [0,0,0,0,1,0|3,0,0]=4 4655 B10R1.21 FCCNCc1ccon1 fc634b0f9bf2d1641ff28fd8d1d71e64 [0,0,0,0,1,0|3,0,0]=4 4656 B10R1.21 FCCNCc1ccsc1 b3ab66b91af8c34ea5a2cd9a10019f7f [0,0,0,0,1,0|3,0,0]=4 4657 B10R1.21 FCCNCc1ccsn1 b5798f7af3fd47e3b598b2c59bd5bf26 [0,0,0,0,1,0|3,0,0]=4 4658 B10R1.21 FCCNCc1cocn1 1ae2b729c397e392d39061ce321a3c1c [0,0,0,0,1,0|3,0,0]=4 4659 B10R1.21 FCCNCc1cscn1 c66bcfc2ca583d97d49cbb2454b74a60 [0,0,0,0,1,0|3,0,0]=4 4660 B10R1.21 FCCNCc1ncc[nH]1 bfe245c91d940b9e7f32f35aa4ff243e [0,0,0,0,1,0|3,0,0]=4 4661 B10R1.21 FCCNCc1ncco1 a98d2e0ff29f8eaaf13d0f18d782e213 [0,0,0,0,1,0|3,0,0]=4 4662 B10R1.21 FCCNCc1nccs1 e6fca3e484f39625a719bbdf50d11013 [0,0,0,0,1,0|3,0,0]=4 4663 B10R1.21 FCCOCc1cc[nH]c1 0b33f8207834ef515f28cd4042eb5f0d [0,0,0,0,1,0|3,0,0]=4 4664 B10R1.21 FCCOCc1ccc[nH]1 ae4bdf41a693ab4b17eedd9a1b3e71bd [0,0,0,0,1,0|2,0,1]=4 4665 B10R1.21 FCCOCc1ccco1 967242227467dd8667ea4ec0e6be7d8a [0,0,0,0,1,0|3,0,0]=4 4666 B10R1.21 FCCOCc1cccs1 89e5f151596724dfb35cbde55e473498 [0,0,0,0,1,0|3,0,0]=4 4667 B10R1.21 FCCOCc1ccoc1 10bfd977f72341b62d2bfca992e3d43b [0,0,0,0,1,0|3,0,0]=4 4668 B10R1.21 FCCOCc1ccon1 2d4a47ec33b145c9cc07ee36a08219c9 [0,0,0,0,1,0|3,0,0]=4 4669 B10R1.21 FCCOCc1ccsc1 5cdc15980f6632241d058e32b9b99b5d [0,0,0,0,1,0|3,0,0]=4 4670 B10R1.21 FCCOCc1ccsn1 2a94a1d0ec75789da754802be65e63d2 [0,0,0,0,1,0|3,0,0]=4 4671 B10R1.21 FCCOCc1cocn1 a97d97ea7da01f1bee83be5b592ad06b [0,0,0,0,1,0|3,0,0]=4 4672 B10R1.21 FCCOCc1cscn1 cc12f9a070d8109da840e1f42abdda42 [0,0,0,0,1,0|3,0,0]=4 4673 B10R1.21 FCCOCc1ncc[nH]1 201f5e36b0f7c22a3d1fd70e66ce737e [0,0,0,0,1,0|3,0,0]=4 4674 B10R1.21 FCCOCc1ncco1 d6ca61277cdf8d6c1646c155d3d4d654 [0,0,0,0,1,0|3,0,0]=4 4675 B10R1.21 FCCOCc1nccs1 d4a9104f949413d9e76a19be706a4de9 [0,0,0,0,1,0|3,0,0]=4 4676 B10R1.21 FCCOCn1cccn1 15ea5fce9733b117a726203882b2c391 [0,0,0,0,1,0|3,0,0]=4 4677 B10R1.21 FCNCCc1c[nH]cn1 5494221e6ff8321957b1f00f7d3f58ac [0,0,0,0,1,0|3,0,0]=4 4678 B10R1.21 FCNCCc1cc[nH]n1 453a6a5d5e3345520c87478f6d3db7c8 [0,0,0,0,1,0|3,0,0]=4 4679 B10R1.21 FCNCCc1ccc[nH]1 7f781d01a7bc67bc21d7d7beac4484f1 [0,0,0,0,1,0|2,0,1]=4 4680 B10R1.21 FCNCCc1ccco1 c274e2fe40f74a5250d921378d833f9d [0,0,0,0,1,0|3,0,0]=4 4681 B10R1.21 FCNCCc1cccs1 88ba79d1c29808d8d8edddbef80e3f02 [0,0,0,0,1,0|3,0,0]=4 4682 B10R1.21 FCNCCc1ccsc1 078e8a1eb650ec980524b1574dc15e3e [0,0,0,0,1,0|3,0,0]=4 4683 B10R1.21 FCNCCc1cscn1 741620d8532723c36d5ed8157030c1f6 [0,0,0,0,1,0|3,0,0]=4 4684 B10R1.21 FCNCCc1ncc[nH]1 731b184345b66c7aff4fef9aa16fc25f [0,0,0,0,1,0|3,0,0]=4 4685 B10R1.21 FCNCCc1nccs1 84784a75c9b9ac0b6352c44b865e33bd [0,0,0,0,1,0|3,0,0]=4 4686 B10R1.21 FCNCCn1cccc1 402f5d0de25cd5256b0ed7e4d9cf69c0 [0,0,0,0,1,0|3,0,0]=4 4687 B10R1.21 FCNCCn1cccn1 1bd6ce84a011535d89a89a23cefc937f [0,0,0,0,1,0|3,0,0]=4 4688 B10R1.21 FCOCCc1c[nH]cn1 4d549ea41c918a10f0105a3f3b12fe92 [0,0,0,0,1,0|3,0,0]=4 4689 B10R1.21 FCOCCc1cc[nH]n1 5039ce57e9c2b7193db2734a96d0f629 [0,0,0,0,1,0|3,0,0]=4 4690 B10R1.21 FCOCCc1ccc[nH]1 c9539e478ac1399bce062501fc9ca424 [0,0,0,0,1,0|2,0,1]=4 4691 B10R1.21 FCOCCc1ccco1 b932bcc9cfe884b19a450cd3b0242ac1 [0,0,0,0,1,0|3,0,0]=4 4692 B10R1.21 FCOCCc1cccs1 3cabc60798d0a799d77c6a3a1fd267e4 [0,0,0,0,1,0|3,0,0]=4 4693 B10R1.21 FCOCCc1ccoc1 e77eab8c1d929f532887b6d2fc60e6b0 [0,0,0,0,1,0|3,0,0]=4 4694 B10R1.21 FCOCCc1ccon1 aa3ae114f28661c31ccce8105f15fa76 [0,0,0,0,1,0|3,0,0]=4 4695 B10R1.21 FCOCCc1ccsc1 a19a3727c3d02698fba58a803ae6170e [0,0,0,0,1,0|3,0,0]=4 4696 B10R1.21 FCOCCc1cscn1 d4aea58e5a3232319d47219f66e6635e [0,0,0,0,1,0|3,0,0]=4 4697 B10R1.21 FCOCCc1ncc[nH]1 ac062c52e912017f57f4bd334a92ab0a [0,0,0,0,1,0|3,0,0]=4 4698 B10R1.21 FCOCCc1nccs1 452774d96f8ecb2923fc4dbeaad1871b [0,0,0,0,1,0|3,0,0]=4 4699 B10R1.21 FCOCCn1cccc1 53b19cefaea779d5126b463e4453f16e [0,0,0,0,1,0|3,0,0]=4 4700 B10R1.21 FCOCCn1cccn1 2b37a8f1c45d34eb3e86a21498b6c553 [0,0,0,0,1,0|3,0,0]=4 4701 B10R1.21 ICCNCc1ccco1 bd983b5b71179f97af0b655fa1b40bbd [0,0,0,0,1,0|3,0,0]=4 4702 B10R1.21 ICCNCc1cccs1 0562d9fcb39a15007547660ec9667d57 [0,0,0,0,1,0|3,0,0]=4 4703 B10R1.21 ICCNCc1ccon1 c195e9bf126ee8bfbd8b739510f16d04 [0,0,0,0,1,0|3,0,0]=4 4704 B10R1.21 ICCNCc1ccsc1 479253904987ab74bf54c81f40b73b2f [0,0,0,0,1,0|3,0,0]=4 4705 B10R1.21 ICCNCc1cocn1 adb800905037ac709f13b2fac8430141 [0,0,0,0,1,0|3,0,0]=4 4706 B10R1.21 ICCNCc1cscn1 cb0cc06b28354bb4d6c6193f71524cb7 [0,0,0,0,1,0|3,0,0]=4 4707 B10R1.21 ICCNCc1ncc[nH]1 1d6ed99291a87221158928fe659558e0 [0,0,0,0,1,0|3,0,0]=4 4708 B10R1.21 ICCNCc1ncco1 9d3055b7896b60e9b7a5d925d5a560b6 [0,0,0,0,1,0|3,0,0]=4 4709 B10R1.21 ICCNCc1nccs1 4a895850b77212c0d69890dc411d0fe9 [0,0,0,0,1,0|3,0,0]=4 4710 B10R1.21 OCCCNc1c[nH]cn1 2de53448b514834c1715e8bdec519e9c [0,0,0,0,1,0|3,0,0]=4 4711 B10R1.21 OCCCNc1cc[nH]n1 665e79f0200627856c921cf1756ca0c6 [0,0,0,0,1,0|3,0,0]=4 4712 B10R1.21 OCCCNc1ccco1 4d624025932b70b0c8be48d0b7350012 [0,0,0,0,1,0|3,0,0]=4 4713 B10R1.21 OCCCNc1cccs1 55eef094d687f19b3a4b8d33bdca1f77 [0,0,0,0,1,0|3,0,0]=4 4714 B10R1.21 OCCCNc1ccoc1 a2c22332826702b9812fcc31344f26aa [0,0,0,0,1,0|3,0,0]=4 4715 B10R1.21 OCCCNc1ccon1 a2336d2dfac82db6e6440c8656828024 [0,0,0,0,1,0|3,0,0]=4 4716 B10R1.21 OCCCNc1ccsc1 e22178c1525770ab4ddf46226ba46d05 [0,0,0,0,1,0|3,0,0]=4 4717 B10R1.21 OCCCNc1ccsn1 b9fe66ef925d6ce96d94b099d68ecf8e [0,0,0,0,1,0|3,0,0]=4 4718 B10R1.21 OCCCNc1cocn1 66631e4f38136054e36eacbc38421a1b [0,0,0,0,1,0|3,0,0]=4 4719 B10R1.21 OCCCNc1cscn1 55aa9c9e9d91d92306ed9d031c8b037d [0,0,0,0,1,0|3,0,0]=4 4720 B10R1.21 OCCCNc1ncc[nH]1 9150591d7491467e9d32b7dc244fa38c [0,0,0,0,1,0|3,0,0]=4 4721 B10R1.21 OCCCNc1ncco1 9df59432fe5a095679b4136a055b46e3 [0,0,0,0,1,0|3,0,0]=4 4722 B10R1.21 OCCCNc1nccs1 18202e8ee8fe60275cf2bd7f986c8c5b [0,0,0,0,1,0|3,0,0]=4 4723 B10R1.21 OCCNCc1cc[nH]c1 1974eebb7f947b66ca2a4964cdd9e9e8 [0,0,0,0,1,0|3,0,0]=4 4724 B10R1.21 OCCNCc1ccc[nH]1 70b9ba075cfc1760e2d08e9e1fd27a85 [0,0,0,0,1,0|2,0,1]=4 4725 B10R1.21 OCCNCc1ccco1 507ba03e75d5eda37d046de9368bba24 [0,0,0,0,1,0|3,0,0]=4 4726 B10R1.21 OCCNCc1cccs1 20c6d4950b663f50a5c3f4e3a3001297 [0,0,0,0,1,0|3,0,0]=4 4727 B10R1.21 OCCNCc1ccoc1 e28b91217cb847e46f31456c51055291 [0,0,0,0,1,0|3,0,0]=4 4728 B10R1.21 OCCNCc1ccon1 9f93ff3f4983f30c45a8acb003b86684 [0,0,0,0,1,0|3,0,0]=4 4729 B10R1.21 OCCNCc1ccsc1 10fb8a848ce67b96a4bb082e495feac9 [0,0,0,0,1,0|3,0,0]=4 4730 B10R1.21 OCCNCc1ccsn1 8cb2daf464b89475dabd09832c4e0843 [0,0,0,0,1,0|3,0,0]=4 4731 B10R1.21 OCCNCc1cocn1 e359c236e63f935d4f4f6e8bf59c1865 [0,0,0,0,1,0|3,0,0]=4 4732 B10R1.21 OCCNCc1cscn1 d5fedcd4e1a219b8cbe9c9c0b9c2431e [0,0,0,0,1,0|3,0,0]=4 4733 B10R1.21 OCCNCc1ncc[nH]1 3ad422f58a046bcb24d6d97263e48222 [0,0,0,0,1,0|3,0,0]=4 4734 B10R1.21 OCCNCc1ncco1 e41d8f3bc0f8aecb72d6dd5103b1cd95 [0,0,0,0,1,0|3,0,0]=4 4735 B10R1.21 OCCNCc1nccs1 2be3ac7fbaee6940b3aebf32c1c64444 [0,0,0,0,1,0|3,0,0]=4 4736 B10R1.21 OCNCCc1c[nH]cn1 c090f5b8a873a83e934d30ddd4325ed3 [0,0,0,0,1,0|3,0,0]=4 4737 B10R1.21 OCNCCc1cc[nH]n1 69f0c8468b4707dd5a9636a32ff7d32e [0,0,0,0,1,0|3,0,0]=4 4738 B10R1.21 OCNCCc1ccc[nH]1 e1c3eae46650a92ca10d84d6e4068368 [0,0,0,0,1,0|2,0,1]=4 4739 B10R1.21 OCNCCc1ccco1 a517e208412caca7f657ad953f1e4b62 [0,0,0,0,1,0|3,0,0]=4 4740 B10R1.21 OCNCCc1cccs1 1b8ef25e4acd5b269ce70b8ca5f424ab [0,0,0,0,1,0|3,0,0]=4 4741 B10R1.21 OCNCCc1ccsc1 fbedc51742e1bca48984479dc3c8fec2 [0,0,0,0,1,0|3,0,0]=4 4742 B10R1.21 OCNCCc1cscn1 3b65d047d0401c4eb374c6dbd74a0aa0 [0,0,0,0,1,0|3,0,0]=4 4743 B10R1.21 OCNCCc1ncc[nH]1 38fd7c643463553288d015e5ec14d164 [0,0,0,0,1,0|3,0,0]=4 4744 B10R1.21 OCNCCc1nccs1 3e5157fe8d584e1aba8e51157f1f1ff9 [0,0,0,0,1,0|3,0,0]=4 4745 B10R1.21 OCNCCn1cccc1 ffae6d28a24a6c4800c8cb0eaea07bd0 [0,0,0,0,1,0|3,0,0]=4 4746 B10R1.21 OCNCCn1cccn1 a5dc4878c7d386a5cb81780edc57d580 [0,0,0,0,1,0|3,0,0]=4 4747 B10R1.21 SCCCNc1cc[nH]n1 f372affdea10663562e98c9f5242e718 [0,0,0,0,1,0|3,0,0]=4 4748 B10R1.21 SCCCNc1cccs1 b2bd8dd51f559a41d4ab60443e74a227 [0,0,0,0,1,0|3,0,0]=4 4749 B10R1.21 SCCCNc1ccon1 af364575bb3eb90ece0bb35653122620 [0,0,0,0,1,0|3,0,0]=4 4750 B10R1.21 SCCCNc1ccsc1 553a74043418a212ee70d4a2e2dd39e0 [0,0,0,0,1,0|3,0,0]=4 4751 B10R1.21 SCCCNc1cocn1 d435cc3d79f511271f3a4908b921f399 [0,0,0,0,1,0|3,0,0]=4 4752 B10R1.21 SCCCNc1cscn1 f9d6bb685cfd01cdd67d12d2776d3f15 [0,0,0,0,1,0|3,0,0]=4 4753 B10R1.21 SCCCNc1ncc[nH]1 c4a1fb0b501e35a4732a8c971d030d13 [0,0,0,0,1,0|3,0,0]=4 4754 B10R1.21 SCCCNc1ncco1 03f06c346af623c1d1d37064182cc0c3 [0,0,0,0,1,0|3,0,0]=4 4755 B10R1.21 SCCCNc1nccs1 9e574855e12de8e1390cef6e505027ca [0,0,0,0,1,0|3,0,0]=4 4756 B10R1.21 SCCCOc1c[nH]cn1 46e5e015529b1766a49d3c6116b14de5 [0,0,0,0,1,0|3,0,0]=4 4757 B10R1.21 SCCCOc1ccco1 22a1a116d80173010e46f2c2d267ec66 [0,0,0,0,1,0|3,0,0]=4 4758 B10R1.21 SCCCOc1cccs1 6f93465f61b75a0424c0871f86fddc3d [0,0,0,0,1,0|3,0,0]=4 4759 B10R1.21 SCCCOc1ccsc1 b9281975dbce32450eafdda76aeacab0 [0,0,0,0,1,0|3,0,0]=4 4760 B10R1.21 SCCCOc1nccs1 05d6e1e4d344d8d5bc14bbdfcc981b01 [0,0,0,0,1,0|3,0,0]=4 4761 B10R1.21 SCCCOn1cccn1 748cdbb45ff26d7a6e93ed2b8eac45a7 [0,0,0,0,1,0|3,0,0]=4 4762 B10R1.21 SCCNCc1cc[nH]c1 0a05c99a61957489ccd083a73d9af7a8 [0,0,0,0,1,0|3,0,0]=4 4763 B10R1.21 SCCNCc1ccc[nH]1 92f814f4f9ebad9c76a5b62d4428e6dc [0,0,0,0,1,0|2,0,1]=4 4764 B10R1.21 SCCNCc1ccco1 4422157518229a6c95ffdca9589320be [0,0,0,0,1,0|3,0,0]=4 4765 B10R1.21 SCCNCc1cccs1 c14456af873f39673f7684598253f2ef [0,0,0,0,1,0|3,0,0]=4 4766 B10R1.21 SCCNCc1ccoc1 1e09f98aead9483e49c58b3836e927e3 [0,0,0,0,1,0|3,0,0]=4 4767 B10R1.21 SCCNCc1ccon1 0f1532b78678f2065232d4e8c7c44f49 [0,0,0,0,1,0|3,0,0]=4 4768 B10R1.21 SCCNCc1ccsc1 a4585e6b47d0647c14037bd597cc251b [0,0,0,0,1,0|3,0,0]=4 4769 B10R1.21 SCCNCc1ccsn1 a82479a3f05616d465cd179508720863 [0,0,0,0,1,0|3,0,0]=4 4770 B10R1.21 SCCNCc1cocn1 d29b8bf612b5fdb66b86f6446df16b42 [0,0,0,0,1,0|3,0,0]=4 4771 B10R1.21 SCCNCc1cscn1 14ea0e489e345d473dd3f14aa24c3cd1 [0,0,0,0,1,0|3,0,0]=4 4772 B10R1.21 SCCNCc1ncc[nH]1 41850700b1d3726b9df2e551bed48d76 [0,0,0,0,1,0|3,0,0]=4 4773 B10R1.21 SCCNCc1ncco1 1258e7ca764084b38646a114b79b62d5 [0,0,0,0,1,0|3,0,0]=4 4774 B10R1.21 SCCNCc1nccs1 5bf7d1b4ebabc8a16cb1d6d7c01de067 [0,0,0,0,1,0|3,0,0]=4 4775 B10R1.21 SCCOCc1cc[nH]c1 330b81691ffc744cf4363fbdcca7531a [0,0,0,0,1,0|3,0,0]=4 4776 B10R1.21 SCCOCc1ccc[nH]1 4f192c4e8c3ebd7c553bf2c300880016 [0,0,0,0,1,0|2,0,1]=4 4777 B10R1.21 SCCOCc1ccco1 eb21d9a30652a8f888082605ebcb92a4 [0,0,0,0,1,0|3,0,0]=4 4778 B10R1.21 SCCOCc1cccs1 19c807d132dc7313aa96049bd57665ef [0,0,0,0,1,0|3,0,0]=4 4779 B10R1.21 SCCOCc1ccoc1 98d19ae76b74624ea52c5c78c7b3cddf [0,0,0,0,1,0|3,0,0]=4 4780 B10R1.21 SCCOCc1ccon1 414e70c283d91a41c99d09939e6523ce [0,0,0,0,1,0|3,0,0]=4 4781 B10R1.21 SCCOCc1ccsc1 81805954561c684dcbf7235bf9192fc9 [0,0,0,0,1,0|3,0,0]=4 4782 B10R1.21 SCCOCc1ccsn1 8a73aeed38a51aca77d0353f63c7f76d [0,0,0,0,1,0|3,0,0]=4 4783 B10R1.21 SCCOCc1cocn1 744e23209b92b9f1ace71a0a7df50cb6 [0,0,0,0,1,0|3,0,0]=4 4784 B10R1.21 SCCOCc1cscn1 27ee2271e698257fe22bc0b1abe4d5fa [0,0,0,0,1,0|3,0,0]=4 4785 B10R1.21 SCCOCc1ncc[nH]1 1523b702ee98deabd28f0a415a2177c7 [0,0,0,0,1,0|3,0,0]=4 4786 B10R1.21 SCCOCc1ncco1 4a4b5a156c050c2a7f702bc2b03448f2 [0,0,0,0,1,0|3,0,0]=4 4787 B10R1.21 SCCOCc1nccs1 f029db55c6d845f7bc176537a66c389d [0,0,0,0,1,0|3,0,0]=4 4788 B10R1.21 SCCOCn1cccn1 a53bd10f444ecb1d542942c607077ace [0,0,0,0,1,0|3,0,0]=4 4789 B9R0.50 C=CC(C=C)OCCCC ab7cd24288c143103860d36be86b3b7a [1,0,1,0,0,0|1,0,1]=4 4790 B9R0.45 C/C=C/C=C/COCCC 8f1e48b4facc41411447438079f84a28 [1,0,1,0,0,0|1,0,1]=4 4791 B9R0.45 C=C/C=C/CCNCCC 83f5e14c911827042616181b3195dbb3 [1,0,1,0,0,0|1,0,1]=4 4792 B9R0.45 CC=CC=CCOCCC 56450f7f936a8924869fea1d2e9622e7 [1,0,1,0,0,0|1,0,1]=4 4793 B9R0.18 C=C/C=C/C(=O)NCCC cdb1993c899e293034914219ee12d2cc [1,0,1,0,0,0|2,0,0]=4 4794 B9R0.18 C=C/C=C\C(=O)NCCC c0156ffebe98b66f4e26bb3d1670da8c [1,0,1,0,0,0|2,0,0]=4 4795 B9R0.18 C=CC=CC(=O)NCCC 4ac7d936250849aaf88bec9640f41d33 [1,0,1,0,0,0|2,0,0]=4 4796 B9R1.8 CCNc1ccccc1 33257e4a9e1d882742dfd4cfddb78cda [2,0,0,0,0,0|2,0,0]=4 4797 B9R1.8 CCNc1ccccn1 2525c23bd886b96c78c0be1e9ad1905b [2,0,0,0,0,0|1,0,0]=3 4798 B9R1.8 CCNc1cccnn1 8ce46420a68f085572db040256d5d2b7 [2,0,0,0,0,0|2,0,0]=4 4799 B9R1.8 CCNc1ccncn1 e04846be86a5c479e545d0cb402fe182 [2,0,0,0,0,0|2,0,0]=4 4800 B9R1.8 CCNc1cnccn1 692286fa82997f2fb685e4d3ad5b2443 [2,0,0,0,0,0|2,0,0]=4 4801 B9R1.8 CCNc1ncccn1 e5f30c193b5ab11515bad37a4470b1a9 [2,0,0,0,0,0|2,0,0]=4 4802 B9R1.8 CCOc1ccccn1 8b10ed115fcb5b65f209d3b07c05b728 [2,0,0,0,0,0|1,0,0]=3 4803 B9R1.8 CCOc1cnccn1 aa9d1d61b4f8dce5da42fe3ddcc6df85 [2,0,0,0,0,0|2,0,0]=4 4804 B9R1.8 CCOc1ncccn1 c537ae1cbb412be3ee508a248bc8885d [2,0,0,0,0,0|2,0,0]=4 4805 B9R1.8 FCNc1ccccn1 e54f22e64e1a3858aca2c223c703a3f4 [2,0,0,0,0,0|2,0,0]=4 4806 B9R1.8 FCOc1ccccn1 104b8f973c7a9ebb04a489743f7e956b [2,0,0,0,0,0|2,0,0]=4 4807 B9R1.8 OCNc1ccccn1 d59bc8d9974c705420d0aeed6cce1b06 [2,0,0,0,0,0|2,0,0]=4 4808 B11R0.80 C=CCN(CC=C)CCCCC d18e52e9f3b904f97444772db0ebbab8 [0,1,1,0,0,0|2,0,0]=4 4809 B11R0.152 C=CCOC(C=C)CCCCC 28f094d851e2f8edbc9fb7f3daab0322 [0,1,1,0,0,0|1,0,1]=4 4810 B11R0.152 C=CCO[C@H](C=C)CCCCC f18c4a73f7890c9df984fb47b0ab11b4 [0,1,1,0,0,0|1,0,1]=4 4811 B11R0.161 C=CCC(C=C)OCCCCC 11a7331285aab9c355cd05e3e93ca6ac [0,1,1,0,0,0|1,0,1]=4 4812 B11R0.3 C/C=C/C=C/COCCCCC 2667a603d2690530aadc1c08dc0a0108 [0,1,1,0,0,0|1,0,1]=4 4813 B11R0.3 C=C/C=C/CCNCCCCC 866990222c3bfaa99a0b3824725b9ce5 [0,1,1,0,0,0|1,0,1]=4 4814 B11R0.3 CC=CC=CCOCCCCC 0a414855753f5c15a0899ce0a42b5368 [0,1,1,0,0,0|1,0,1]=4 4815 B11R0.81 C=C/C=C/C(=O)NCCCCC 6e00bb4eccd15303cdadb3826fe27155 [0,1,1,0,0,0|2,0,0]=4 4816 B11R0.81 C=C/C=C\C(=O)NCCCCC ff69046eef2fc88efd8ad9cedefb5182 [0,1,1,0,0,0|2,0,0]=4 4817 B11R0.81 C=CC=CC(=O)NCCCCC f3829a56cfc09f603668e5f9db569660 [0,1,1,0,0,0|2,0,0]=4 4818 B11R0.140 C/C=C/C=C/C(=O)NCCCC 7a886652e33d103605624db7191b1c42 [0,1,1,0,0,0|2,0,0]=4 4819 B11R0.140 CC=CC=CC(=O)NCCCC 00ad07ea2e0420f3ecd32dc6ed13e273 [0,1,1,0,0,0|2,0,0]=4 4820 B11R0.5 C=C/C=C/C(=O)NC(C)CCC 676080b024df99124d74e9065fe6d716 [0,1,1,0,0,0|2,0,0]=4 4821 B11R0.5 C=C/C=C/C(=O)N[C@@H](C)CCC 432bc8494aa7f676f67fdc685e693f81 [0,1,1,0,0,0|2,0,0]=4 4822 B11R0.5 C=C/C=C\C(=O)NC(C)CCC 73532fe150570cc22a360fd39c095c9e [0,1,1,0,0,0|2,0,0]=4 4823 B11R0.5 C=C/C=C\C(=O)N[C@@H](C)CCC aad60085b4968cb0ee510fadfa1080fe [0,1,1,0,0,0|2,0,0]=4 4824 B11R0.5 C=CC=CC(=O)NC(C)CCC 586c5cda38d0b5f6dada0d3c97fba101 [0,1,1,0,0,0|2,0,0]=4 4825 B11R0.5 C=CC=CC(=O)N[C@@H](C)CCC 4de9047a4ba662a44b7a040daaa015b1 [0,1,1,0,0,0|2,0,0]=4 4826 B11R0.11 C=C/C=C/C(=O)N(C)CCCC fd24222aaedcb65d16fb275400e2d714 [0,1,1,0,0,0|2,0,0]=4 4827 B11R0.11 C=C/C=C\C(=O)N(C)CCCC 4d583897fc528debb5dc14c781612f16 [0,1,1,0,0,0|2,0,0]=4 4828 B11R0.11 C=CC=CC(=O)N(C)CCCC 1b9de6e20ce9d42bec614044b02646a4 [0,1,1,0,0,0|2,0,0]=4 4829 B11R0.70 C=C/C=C/C(=O)NCC(C)CC 75c2412b04fa80538a0c5275ef90d072 [0,1,1,0,0,0|2,0,0]=4 4830 B11R0.70 C=C/C=C/C(=O)NCC(O)CC 46b3d7ae40ee4895356ce79870f07402 [0,1,1,0,0,0|2,0,0]=4 4831 B11R0.70 C=C/C=C/C(=O)NC[C@@H](C)CC 10c73f4588b1b7d3863d67d6f1c05a6d [0,1,1,0,0,0|2,0,0]=4 4832 B11R0.70 C=C/C=C/C(=O)NC[C@H](O)CC 35f23d209147f2bc212da611ab13d385 [0,1,1,0,0,0|2,0,0]=4 4833 B11R0.70 C=C/C=C\C(=O)NCC(C)CC 464f5c21b688a98cfd88b5deb0f95d57 [0,1,1,0,0,0|2,0,0]=4 4834 B11R0.70 C=C/C=C\C(=O)NCC(O)CC 66bf34d36a3ba10842a35c5299faffb3 [0,1,1,0,0,0|2,0,0]=4 4835 B11R0.70 C=C/C=C\C(=O)NC[C@@H](C)CC d7153e21594406239f2e22b2c6982925 [0,1,1,0,0,0|2,0,0]=4 4836 B11R0.70 C=C/C=C\C(=O)NC[C@H](O)CC eb1db659a45fd48bbf2d666c9a4c288f [0,1,1,0,0,0|2,0,0]=4 4837 B11R0.70 C=CC=CC(=O)NCC(C)CC fa922526f61b6c3a96fed8b172e53461 [0,1,1,0,0,0|2,0,0]=4 4838 B11R0.70 C=CC=CC(=O)NCC(O)CC 4fd5926990dbe98890293f18d8ff8e02 [0,1,1,0,0,0|2,0,0]=4 4839 B11R0.70 C=CC=CC(=O)NC[C@@H](C)CC 1ec0653d649285d825224cdc1ab02aa7 [0,1,1,0,0,0|2,0,0]=4 4840 B11R0.70 C=CC=CC(=O)NC[C@H](O)CC 101fc6d7fcc37cad5b6a9abe86e4013d [0,1,1,0,0,0|2,0,0]=4 4841 B11R0.147 C=C/C=C/C(=O)NCCC(C)C f18d94e6ef784a3f506f3e451fa63d08 [0,1,1,0,0,0|2,0,0]=4 4842 B11R0.147 C=C/C=C/C(=O)NCCC(C)O 2f5b9eb732d8c19eddc654c5ee11e5fd [0,1,1,0,0,0|2,0,0]=4 4843 B11R0.147 C=C/C=C/C(=O)NCC[C@@H](C)O 9861a42da1d6c58f099ab52eae62f9fe [0,1,1,0,0,0|2,0,0]=4 4844 B11R0.147 C=C/C=C/C(=O)NCC[C@H](C)O 20446bd7bdf5bc3f8363c3eb8269149a [0,1,1,0,0,0|2,0,0]=4 4845 B11R0.147 C=C/C=C\C(=O)NCCC(C)C 2ae5eb05a04ab6607636d599273f8f64 [0,1,1,0,0,0|2,0,0]=4 4846 B11R0.147 C=C/C=C\C(=O)NCCC(C)O 21c9d4f195706468819f047cbd5320ad [0,1,1,0,0,0|2,0,0]=4 4847 B11R0.147 C=C/C=C\C(=O)NCC[C@@H](C)O 9dce3ab8ddd755d4eef93d598f5c6bd5 [0,1,1,0,0,0|2,0,0]=4 4848 B11R0.147 C=C/C=C\C(=O)NCC[C@H](C)O 90e0f4d28f2742d488d9ccef1bdae3e8 [0,1,1,0,0,0|2,0,0]=4 4849 B11R0.147 C=CC=CC(=O)NCCC(C)C ff3acd03de51ebd5fbd9be8285828085 [0,1,1,0,0,0|2,0,0]=4 4850 B11R0.147 C=CC=CC(=O)NCCC(C)O ff675b0886fdfa9130aa1e5a216c2db2 [0,1,1,0,0,0|2,0,0]=4 4851 B11R0.147 C=CC=CC(=O)NCC[C@@H](C)O 59ee544967596edba09422ecbf217a8d [0,1,1,0,0,0|2,0,0]=4 4852 B11R0.147 C=CC=CC(=O)NCC[C@H](C)O 236bf0e92636b28533b494c6964c8eb9 [0,1,1,0,0,0|2,0,0]=4 4853 B11R1.1 CCCNc1ccc(cc1)Br 95e3de2d252597fde5ce9a477304d00e [1,1,0,0,0,0|2,0,0]=4 4854 B11R1.1 CCCNc1ccc(cc1)C 60206ed79d50ce0b51d2c9baa6a9bfd8 [1,1,0,0,0,0|2,0,0]=4 4855 B11R1.1 CCCNc1ccc(cc1)Cl 78619a742ccf6ba08a4394e2ee033c54 [1,1,0,0,0,0|2,0,0]=4 4856 B11R1.1 CCCNc1ccc(cc1)F 03593481ab116133e85310d463cb3940 [1,1,0,0,0,0|2,0,0]=4 4857 B11R1.1 CCCNc1ccc(cc1)I 1d619469e460bbb1d49ca10b65682c62 [1,1,0,0,0,0|2,0,0]=4 4858 B11R1.1 CCCNc1ccc(cc1)S 5de90476a8c0464c76157dc952d2c04c [1,1,0,0,0,0|2,0,0]=4 4859 B11R1.1 CCCNc1ccc(cn1)Br 21ad52c0b7cad2f16279c41b12c3dd20 [1,1,0,0,0,0|1,0,0]=3 4860 B11R1.1 CCCNc1ccc(cn1)C 49b1b111cca17d95ac5b969044ae90fe [1,1,0,0,0,0|1,0,0]=3 4861 B11R1.1 CCCNc1ccc(cn1)Cl a95c01f05e53613156fba3b0f8d7f780 [1,1,0,0,0,0|1,0,0]=3 4862 B11R1.1 CCCNc1ccc(cn1)F bd191ccc5254163826bb8b5b65ee6ba9 [1,1,0,0,0,0|1,0,0]=3 4863 B11R1.1 CCCNc1ccc(cn1)I 3117f77f4a2d396d13ad23c0ed5be14e [1,1,0,0,0,0|1,0,0]=3 4864 B11R1.1 CCCNc1ccc(nn1)Br ccdcddb968ec068533be8b8680a79244 [1,1,0,0,0,0|2,0,0]=4 4865 B11R1.1 CCCNc1ccc(nn1)C 4a47f404f21e29fa778a561433c0b743 [1,1,0,0,0,0|2,0,0]=4 4866 B11R1.1 CCCNc1ccc(nn1)Cl 7ecc7b5a3c836aee1090e838fbe3ae62 [1,1,0,0,0,0|2,0,0]=4 4867 B11R1.1 CCCNc1ccc(nn1)F dd7d3bea14bb07d9e27ae9cdfe38c20b [1,1,0,0,0,0|2,0,0]=4 4868 B11R1.1 CCCNc1ccc(nn1)I 8e7333ea5a9771bb7ada2e8999ebdfb9 [1,1,0,0,0,0|2,0,0]=4 4869 B11R1.1 CCCNc1cnc(cn1)Br 3dbfefa68fc5da70500dcddd3fcb8c8f [1,1,0,0,0,0|2,0,0]=4 4870 B11R1.1 CCCNc1cnc(cn1)C 8a7aa0209c65f0751183b5a5e627c60d [1,1,0,0,0,0|2,0,0]=4 4871 B11R1.1 CCCNc1cnc(cn1)Cl 6e2e446e145945cda8558d44b29bbfd9 [1,1,0,0,0,0|2,0,0]=4 4872 B11R1.1 CCCNc1cnc(cn1)I 6202f119a68d18841749f02b15b96196 [1,1,0,0,0,0|2,0,0]=4 4873 B11R1.1 CCCNc1ncc(cn1)Br 56877f4f5f96eb464258c4679b8253a4 [1,1,0,0,0,0|2,0,0]=4 4874 B11R1.1 CCCNc1ncc(cn1)C ed908b7ca7d2ae1e9bbe46369c508790 [1,1,0,0,0,0|2,0,0]=4 4875 B11R1.1 CCCNc1ncc(cn1)Cl 03b3ce9b0bc7ca0f5e77f05610127bc2 [1,1,0,0,0,0|2,0,0]=4 4876 B11R1.1 CCCNc1ncc(cn1)F aa7c389086dabb2d5503500ee25facb6 [1,1,0,0,0,0|2,0,0]=4 4877 B11R1.1 CCCNc1ncc(cn1)I f360c957e12d39c4d43e7b791e83f543 [1,1,0,0,0,0|2,0,0]=4 4878 B11R1.1 CCCOc1ccc(cc1)Br fcee74d69e8e023a5434abc8b0385424 [1,1,0,0,0,0|2,0,0]=4 4879 B11R1.1 CCCOc1ccc(cc1)C 4fdcf2ff939bb0420513a197f77843e9 [1,1,0,0,0,0|2,0,0]=4 4880 B11R1.1 CCCOc1ccc(cc1)Cl 6ca291266ab2c05a274ea67a7fbcb647 [1,1,0,0,0,0|2,0,0]=4 4881 B11R1.1 CCCOc1ccc(cc1)F 18444060e70b801a4550e15d090495f3 [1,1,0,0,0,0|2,0,0]=4 4882 B11R1.1 CCCOc1ccc(cc1)I 1cc2cc68a2ed4244fd1e94b3d6df9d5e [1,1,0,0,0,0|2,0,0]=4 4883 B11R1.1 CCCOc1ccc(cc1)S 5c2ad8fc9e5698065bd7177da22c3e46 [1,1,0,0,0,0|2,0,0]=4 4884 B11R1.1 CCCOc1ccc(cn1)C a2aa3425c184ebbd01762c44679803c0 [1,1,0,0,0,0|1,0,0]=3 4885 B11R1.1 CCCOc1ccc(cn1)Cl 0c1b7fe9f246d104ebcbc468a16004c1 [1,1,0,0,0,0|1,0,0]=3 4886 B11R1.1 CCCOc1ccc(cn1)F 6a93fffcdab2ace921c013c1d2a630f1 [1,1,0,0,0,0|1,0,0]=3 4887 B11R1.1 CCCOc1ccc(cn1)I ca1682e59f74f1735f8a64800a62750a [1,1,0,0,0,0|1,0,0]=3 4888 B11R1.1 CCCOc1ccc(nn1)Br ca5d040c8581350c48d8935145ece88b [1,1,0,0,0,0|2,0,0]=4 4889 B11R1.1 CCCOc1ccc(nn1)C c27dff73ed2f7d87764f5d3661cdeb9f [1,1,0,0,0,0|2,0,0]=4 4890 B11R1.1 CCCOc1ccc(nn1)Cl 489433f97f5e5f36cd4875eb8c146641 [1,1,0,0,0,0|2,0,0]=4 4891 B11R1.1 CCCOc1cnc(cn1)Br eb7d8eeeed4e6306f134f86a21893054 [1,1,0,0,0,0|2,0,0]=4 4892 B11R1.1 CCCOc1cnc(cn1)C 03ab54fe3c16961ce0c5fdc0fd5a9600 [1,1,0,0,0,0|2,0,0]=4 4893 B11R1.1 CCCOc1cnc(cn1)Cl a5a301809a45e660e1887859209b0546 [1,1,0,0,0,0|2,0,0]=4 4894 B11R1.1 CCCOc1cnc(cn1)I 16281406a510ee3ee4a386b2674a0229 [1,1,0,0,0,0|2,0,0]=4 4895 B11R1.1 CCCOc1ncc(cn1)Br 37f78dfab6b44f8a191b0e3ce4ac390a [1,1,0,0,0,0|2,0,0]=4 4896 B11R1.1 CCCOc1ncc(cn1)C beeaa7048dea8c1a1967265578580e9f [1,1,0,0,0,0|2,0,0]=4 4897 B11R1.1 CCCOc1ncc(cn1)F c84594084e7b9b80f17d4cd2e40f468e [1,1,0,0,0,0|2,0,0]=4 4898 B11R1.1 CCCOc1ncc(cn1)I c844c34a2872657b343cf859afb34770 [1,1,0,0,0,0|2,0,0]=4 4899 B11R1.1 CCNCc1ccc(cc1)Br 2cd51938999c20d02733c25a0b5c4804 [1,1,0,0,0,0|2,0,0]=4 4900 B11R1.1 CCNCc1ccc(cc1)C 587aa1ee1f45a7f7f3762adcf6ab1e89 [1,1,0,0,0,0|2,0,0]=4 4901 B11R1.1 CCNCc1ccc(cc1)Cl 521dc09ab663236062b599824b274153 [1,1,0,0,0,0|2,0,0]=4 4902 B11R1.1 CCNCc1ccc(cc1)F 507a49f5c428a46a95718b00a3fd1bd9 [1,1,0,0,0,0|2,0,0]=4 4903 B11R1.1 CCNCc1ccc(cc1)I cb00fc5924e1405950f010ec806d6a94 [1,1,0,0,0,0|2,0,0]=4 4904 B11R1.1 CCNCc1ccc(cn1)Br 882a30c5c31be62d8df2ad05ade9700e [1,1,0,0,0,0|1,0,0]=3 4905 B11R1.1 CCNCc1ccc(cn1)C ce28a7edd6e5cb339d15632619449df9 [1,1,0,0,0,0|1,0,0]=3 4906 B11R1.1 CCNCc1ccc(cn1)Cl a8b3098af6f06b71ef76b0a789adb905 [1,1,0,0,0,0|1,0,0]=3 4907 B11R1.1 CCNCc1ccc(cn1)F 8ce16a3c3b9cfcc722411ae28895539b [1,1,0,0,0,0|1,0,0]=3 4908 B11R1.1 CCNCc1ccc(nn1)C eb19abdb6fa5bbee3b70e5fa3639bbb5 [1,1,0,0,0,0|2,0,0]=4 4909 B11R1.1 CCNCc1ccc(nn1)Cl 5d8791c87f02ef2da6feeee59195419f [1,1,0,0,0,0|2,0,0]=4 4910 B11R1.1 CCNCc1cnc(cn1)Br 75b2c18e8299485b63bfe9e5d4135615 [1,1,0,0,0,0|2,0,0]=4 4911 B11R1.1 CCNCc1cnc(cn1)C c7cd472ae379c00b6048324cd973a09b [1,1,0,0,0,0|2,0,0]=4 4912 B11R1.1 CCNCc1cnc(cn1)Cl e187dc8018fb65cbf1b762ca3fbfe810 [1,1,0,0,0,0|2,0,0]=4 4913 B11R1.1 CCNCc1ncc(cn1)Br f056937bae9b5babadd4fa0c8ef36cdb [1,1,0,0,0,0|2,0,0]=4 4914 B11R1.1 CCNCc1ncc(cn1)C 21af8a6bfdc9157639ae2eb8237e5056 [1,1,0,0,0,0|2,0,0]=4 4915 B11R1.1 CCNCc1ncc(cn1)Cl eb06a83d2ff4e8e78df201ffae6b3ba9 [1,1,0,0,0,0|2,0,0]=4 4916 B11R1.1 CCNCc1ncc(cn1)F 3e58af83559a2568784170fa73c65eba [1,1,0,0,0,0|2,0,0]=4 4917 B11R1.1 CCOCc1ccc(cc1)Br 55e365425e5287f17bedcdf9c6cf8797 [1,1,0,0,0,0|2,0,0]=4 4918 B11R1.1 CCOCc1ccc(cc1)C 4d215a4a9529a309b910ed7006942890 [1,1,0,0,0,0|2,0,0]=4 4919 B11R1.1 CCOCc1ccc(cc1)Cl 162fb8a5396843344a75f2243153a2a9 [1,1,0,0,0,0|2,0,0]=4 4920 B11R1.1 CCOCc1ccc(cc1)F 67e386059816bee45125127b16cfcbee [1,1,0,0,0,0|2,0,0]=4 4921 B11R1.1 CCOCc1ccc(cc1)I 25d977d51d9f47d9f153070d57dca8b8 [1,1,0,0,0,0|2,0,0]=4 4922 B11R1.1 CCOCc1ccc(cc1)S 51de74da01a41ad35713330690173be6 [1,1,0,0,0,0|2,0,0]=4 4923 B11R1.1 CCOCc1ccc(cn1)Br 7fa2d6660ca0fac0c5d496c90646d302 [1,1,0,0,0,0|1,0,0]=3 4924 B11R1.1 CCOCc1ccc(cn1)C d87497b35c5f44e142aec59de5813e88 [1,1,0,0,0,0|1,0,0]=3 4925 B11R1.1 CCOCc1ccc(cn1)Cl 6991b553b81a946d1923a2d827bfdbc3 [1,1,0,0,0,0|1,0,0]=3 4926 B11R1.1 CCOCc1ccc(cn1)F c13b565598015e639c197d30e6fbe232 [1,1,0,0,0,0|1,0,0]=3 4927 B11R1.1 CCOCc1ccc(cn1)I 401d1ae041509fd6bf393ad89597efa1 [1,1,0,0,0,0|1,0,0]=3 4928 B11R1.1 CCOCc1ccc(nn1)C 25715347b166dc0e3fa1b4f7090bb697 [1,1,0,0,0,0|2,0,0]=4 4929 B11R1.1 CCOCc1ccc(nn1)Cl ac07200b3f9b3b1058c1d205c3caafe5 [1,1,0,0,0,0|2,0,0]=4 4930 B11R1.1 CCOCc1cnc(cn1)Br 0b1905360ed53097dd5446844fb9d44e [1,1,0,0,0,0|2,0,0]=4 4931 B11R1.1 CCOCc1cnc(cn1)C b885c2b2dd24eed4b75af88d0f2ca8e7 [1,1,0,0,0,0|2,0,0]=4 4932 B11R1.1 CCOCc1cnc(cn1)Cl 37e2370a54551fed3ce526f1f0ca25f7 [1,1,0,0,0,0|2,0,0]=4 4933 B11R1.1 CCOCc1ncc(cn1)Br 2b985aa3a1e51eb1ec0bfffbbed61b5d [1,1,0,0,0,0|2,0,0]=4 4934 B11R1.1 CCOCc1ncc(cn1)C efcb1280143d25af755f57996ed9be19 [1,1,0,0,0,0|2,0,0]=4 4935 B11R1.1 CCOCc1ncc(cn1)Cl 1a16c85fe3aa6d40b0bb233d349e2470 [1,1,0,0,0,0|2,0,0]=4 4936 B11R1.1 CCOCc1ncc(cn1)F 87b2a932637bebcc07989a9522eb1b07 [1,1,0,0,0,0|2,0,0]=4 4937 B11R1.1 COCNc1ccc(cn1)Br 1c720799b81f195c61b333a1f89190a8 [1,1,0,0,0,0|2,0,0]=4 4938 B11R1.1 COCNc1ccc(cn1)C dfa9e7f1e71b67e682014a3887f5529f [1,1,0,0,0,0|2,0,0]=4 4939 B11R1.1 COCNc1ccc(cn1)Cl 97b49df12f3a921c9e3552ee1e5e784a [1,1,0,0,0,0|2,0,0]=4 4940 B11R1.1 COCNc1ccc(cn1)F 5ab2d6422d4a1c3846fcacb1a633ff1f [1,1,0,0,0,0|2,0,0]=4 4941 B11R1.1 COCNc1ccc(cn1)I 79f06f1a860ef23cb3610db9ed31701e [1,1,0,0,0,0|2,0,0]=4 4942 B11R1.1 COCOc1ccc(cn1)C 1843af41304aa6e2c88f2a0c48329c6c [1,1,0,0,0,0|2,0,0]=4 4943 B11R1.1 COCOc1ccc(cn1)Cl 76d137fbe0f9bd159ffa6657e8141956 [1,1,0,0,0,0|2,0,0]=4 4944 B11R1.1 COCOc1ccc(cn1)F ea228b8dcd59e2d303f724d0e06cdd97 [1,1,0,0,0,0|2,0,0]=4 4945 B11R1.1 COCOc1ccc(cn1)I 6a318e58869e2af374a0226b608f1874 [1,1,0,0,0,0|2,0,0]=4 4946 B11R1.1 CSCNc1ccc(cn1)Br d92ad14722de594cb72f592378f03b0e [1,1,0,0,0,0|2,0,0]=4 4947 B11R1.1 CSCNc1ccc(cn1)C 7d8d228d08f638bf041a5d3c93910cdd [1,1,0,0,0,0|2,0,0]=4 4948 B11R1.1 CSCNc1ccc(cn1)Cl b04370fd562137475983ddbca974054e [1,1,0,0,0,0|2,0,0]=4 4949 B11R1.1 CSCNc1ccc(cn1)F 309f8c513d2fecfdc07e9f1a2e722d64 [1,1,0,0,0,0|2,0,0]=4 4950 B11R1.1 CSCNc1ccc(cn1)I f5ba8214d3f7399c81b46c05a2c196a8 [1,1,0,0,0,0|2,0,0]=4 4951 B11R1.1 CSCOc1ccc(cn1)C 23dab940603659dd1961d8dabf9e9d54 [1,1,0,0,0,0|2,0,0]=4 4952 B11R1.1 CSCOc1ccc(cn1)Cl 267a2b42ae207e68f7e607ae81db2125 [1,1,0,0,0,0|2,0,0]=4 4953 B11R1.1 CSCOc1ccc(cn1)F 5369a20d0af3e7b5d9bf45f8e5768082 [1,1,0,0,0,0|2,0,0]=4 4954 B11R1.1 CSCOc1ccc(cn1)I 2e95527b9e2725ee105d852c39d59c2e [1,1,0,0,0,0|2,0,0]=4 4955 B11R1.1 Cc1ccc(nc1)CNCF a2ae316dbd0bb13a861c9dac3c80cf57 [1,1,0,0,0,0|2,0,0]=4 4956 B11R1.1 Cc1ccc(nc1)CNCO 8b5ed39717274fd8ed92909f510b435c [1,1,0,0,0,0|2,0,0]=4 4957 B11R1.1 Cc1ccc(nc1)COCF 8c39601fc22b07f8712ea33f68ec1dbf [1,1,0,0,0,0|2,0,0]=4 4958 B11R1.1 Cc1ccc(nc1)NCCF 06c1e16ffeb1ab85a569cd0e334ae6b2 [1,1,0,0,0,0|2,0,0]=4 4959 B11R1.1 Cc1ccc(nc1)NCCO 89539a4a1231df63bf072dde77e69a2d [1,1,0,0,0,0|2,0,0]=4 4960 B11R1.1 Cc1ccc(nc1)NCCS 69a8c11eca8289a9654e21b03bcd9530 [1,1,0,0,0,0|2,0,0]=4 4961 B11R1.1 Cc1ccc(nc1)OCCF 07dcb840a80fa7cbdd901daf4d527f50 [1,1,0,0,0,0|2,0,0]=4 4962 B11R1.1 Cc1ccc(nc1)OCCS c0e97758fad975d9872b78bd47384ac8 [1,1,0,0,0,0|2,0,0]=4 4963 B11R1.1 FCCNc1ccc(cn1)Br 3f032646448fe390c3e2eb7c9f0340fb [1,1,0,0,0,0|2,0,0]=4 4964 B11R1.1 FCCNc1ccc(cn1)Cl 099b0366560a094d477ba72f02802098 [1,1,0,0,0,0|2,0,0]=4 4965 B11R1.1 FCCNc1ccc(cn1)F d18108661df3b156b54b5b0e241a96f7 [1,1,0,0,0,0|2,0,0]=4 4966 B11R1.1 FCCNc1ccc(cn1)I 83a422430eb181b6cd15fdc584932f83 [1,1,0,0,0,0|2,0,0]=4 4967 B11R1.1 FCCOc1ccc(cn1)Cl b3e4a78af085b1d8a0cc04fa3d2b9697 [1,1,0,0,0,0|2,0,0]=4 4968 B11R1.1 FCCOc1ccc(cn1)F 09a0361ca931a8815d595adcfa70dfc5 [1,1,0,0,0,0|2,0,0]=4 4969 B11R1.1 FCCOc1ccc(cn1)I c881f50d40edf1b68b0c0f26e5461697 [1,1,0,0,0,0|2,0,0]=4 4970 B11R1.1 FCNCc1ccc(cn1)Br 94657af0bd8c4405cbbc4eaa4ffee2a0 [1,1,0,0,0,0|2,0,0]=4 4971 B11R1.1 FCNCc1ccc(cn1)Cl cce15c536bf4a9ea70c6d5eecfbcc8f5 [1,1,0,0,0,0|2,0,0]=4 4972 B11R1.1 FCNCc1ccc(cn1)F 2fbb419c0ebed0c99c9e4221c90b61d5 [1,1,0,0,0,0|2,0,0]=4 4973 B11R1.1 FCOCc1ccc(cn1)Br 2cff720254f33336759fb5ca9479388f [1,1,0,0,0,0|2,0,0]=4 4974 B11R1.1 FCOCc1ccc(cn1)Cl 580c540efe3c49a7a19e2d9b432e11d5 [1,1,0,0,0,0|2,0,0]=4 4975 B11R1.1 FCOCc1ccc(cn1)F 1bb531fece1ae15a51af6ee1772e0067 [1,1,0,0,0,0|2,0,0]=4 4976 B11R1.1 FCOCc1ccc(cn1)I c87ccc15c68a7dc6b58ab9811a041353 [1,1,0,0,0,0|2,0,0]=4 4977 B11R1.1 Fc1ccc(nc1)NCCS eadd69409288b61ab12eacb9e50162ce [1,1,0,0,0,0|2,0,0]=4 4978 B11R1.1 Fc1ccc(nc1)OCCS 3e877b70e347acb690df074056e728c6 [1,1,0,0,0,0|2,0,0]=4 4979 B11R1.1 OCCNc1ccc(cn1)Br 697c3de2afaae9bbb982c9a6366dab99 [1,1,0,0,0,0|2,0,0]=4 4980 B11R1.1 OCCNc1ccc(cn1)Cl bece4a641c5ba21cb6f601a8cec5b6e4 [1,1,0,0,0,0|2,0,0]=4 4981 B11R1.1 OCCNc1ccc(cn1)F 9ca695181e9e504e36cd02cea32905b6 [1,1,0,0,0,0|2,0,0]=4 4982 B11R1.1 OCCNc1ccc(cn1)I d44ab634a65882279d333c5c872969b4 [1,1,0,0,0,0|2,0,0]=4 4983 B11R1.1 OCNCc1ccc(cn1)Br 7f3d19f9771c479964bba22b4616ef61 [1,1,0,0,0,0|2,0,0]=4 4984 B11R1.1 OCNCc1ccc(cn1)Cl ad113e6a1148f2e84481c6ee13c725cd [1,1,0,0,0,0|2,0,0]=4 4985 B11R1.1 OCNCc1ccc(cn1)F 2e534136875f673e3baed66e480ece0d [1,1,0,0,0,0|2,0,0]=4 4986 B11R1.1 SCCNc1ccc(cn1)Br f6b3ae38db4d208d9472a656cf209759 [1,1,0,0,0,0|2,0,0]=4 4987 B11R1.1 SCCNc1ccc(cn1)Cl 370f82690d6577b3a5e4d98e9b20b4f5 [1,1,0,0,0,0|2,0,0]=4 4988 B11R1.1 SCCNc1ccc(cn1)I e98b3cd9100a365b7ae469cccc303ad0 [1,1,0,0,0,0|2,0,0]=4 4989 B11R1.1 SCCOc1ccc(cn1)Cl cfe42552e9127c0fb0aa4c2a6f99c83c [1,1,0,0,0,0|2,0,0]=4 4990 B11R1.1 SCCOc1ccc(cn1)I 20a50db09c759c9079c8425e41725441 [1,1,0,0,0,0|2,0,0]=4 4991 B11R1.16 CC(NCF)c1ccccn1 0905269fa9a0af5b89b0863135e0ba86 [1,1,0,0,0,0|2,0,0]=4 4992 B11R1.16 CC(NCO)c1ccccn1 92e2d7a3e5eb4a0cf656a3abd8120ca1 [1,1,0,0,0,0|2,0,0]=4 4993 B11R1.16 CC(OCF)c1ccccn1 2375003933f3ce846737f38420e767b3 [1,1,0,0,0,0|2,0,0]=4 4994 B11R1.16 CCCN(C)c1ccccc1 5333b12ce18e2a38096b8e486fed114a [1,1,0,0,0,0|2,0,0]=4 4995 B11R1.16 CCCN(C)c1ccccn1 8ff1db8620efe8553f2af13d547cf9e1 [1,1,0,0,0,0|1,0,0]=3 4996 B11R1.16 CCCN(C)c1ccncn1 bd7fe4185816fe05bec7bd92de86498a [1,1,0,0,0,0|2,0,0]=4 4997 B11R1.16 CCCN(C)c1cnccn1 7515a4a7db1f95bb8312ff50e22bcdd1 [1,1,0,0,0,0|2,0,0]=4 4998 B11R1.16 CCCN(C)c1ncccn1 0ce0ace55fb174ccdc6819afe0f51fcd [1,1,0,0,0,0|2,0,0]=4 4999 B11R1.16 CCNC(C)c1ccccc1 af03e39d181c5fd668bda5d6f7d06e14 [1,1,0,0,0,0|2,0,0]=4 5000 B11R1.16 CCNC(C)c1ccccn1 1349d82fdb3aca31d54d33a892f4429f [1,1,0,0,0,0|1,0,0]=3 5001 B11R1.16 CCNC(C)c1cccnn1 efc02f97da2becc35b8d266864811e35 [1,1,0,0,0,0|2,0,0]=4 5002 B11R1.16 CCNC(C)c1ccncn1 22930201dd5caefefa3309491753d9e9 [1,1,0,0,0,0|2,0,0]=4 5003 B11R1.16 CCNC(C)c1cnccn1 3027041055109ccfc9487eb2dd1789f2 [1,1,0,0,0,0|2,0,0]=4 5004 B11R1.16 CCNC(C)c1ncccn1 112a21bda09e683bb3edc0c3fc56d505 [1,1,0,0,0,0|2,0,0]=4 5005 B11R1.16 CCN[C@@H](C)c1ccccc1 994b5b0b50363ecab1efd5b7f9e6d7cd [1,1,0,0,0,0|2,0,0]=4 5006 B11R1.16 CCN[C@@H](C)c1ccccn1 6becaa5dd299afbde8d9e40b8df2b64b [1,1,0,0,0,0|1,0,0]=3 5007 B11R1.16 CCN[C@H](C)c1ccccc1 af432512ad94856da6ef9d44592c3502 [1,1,0,0,0,0|2,0,0]=4 5008 B11R1.16 CCN[C@H](C)c1ccccn1 de5b9d337b6c15bb985fd6d76426b016 [1,1,0,0,0,0|1,0,0]=3 5009 B11R1.16 CCOC(C)c1ccccc1 37108e833ff536d25c550cb5b37c873d [1,1,0,0,0,0|2,0,0]=4 5010 B11R1.16 CCOC(C)c1ccccn1 2349fef21e807c42cd2b612eadfb89fd [1,1,0,0,0,0|1,0,0]=3 5011 B11R1.16 CCOC(C)c1cccnn1 b45ba464b06ee6bdc1c736a50ffd8553 [1,1,0,0,0,0|2,0,0]=4 5012 B11R1.16 CCOC(C)c1cnccn1 c43729a6fd74b4ab221ba3a8754f47ca [1,1,0,0,0,0|2,0,0]=4 5013 B11R1.16 CCOC(C)c1ncccn1 1fedda22cfecf8948662f3eef3f690f9 [1,1,0,0,0,0|2,0,0]=4 5014 B11R1.16 CCO[C@@H](C)c1ccccc1 e4f11a13dd3f609e6f25ac3a3b969fe2 [1,1,0,0,0,0|2,0,0]=4 5015 B11R1.16 CCO[C@@H](C)c1ccccn1 d31d85c16530817c2b81fb1a03fe7e57 [1,1,0,0,0,0|1,0,0]=3 5016 B11R1.16 CCO[C@@H](C)c1ccncn1 ecda7948a20662ef60b97d1988299e8d [1,1,0,0,0,0|2,0,0]=4 5017 B11R1.16 CCO[C@@H](C)c1cnccn1 8a6e3a914bc27167363a585a0aa27251 [1,1,0,0,0,0|2,0,0]=4 5018 B11R1.16 CCO[C@@H](C)c1ncccn1 4240750fe2b64fee8772620e302ddfbe [1,1,0,0,0,0|2,0,0]=4 5019 B11R1.16 CCO[C@H](C)c1ccccc1 54694971b3853f962e687b61e7c698c1 [1,1,0,0,0,0|2,0,0]=4 5020 B11R1.16 CCO[C@H](C)c1ccccn1 c768b24f1cd72ff8137851b753ae2d04 [1,1,0,0,0,0|1,0,0]=3 5021 B11R1.16 CCO[C@H](C)c1cccnn1 5e113335bfa1da5c764374cee09167f3 [1,1,0,0,0,0|2,0,0]=4 5022 B11R1.16 CCO[C@H](C)c1cnccn1 5d3b5896b879729f1ffbe4449af13432 [1,1,0,0,0,0|2,0,0]=4 5023 B11R1.16 CCO[C@H](C)c1ncccn1 f16129f9fc3238ad0c96779a2995a1df [1,1,0,0,0,0|2,0,0]=4 5024 B11R1.16 CN(CCO)c1ccccn1 e37523a54a1bd0bac80e99fe2cbc8f05 [1,1,0,0,0,0|2,0,0]=4 5025 B11R1.16 CN(CCS)c1ccccn1 de84abbd40dd1eead0c63b1f2ba48791 [1,1,0,0,0,0|2,0,0]=4 5026 B11R1.16 COCN(C)c1ccccn1 66cbdeedae67899dab62ab4e4b9abfe2 [1,1,0,0,0,0|2,0,0]=4 5027 B11R1.16 CSCN(C)c1ccccn1 b50faf9300869282fdd09bc9d262195a [1,1,0,0,0,0|2,0,0]=4 5028 B11R1.16 C[C@@H](NCF)c1ccccn1 99b97b5aa9cfaef5c750c0b6f424a155 [1,1,0,0,0,0|2,0,0]=4 5029 B11R1.16 C[C@@H](NCO)c1ccccn1 06a1df171fb3e867c231d94d30fe4c59 [1,1,0,0,0,0|2,0,0]=4 5030 B11R1.16 C[C@@H](OCF)c1ccccn1 452563b793d445f90c7b5445d0861252 [1,1,0,0,0,0|2,0,0]=4 5031 B11R1.16 C[C@H](NCF)c1ccccn1 3f81f6af69df7aaa916f5a60f5ffdf6c [1,1,0,0,0,0|2,0,0]=4 5032 B11R1.16 C[C@H](NCO)c1ccccn1 d98746896574333cf45787ddae8ffaa8 [1,1,0,0,0,0|2,0,0]=4 5033 B11R1.16 C[C@H](OCF)c1ccccn1 6ecec266ea2cccd56a91b2c7f7312784 [1,1,0,0,0,0|2,0,0]=4 5034 B11R1.17 CCCNc1cccc[n+]1[O-] 9aa6a23beaed595bd0e08509502f2e88 [1,1,0,0,0,0|1,0,1]=4 5035 B11R1.17 CCCNc1ccccc1Cl f06644db92e5a5e5c88ba3d72e76b09c [1,1,0,0,0,0|2,0,0]=4 5036 B11R1.17 CCCNc1ccccc1F b26d422a9020f42016e9a773ea4da59b [1,1,0,0,0,0|2,0,0]=4 5037 B11R1.17 CCCNc1ccccc1I 9667c1f0fcc826e8e0c3d31e03051206 [1,1,0,0,0,0|2,0,0]=4 5038 B11R1.17 CCCNc1ncccc1Br afdad602cc18eba6538110beb8225730 [1,1,0,0,0,0|1,0,0]=3 5039 B11R1.17 CCCNc1ncccc1C abec0375ee082a7d48f7cf43776cf112 [1,1,0,0,0,0|1,0,0]=3 5040 B11R1.17 CCCNc1ncccc1Cl b509a2ca435f1e67a922e5764a1cf9c5 [1,1,0,0,0,0|1,0,0]=3 5041 B11R1.17 CCCNc1ncccc1F af3a157f218544df912ffebf16be14cb [1,1,0,0,0,0|1,0,0]=3 5042 B11R1.17 CCCNc1ncccc1I c4c7e827ce85817f94824160ced25561 [1,1,0,0,0,0|1,0,0]=3 5043 B11R1.17 CCCNc1nccnc1Br b2deb868e93ad8bfdc3d31ff074e6394 [1,1,0,0,0,0|2,0,0]=4 5044 B11R1.17 CCCNc1nccnc1C 7959f3a041ff51b3c70e5e598f2f50d9 [1,1,0,0,0,0|2,0,0]=4 5045 B11R1.17 CCCNc1nccnc1Cl 1504070ee0177f27ed1d51a2c4390e7f [1,1,0,0,0,0|2,0,0]=4 5046 B11R1.17 CCCNc1nccnc1I 25f1a795720059dbef86476449229e6c [1,1,0,0,0,0|2,0,0]=4 5047 B11R1.17 CCCNc1ncncc1Br c1cb470d790bd89ee1d9f26a559d99e1 [1,1,0,0,0,0|2,0,0]=4 5048 B11R1.17 CCCNc1ncncc1C c39d1566d97133b153fe318962c5d196 [1,1,0,0,0,0|2,0,0]=4 5049 B11R1.17 CCCNc1ncncc1Cl a660b7cdac31a5f51f32c735791cf876 [1,1,0,0,0,0|2,0,0]=4 5050 B11R1.17 CCCNc1ncncc1F c3fd79eb12dde9d67a8ca84d3375337c [1,1,0,0,0,0|2,0,0]=4 5051 B11R1.17 CCCNc1ncncc1I 333eb570aa92227842a3ad0b0b0f2691 [1,1,0,0,0,0|2,0,0]=4 5052 B11R1.17 CCCNc1nnccc1C f9a9e1159ef661d8498bd53c7641961c [1,1,0,0,0,0|2,0,0]=4 5053 B11R1.17 CCCOc1cccc[n+]1[O-] 82deb6f6c59813d3c334fbb145a1cf35 [1,1,0,0,0,0|1,0,1]=4 5054 B11R1.17 CCCOc1ccccc1C 6c1a4dc1e6028f3da6f849553f219900 [1,1,0,0,0,0|2,0,0]=4 5055 B11R1.17 CCCOc1ccccc1Cl 4721246108b2629d9b8b29c6ad627685 [1,1,0,0,0,0|2,0,0]=4 5056 B11R1.17 CCCOc1ccccc1F e002653ab86def653a9f4f2e92420612 [1,1,0,0,0,0|2,0,0]=4 5057 B11R1.17 CCCOc1ccccc1I 2ec532f87a4a1971649b297302a06402 [1,1,0,0,0,0|2,0,0]=4 5058 B11R1.17 CCCOc1ccccc1S a0d26031bd542d5d05da52b2adf5a399 [1,1,0,0,0,0|2,0,0]=4 5059 B11R1.17 CCCOc1ncccc1Br 591cb4e29b3d78165b95627fad6003be [1,1,0,0,0,0|1,0,0]=3 5060 B11R1.17 CCCOc1ncccc1C 75d7921d560a6b2f851a2acab9f2614a [1,1,0,0,0,0|1,0,0]=3 5061 B11R1.17 CCCOc1ncccc1Cl 0a16720fcbf52b5cf544018f35b8eeec [1,1,0,0,0,0|1,0,0]=3 5062 B11R1.17 CCCOc1ncccc1F ee3952c45bf36a13ea36600dcc4a174a [1,1,0,0,0,0|1,0,0]=3 5063 B11R1.17 CCCOc1nccnc1Br c34189a6173cc4621130f2580d00b8c6 [1,1,0,0,0,0|2,0,0]=4 5064 B11R1.17 CCCOc1nccnc1C 0b16d5dccf3e1318f521652f165dafab [1,1,0,0,0,0|2,0,0]=4 5065 B11R1.17 CCCOc1ncncc1C d6c9a597c3b3261675984146b270ba14 [1,1,0,0,0,0|2,0,0]=4 5066 B11R1.17 CCCOc1ncncc1Cl 08b3bd19bfa8649c30f7d34a2a94ab39 [1,1,0,0,0,0|2,0,0]=4 5067 B11R1.17 CCCOc1ncncc1F 5bfa2db7b857ef57fd46b6f19b7477c2 [1,1,0,0,0,0|2,0,0]=4 5068 B11R1.17 CCCOc1ncncc1I 3700eb036f64e40a2adc2800af53d26b [1,1,0,0,0,0|2,0,0]=4 5069 B11R1.17 CCCOc1nnccc1C 52fb11dc6f50f6e097f1bf89726dbdc3 [1,1,0,0,0,0|2,0,0]=4 5070 B11R1.17 CCCOc1nnccc1Cl 6c504f8b4b65c7486e619e0bf1581d75 [1,1,0,0,0,0|2,0,0]=4 5071 B11R1.17 CCCOc1nnccc1I 6d108d53c566b6893d5da19c58eb3be8 [1,1,0,0,0,0|2,0,0]=4 5072 B11R1.17 CCNCc1cccc[n+]1[O-] 4482be04b13bf2a14654c2b7dc44e9ba [1,1,0,0,0,0|1,0,1]=4 5073 B11R1.17 CCNCc1ccccc1Br 8f6bd2781373b66afc29396cae666f02 [1,1,0,0,0,0|2,0,0]=4 5074 B11R1.17 CCNCc1ccccc1C 284345fa1eb882542c433fcb95919ca4 [1,1,0,0,0,0|2,0,0]=4 5075 B11R1.17 CCNCc1ccccc1Cl db65b4e8d8ccf115e617990e552ab4c8 [1,1,0,0,0,0|2,0,0]=4 5076 B11R1.17 CCNCc1ccccc1F 9048c9b0864184d75154ea96f3fe50b8 [1,1,0,0,0,0|2,0,0]=4 5077 B11R1.17 CCNCc1ccccc1I d0f5abf080424e879ba8e6dfea920ca7 [1,1,0,0,0,0|2,0,0]=4 5078 B11R1.17 CCNCc1ncccc1Br 09995fa96814a8c54c9bca09512a1c87 [1,1,0,0,0,0|1,0,0]=3 5079 B11R1.17 CCNCc1ncccc1C 87bcb20686c74c1349ceb9aba049bbf8 [1,1,0,0,0,0|1,0,0]=3 5080 B11R1.17 CCNCc1ncccc1Cl 3fcb8c6a497a9d9b3a48e230bfe378a1 [1,1,0,0,0,0|1,0,0]=3 5081 B11R1.17 CCNCc1ncccc1F dda2cc3453d8ca1ee059e44555253881 [1,1,0,0,0,0|1,0,0]=3 5082 B11R1.17 CCNCc1nccnc1Cl 312702593b26de5f36ebb20f79575628 [1,1,0,0,0,0|2,0,0]=4 5083 B11R1.17 CCNCc1nnccc1C 3402d9f4b0a320cfb3142aef76047e33 [1,1,0,0,0,0|2,0,0]=4 5084 B11R1.17 CCOCc1ccccc1C 939ca93b69bfa487d1d8ecb62c2d84e3 [1,1,0,0,0,0|2,0,0]=4 5085 B11R1.17 CCOCc1ccccc1Cl e7556758f6c778f3c386ca652094b5cc [1,1,0,0,0,0|2,0,0]=4 5086 B11R1.17 CCOCc1ccccc1F 5a297cb41f57dfedbabc975eceaf6126 [1,1,0,0,0,0|2,0,0]=4 5087 B11R1.17 CCOCc1ccccc1I 7a255f979ee626f845777c39e07b9738 [1,1,0,0,0,0|2,0,0]=4 5088 B11R1.17 CCOCc1ncccc1Br a900f8070f81c4dcfb6829872fbeb70d [1,1,0,0,0,0|1,0,0]=3 5089 B11R1.17 CCOCc1ncccc1C 22c6c25dddf153fd6e4a707af4b8068f [1,1,0,0,0,0|1,0,0]=3 5090 B11R1.17 CCOCc1ncccc1Cl 3c0fdcad26845cb45b2978d3ea158930 [1,1,0,0,0,0|1,0,0]=3 5091 B11R1.17 CCOCc1ncccc1F 27994f3f8111644da417064253c7144c [1,1,0,0,0,0|1,0,0]=3 5092 B11R1.17 CCOCc1nccnc1C 47c62f7c04b33077f76d36a56e394ddf [1,1,0,0,0,0|2,0,0]=4 5093 B11R1.17 CCOCc1nccnc1Cl 35bc32266fe34371783b3188fae8c7a3 [1,1,0,0,0,0|2,0,0]=4 5094 B11R1.17 CCOCc1ncncc1Br d4328d14087b66e9dc89897ecf53bbcc [1,1,0,0,0,0|2,0,0]=4 5095 B11R1.17 CCOCc1nnccc1C bf9a30aaff0ebba1fed9aa3ecbd67793 [1,1,0,0,0,0|2,0,0]=4 5096 B11R1.17 COCNc1ncccc1Br c77a620fbf2cdac3f0f62475c9ecc7a2 [1,1,0,0,0,0|2,0,0]=4 5097 B11R1.17 COCNc1ncccc1C 1b0f64ed15da388d9aa93d7b67326b3e [1,1,0,0,0,0|2,0,0]=4 5098 B11R1.17 COCNc1ncccc1Cl ca63b8cc36b4035832431c47e5163efd [1,1,0,0,0,0|2,0,0]=4 5099 B11R1.17 COCNc1ncccc1F 915a644ab62f3ba464f87c0a95220680 [1,1,0,0,0,0|2,0,0]=4 5100 B11R1.17 COCNc1ncccc1I b4a9dc07751ead9c70b17558e3b66036 [1,1,0,0,0,0|2,0,0]=4 5101 B11R1.17 COCOc1ncccc1Br cb0e062478894323a2bf72bd99943205 [1,1,0,0,0,0|2,0,0]=4 5102 B11R1.17 COCOc1ncccc1C 8adf3b28b23a153b7bc424eae3dd8908 [1,1,0,0,0,0|2,0,0]=4 5103 B11R1.17 COCOc1ncccc1Cl d19708d7cfcc2a228078cd9342fea1f5 [1,1,0,0,0,0|2,0,0]=4 5104 B11R1.17 COCOc1ncccc1F cae1fa733309d8632bcbd4de00bcaf3d [1,1,0,0,0,0|2,0,0]=4 5105 B11R1.17 CSCNc1ncccc1Br 1862e461f2f1c7f043d226598ff4d3c8 [1,1,0,0,0,0|2,0,0]=4 5106 B11R1.17 CSCNc1ncccc1C b72b60896e65164c61988cde1d337896 [1,1,0,0,0,0|2,0,0]=4 5107 B11R1.17 CSCNc1ncccc1Cl 57e6a7edcf17c53b44383748f9a30c34 [1,1,0,0,0,0|2,0,0]=4 5108 B11R1.17 CSCNc1ncccc1F 86e934783769b9abb439eea8f6534bf7 [1,1,0,0,0,0|2,0,0]=4 5109 B11R1.17 CSCNc1ncccc1I d97b70a581f4cd1b22aaca5147670749 [1,1,0,0,0,0|2,0,0]=4 5110 B11R1.17 CSCOc1ncccc1Br 6e080946e25fd51558294e406949104d [1,1,0,0,0,0|2,0,0]=4 5111 B11R1.17 CSCOc1ncccc1C 865f2360dda339fdcf06b9b04930b805 [1,1,0,0,0,0|2,0,0]=4 5112 B11R1.17 CSCOc1ncccc1Cl 2ea519f27eb8d8468c81a1b05ef6f35a [1,1,0,0,0,0|2,0,0]=4 5113 B11R1.17 CSCOc1ncccc1F 40793fdcf7e70c51c7dd0f6c028803ea [1,1,0,0,0,0|2,0,0]=4 5114 B11R1.17 Cc1cccnc1CNCF 2c26c481bd112f7c3bb7a25857042abb [1,1,0,0,0,0|2,0,0]=4 5115 B11R1.17 Cc1cccnc1CNCO 30441c00bc8726da80cd698c0c87c74c [1,1,0,0,0,0|2,0,0]=4 5116 B11R1.17 Cc1cccnc1COCF f9daa7504b746dc27a9e9ed20f0e1520 [1,1,0,0,0,0|2,0,0]=4 5117 B11R1.17 Cc1cccnc1NCCF c6a56b86cfcc66034f29d7ba2dfdfbec [1,1,0,0,0,0|2,0,0]=4 5118 B11R1.17 Cc1cccnc1NCCO 478e63720a6f78f7fa3d3c8fa6de1dc4 [1,1,0,0,0,0|2,0,0]=4 5119 B11R1.17 Cc1cccnc1NCCS b23ea2db8bf1ef5c05a6fe50d695e40b [1,1,0,0,0,0|2,0,0]=4 5120 B11R1.17 Cc1cccnc1OCCF faf3152ba6945693ae32a3e095a2b826 [1,1,0,0,0,0|2,0,0]=4 5121 B11R1.17 Cc1cccnc1OCCS ebc37bd504865bb3bd37cc174cef578b [1,1,0,0,0,0|2,0,0]=4 5122 B11R1.17 FCCNc1ncccc1Br e6f854786d4173f29b78bacd07ccab9c [1,1,0,0,0,0|2,0,0]=4 5123 B11R1.17 FCCNc1ncccc1Cl 54ec6525c21e81548ff61bcd7ae7d624 [1,1,0,0,0,0|2,0,0]=4 5124 B11R1.17 FCCNc1ncccc1F 358cffd023b274f732cda0b5c2190c27 [1,1,0,0,0,0|2,0,0]=4 5125 B11R1.17 FCCNc1ncccc1I bc5009ad55d84156cf420a73fc3fc6d5 [1,1,0,0,0,0|2,0,0]=4 5126 B11R1.17 FCCOc1ncccc1Cl b73f55a16bf1f494913a7a4f0b401a23 [1,1,0,0,0,0|2,0,0]=4 5127 B11R1.17 FCCOc1ncccc1F 7d56fdd6c51a834d78263d8c857209fd [1,1,0,0,0,0|2,0,0]=4 5128 B11R1.17 FCNCc1ncccc1Br b5197451dd0022115174347e58eef85d [1,1,0,0,0,0|2,0,0]=4 5129 B11R1.17 FCNCc1ncccc1Cl 86f2dce8009a3b1781f46ed662622927 [1,1,0,0,0,0|2,0,0]=4 5130 B11R1.17 FCNCc1ncccc1F 8200c19207bf0e71e6f6aec74ff2ecb8 [1,1,0,0,0,0|2,0,0]=4 5131 B11R1.17 FCOCc1ncccc1Br e22bdeecaef240afd0cfb86078074969 [1,1,0,0,0,0|2,0,0]=4 5132 B11R1.17 FCOCc1ncccc1Cl 0ebe83d88be391885ad0c4cb20c30593 [1,1,0,0,0,0|2,0,0]=4 5133 B11R1.17 FCOCc1ncccc1F d288823ff13e57b70fbec0cae23ca618 [1,1,0,0,0,0|2,0,0]=4 5134 B11R1.17 Fc1cccnc1NCCS eab3d3f37904d3363394eaae4c337f38 [1,1,0,0,0,0|2,0,0]=4 5135 B11R1.17 Fc1cccnc1OCCS 6af9dcb9d943c2f57e65086f2e95b3d6 [1,1,0,0,0,0|2,0,0]=4 5136 B11R1.17 OCCNc1ncccc1Br 0548355e3244a92d79969bfcd2d73738 [1,1,0,0,0,0|2,0,0]=4 5137 B11R1.17 OCCNc1ncccc1Cl fb24191d2ae955de5523cbc99ed0e194 [1,1,0,0,0,0|2,0,0]=4 5138 B11R1.17 OCCNc1ncccc1F d121ec624e5ab5f9b9966d8d8f14f0d4 [1,1,0,0,0,0|2,0,0]=4 5139 B11R1.17 OCCNc1ncccc1I 572fad78fee75cd5b25db51cecd6f336 [1,1,0,0,0,0|2,0,0]=4 5140 B11R1.17 OCNCc1ncccc1Br b3063f47e1ec26ad2317599d840e6a3f [1,1,0,0,0,0|2,0,0]=4 5141 B11R1.17 OCNCc1ncccc1Cl 00c0e4e1c0f5be5f03ce1610dfdfc900 [1,1,0,0,0,0|2,0,0]=4 5142 B11R1.17 OCNCc1ncccc1F 3eb4781c927959737348d1749c1cc471 [1,1,0,0,0,0|2,0,0]=4 5143 B11R1.17 SCCNc1ncccc1Br 135bf1d3e459f6f3c2569b05a8344c15 [1,1,0,0,0,0|2,0,0]=4 5144 B11R1.17 SCCNc1ncccc1Cl aa9b8d08c723bb582a74b13ea2051472 [1,1,0,0,0,0|2,0,0]=4 5145 B11R1.17 SCCNc1ncccc1I 4b44737c1e22ea84172cdb9e911d1121 [1,1,0,0,0,0|2,0,0]=4 5146 B11R1.17 SCCOc1ncccc1Br 8ab4de38b0b67f701e532bd12c42d047 [1,1,0,0,0,0|2,0,0]=4 5147 B11R1.17 SCCOc1ncccc1Cl 7d9745e73c486bc18a5304973ca312b5 [1,1,0,0,0,0|2,0,0]=4 5148 B11R1.24 CCCNc1cc(ccn1)Br f1c13a780ea072a97f4918a3ae5fe793 [1,1,0,0,0,0|1,0,0]=3 5149 B11R1.24 CCCNc1cc(ccn1)C 9dd4b3ccbbc29296234e9ff62794f94d [1,1,0,0,0,0|1,0,0]=3 5150 B11R1.24 CCCNc1cc(ccn1)Cl e2748ea47500b5c43ad80436ec365351 [1,1,0,0,0,0|1,0,0]=3 5151 B11R1.24 CCCNc1cc(ccn1)F 19627d65edc699fb72ffad9630193c09 [1,1,0,0,0,0|1,0,0]=3 5152 B11R1.24 CCCNc1cc(ccn1)I 84f5d93869eede5ea29829b3c07bd844 [1,1,0,0,0,0|1,0,0]=3 5153 B11R1.24 CCCNc1cc(cnn1)Br 42aec590a5126706d3d8cb2beed0328e [1,1,0,0,0,0|2,0,0]=4 5154 B11R1.24 CCCNc1cc(cnn1)C 5c62222ae5ea8ecaecb63882a2edac4f [1,1,0,0,0,0|2,0,0]=4 5155 B11R1.24 CCCNc1cc(cnn1)Cl 3d453950b6aefff2f4ff234467d9a7af [1,1,0,0,0,0|2,0,0]=4 5156 B11R1.24 CCCNc1cc(ncn1)Br 5c2fe09aac1ddf093e6d92a2a19246ce [1,1,0,0,0,0|2,0,0]=4 5157 B11R1.24 CCCNc1cc(ncn1)C 87347225ae278d70f2d6167b359700d6 [1,1,0,0,0,0|2,0,0]=4 5158 B11R1.24 CCCNc1cc(ncn1)Cl d85554165421c7b95c069b77e8c19e7b [1,1,0,0,0,0|2,0,0]=4 5159 B11R1.24 CCCNc1cc(ncn1)F 95b1e365f12dd8f10978cf17d40ebe02 [1,1,0,0,0,0|2,0,0]=4 5160 B11R1.24 CCCNc1cc(ncn1)I aa3094a0a0ff2b9269d211469780a1ff [1,1,0,0,0,0|2,0,0]=4 5161 B11R1.24 CCCNc1cc[nH]c(=O)n1 f6ccb3123e8f25a61ffc90959ae3a039 [1,1,0,0,0,0|2,0,0]=4 5162 B11R1.24 CCCNc1cccc(c1)Br acb1f2bb5e7b1b5520f3f6cb5aa22aaf [1,1,0,0,0,0|2,0,0]=4 5163 B11R1.24 CCCNc1cccc(c1)C e421761759f1c746a8f404b8a3a2f9e1 [1,1,0,0,0,0|2,0,0]=4 5164 B11R1.24 CCCNc1cccc(c1)Cl 5f3ddf9c366c2329c81257ae31beedbd [1,1,0,0,0,0|2,0,0]=4 5165 B11R1.24 CCCNc1cccc(c1)F ea1b244e71e5a96c27eaf1a47c4045c2 [1,1,0,0,0,0|2,0,0]=4 5166 B11R1.24 CCCNc1cccc(c1)I 25b73dbb892b7f389897d5a43a220453 [1,1,0,0,0,0|2,0,0]=4 5167 B11R1.24 CCCNc1cccc(c1)S 225c14a2af7bde79a1ce2cf37e4d273b [1,1,0,0,0,0|2,0,0]=4 5168 B11R1.24 CCCNc1cccc(n1)Br 922806381eb036239ce652ef71179a3c [1,1,0,0,0,0|1,0,0]=3 5169 B11R1.24 CCCNc1cccc(n1)C ac360e9e258569f548399e28fa3180d8 [1,1,0,0,0,0|1,0,0]=3 5170 B11R1.24 CCCNc1cccc(n1)Cl dce45d6f17ac605453290d833800c971 [1,1,0,0,0,0|1,0,0]=3 5171 B11R1.24 CCCNc1cccc(n1)F 6c39e109efcbcaf4d3a5d07f4418f5de [1,1,0,0,0,0|1,0,0]=3 5172 B11R1.24 CCCNc1cccc(n1)I 257cf609e45e5409e5f7885d77dcd130 [1,1,0,0,0,0|1,0,0]=3 5173 B11R1.24 CCCNc1ccnc(n1)Br fa977abbc6d9cff2c3ae03758bad3270 [1,1,0,0,0,0|2,0,0]=4 5174 B11R1.24 CCCNc1ccnc(n1)C 3aba40c76e38d5e5b178926b1611aad5 [1,1,0,0,0,0|2,0,0]=4 5175 B11R1.24 CCCNc1ccnc(n1)Cl c96f4af2b89fd7e023f65403b41e6c3e [1,1,0,0,0,0|2,0,0]=4 5176 B11R1.24 CCCNc1ccnc(n1)F 6488712c4a4fa17bbe8c2dcf794ea8ed [1,1,0,0,0,0|2,0,0]=4 5177 B11R1.24 CCCNc1ccnc(n1)S ae0314785915cd696e265596a76d89ff [1,1,0,0,0,0|2,0,0]=4 5178 B11R1.24 CCCNc1cncc(n1)Br 14e256debc40100632b783ca9e3f0377 [1,1,0,0,0,0|2,0,0]=4 5179 B11R1.24 CCCNc1cncc(n1)C 7d065fb5278b04e394be53839a4f4b26 [1,1,0,0,0,0|2,0,0]=4 5180 B11R1.24 CCCNc1cncc(n1)Cl ed5d58055eb33af3f370507db3afd9aa [1,1,0,0,0,0|2,0,0]=4 5181 B11R1.24 CCCNc1cncc(n1)F 565d2a2cd861b4f047e60b3fa461c56a [1,1,0,0,0,0|2,0,0]=4 5182 B11R1.24 CCCNc1nccc(=O)[nH]1 e977dbc11cd3921ba984db4b12d64b3a [1,1,0,0,0,0|2,0,0]=4 5183 B11R1.24 CCCNc1nccc(n1)Br 732370b6f620bcc58cc793c364edf7f2 [1,1,0,0,0,0|2,0,0]=4 5184 B11R1.24 CCCNc1nccc(n1)C cbeaff3c30dc661ba1c0bed3864766cb [1,1,0,0,0,0|2,0,0]=4 5185 B11R1.24 CCCNc1nccc(n1)Cl 7d5d751c3de5e018d585db1d3048baef [1,1,0,0,0,0|2,0,0]=4 5186 B11R1.24 CCCNc1nccc(n1)F 16e54dcb98229bf40c8329f6a12ca0bf [1,1,0,0,0,0|2,0,0]=4 5187 B11R1.24 CCCNc1nccc(n1)I e3f0ab4572e2cb2e54b7e676898bf5e6 [1,1,0,0,0,0|2,0,0]=4 5188 B11R1.24 CCCNc1nccc(n1)S 6291a731cd2d693f36039136e5a8e8cc [1,1,0,0,0,0|2,0,0]=4 5189 B11R1.24 CCCOc1cc(ccn1)Br 733fbc0062452a6d408b5de5a71ee204 [1,1,0,0,0,0|1,0,0]=3 5190 B11R1.24 CCCOc1cc(ccn1)C e0a5b7a4ceaf137253b09aaa74d8a523 [1,1,0,0,0,0|1,0,0]=3 5191 B11R1.24 CCCOc1cc(ccn1)Cl 9bec7845ed0cc2ec4528299e79a75327 [1,1,0,0,0,0|1,0,0]=3 5192 B11R1.24 CCCOc1cc(ccn1)F 0dc309ef3e091b80292d2495314d3e88 [1,1,0,0,0,0|1,0,0]=3 5193 B11R1.24 CCCOc1cc(ncn1)Br 49edf0ad18c06927e67630cbac2b35fd [1,1,0,0,0,0|2,0,0]=4 5194 B11R1.24 CCCOc1cc(ncn1)C 600e497facc27cc106f73273f78d6b5d [1,1,0,0,0,0|2,0,0]=4 5195 B11R1.24 CCCOc1cc(ncn1)Cl dce17002a55f3dd5efa4b0b6593a7636 [1,1,0,0,0,0|2,0,0]=4 5196 B11R1.24 CCCOc1cccc(=O)[nH]1 5737faf370dd02b121376f36c61aae8a [1,1,0,0,0,0|1,0,1]=4 5197 B11R1.24 CCCOc1cccc(c1)Br a13e2d3b97569660f2094ead5808f8a1 [1,1,0,0,0,0|2,0,0]=4 5198 B11R1.24 CCCOc1cccc(c1)C d7061e70aaece534ca2df7008d458f1f [1,1,0,0,0,0|2,0,0]=4 5199 B11R1.24 CCCOc1cccc(c1)Cl dd576836e51eec77f1708e34dc442061 [1,1,0,0,0,0|2,0,0]=4 5200 B11R1.24 CCCOc1cccc(c1)F cef2c69d3852855819ee350cb218d7bc [1,1,0,0,0,0|2,0,0]=4 5201 B11R1.24 CCCOc1cccc(c1)I 5e7b3431fe9595b36463e1f6c0c6091a [1,1,0,0,0,0|2,0,0]=4 5202 B11R1.24 CCCOc1cccc(c1)S 9cc4d5ce9f1a372f0235b118438f64df [1,1,0,0,0,0|2,0,0]=4 5203 B11R1.24 CCCOc1cccc(n1)Br a9055c800f7a8bea8f5823944b85de73 [1,1,0,0,0,0|1,0,0]=3 5204 B11R1.24 CCCOc1cccc(n1)C 39c146d9d455282915fb415280d9321f [1,1,0,0,0,0|1,0,0]=3 5205 B11R1.24 CCCOc1cccc(n1)F 64f38a887ca7a2ad9537d774a3104a70 [1,1,0,0,0,0|1,0,0]=3 5206 B11R1.24 CCCOc1ccnc(n1)C 2daef3bcca61affddd659cb8093de78c [1,1,0,0,0,0|2,0,0]=4 5207 B11R1.24 CCCOc1ccnc(n1)Cl 4013358112d99c5824b106c92e0dc790 [1,1,0,0,0,0|2,0,0]=4 5208 B11R1.24 CCCOc1cncc(n1)Br 8acbc2197880f863ff3c8b69c5a65d3b [1,1,0,0,0,0|2,0,0]=4 5209 B11R1.24 CCCOc1cncc(n1)C c2772f2207ed04c57882d6d72486141e [1,1,0,0,0,0|2,0,0]=4 5210 B11R1.24 CCCOc1cncc(n1)Cl ba3c70e8a93a324604ef8bfd0449bb0d [1,1,0,0,0,0|2,0,0]=4 5211 B11R1.24 CCCOc1nccc(n1)Cl d79661ecec27a5144eff1ac3e85982c8 [1,1,0,0,0,0|2,0,0]=4 5212 B11R1.24 CCCOc1nccc(n1)S b98deea636cb41a263d9928c0badecbe [1,1,0,0,0,0|2,0,0]=4 5213 B11R1.24 CCNCc1cc(ccn1)Br e896276c8fa14cddbcb38ebcdac27e5d [1,1,0,0,0,0|1,0,0]=3 5214 B11R1.24 CCNCc1cc(ccn1)C 774f66d8e453a57270dc32842d55134b [1,1,0,0,0,0|1,0,0]=3 5215 B11R1.24 CCNCc1cc(ccn1)Cl 5028728b9ac7ebc1c9518284f0807fbd [1,1,0,0,0,0|1,0,0]=3 5216 B11R1.24 CCNCc1cc[nH]c(=O)n1 b6cdb31d7faf2e9d989c4a3eb66282b9 [1,1,0,0,0,0|2,0,0]=4 5217 B11R1.24 CCNCc1cccc(c1)Br 7cc097aea1efe8376684166a5d7a74a3 [1,1,0,0,0,0|2,0,0]=4 5218 B11R1.24 CCNCc1cccc(c1)C 8711965bd65b9b9cae0b5574aaf9df19 [1,1,0,0,0,0|2,0,0]=4 5219 B11R1.24 CCNCc1cccc(c1)Cl 35f4a4fcd3415e84e248be1142a75e6e [1,1,0,0,0,0|2,0,0]=4 5220 B11R1.24 CCNCc1cccc(c1)F a045945dd7664750cd4517426a30ddec [1,1,0,0,0,0|2,0,0]=4 5221 B11R1.24 CCNCc1cccc(c1)I a0250fe998532bc25a8c10c3d959951b [1,1,0,0,0,0|2,0,0]=4 5222 B11R1.24 CCNCc1cccc(n1)Br c978bb899b1e5a401c33708277506b25 [1,1,0,0,0,0|1,0,0]=3 5223 B11R1.24 CCNCc1cccc(n1)C 152e97bb6eb9a6a331f50dff3115da53 [1,1,0,0,0,0|1,0,0]=3 5224 B11R1.24 CCNCc1cccc(n1)Cl 1bd8ce8886953bed1784a34d49705dec [1,1,0,0,0,0|1,0,0]=3 5225 B11R1.24 CCNCc1cccc(n1)F 6624bbae6e7a27ced67aeeba1b15f696 [1,1,0,0,0,0|1,0,0]=3 5226 B11R1.24 CCNCc1ccnc(n1)C 0f8f456432ce41f11e5f9f5897bc38f3 [1,1,0,0,0,0|2,0,0]=4 5227 B11R1.24 CCNCc1cncc(n1)Cl ed106e7f77edef20e981894c6b487949 [1,1,0,0,0,0|2,0,0]=4 5228 B11R1.24 CCNCc1nccc(n1)C 56bd6712941404d4e99e45aa44148aa6 [1,1,0,0,0,0|2,0,0]=4 5229 B11R1.24 CCNCc1nccc(n1)Cl 07062ee5f9ee16b801a4b10e9f11a502 [1,1,0,0,0,0|2,0,0]=4 5230 B11R1.24 CCOCc1cc(ccn1)Br 0726b8a141caded4ec904623fca2ab22 [1,1,0,0,0,0|1,0,0]=3 5231 B11R1.24 CCOCc1cc(ccn1)C 2d5b6d2e2d714975e85774b9da739956 [1,1,0,0,0,0|1,0,0]=3 5232 B11R1.24 CCOCc1cc(ccn1)Cl 158638af681bb2c0924168dfb0c4809a [1,1,0,0,0,0|1,0,0]=3 5233 B11R1.24 CCOCc1cc(ccn1)F a0a517bf4ebe3f482da9efb1f014fd4e [1,1,0,0,0,0|1,0,0]=3 5234 B11R1.24 CCOCc1cc(ccn1)I 52a26a3ba97e706ba155b551bf3cce2f [1,1,0,0,0,0|1,0,0]=3 5235 B11R1.24 CCOCc1cc(cnn1)C 1666bfdb580ffa9b164a53cf82d16080 [1,1,0,0,0,0|2,0,0]=4 5236 B11R1.24 CCOCc1cc(ncn1)C 75d27a4d886a004f6162bae5e71bd31f [1,1,0,0,0,0|2,0,0]=4 5237 B11R1.24 CCOCc1cc(ncn1)Cl 7457ad973702347f2408d2bbb9f0e9b4 [1,1,0,0,0,0|2,0,0]=4 5238 B11R1.24 CCOCc1cccc(c1)Br 68ab38873ddd37fd78370dbba526e703 [1,1,0,0,0,0|2,0,0]=4 5239 B11R1.24 CCOCc1cccc(c1)C a074366dc5260a76a26e1b3a17ce68f7 [1,1,0,0,0,0|2,0,0]=4 5240 B11R1.24 CCOCc1cccc(c1)Cl 8933445146c771b808a03b867c201e1e [1,1,0,0,0,0|2,0,0]=4 5241 B11R1.24 CCOCc1cccc(c1)F 01b8eda252200f38637020bb494cc211 [1,1,0,0,0,0|2,0,0]=4 5242 B11R1.24 CCOCc1cccc(c1)I ee21a715b45c835bc7170e7ff62f202c [1,1,0,0,0,0|2,0,0]=4 5243 B11R1.24 CCOCc1cccc(n1)Br 90a68360acfece20f90108990bcd1149 [1,1,0,0,0,0|1,0,0]=3 5244 B11R1.24 CCOCc1cccc(n1)C 28a36ef1d20cbd44690d599ab87bdc5f [1,1,0,0,0,0|1,0,0]=3 5245 B11R1.24 CCOCc1cccc(n1)Cl 82ebf630bd981fc4893dc75cb0bef897 [1,1,0,0,0,0|1,0,0]=3 5246 B11R1.24 CCOCc1cccc(n1)F 2089888f25135651426c37a52be6c99b [1,1,0,0,0,0|1,0,0]=3 5247 B11R1.24 CCOCc1cccc(n1)I fe037eb715fee04a280f82d502bd179d [1,1,0,0,0,0|1,0,0]=3 5248 B11R1.24 CCOCc1ccnc(n1)C 677d8c08e328514263ff0ac51349ebac [1,1,0,0,0,0|2,0,0]=4 5249 B11R1.24 CCOCc1ccnc(n1)Cl 51dee434d948e123cd309c5f43d1d44c [1,1,0,0,0,0|2,0,0]=4 5250 B11R1.24 CCOCc1cncc(n1)Br 93b3c48b0f46fe40293e5c4d06ff7add [1,1,0,0,0,0|2,0,0]=4 5251 B11R1.24 CCOCc1cncc(n1)Cl 4fc9209a0abdc2127432660e0653cfeb [1,1,0,0,0,0|2,0,0]=4 5252 B11R1.24 CCOCc1nccc(n1)C 93bb1f47b07455e46d382ea8b4bc923f [1,1,0,0,0,0|2,0,0]=4 5253 B11R1.24 COCNc1cc(ccn1)Br 98124c9b7bff257ad47a46b3246dfe42 [1,1,0,0,0,0|2,0,0]=4 5254 B11R1.24 COCNc1cc(ccn1)C adae85d67d0345e0f68e69a369f5bba4 [1,1,0,0,0,0|2,0,0]=4 5255 B11R1.24 COCNc1cc(ccn1)Cl 82fa414f6c17c6b5480baeedfa72f146 [1,1,0,0,0,0|2,0,0]=4 5256 B11R1.24 COCNc1cc(ccn1)F 256b1379eda8d20685ae9c276ff903a0 [1,1,0,0,0,0|2,0,0]=4 5257 B11R1.24 COCNc1cc(ccn1)I 2f12763df2ecd64e0527c361f56684ff [1,1,0,0,0,0|2,0,0]=4 5258 B11R1.24 COCNc1cccc(n1)Br 52ad474fe6f88660af61388b9000376a [1,1,0,0,0,0|2,0,0]=4 5259 B11R1.24 COCNc1cccc(n1)C be3044ceb0ac6b2a92548da526a4558a [1,1,0,0,0,0|2,0,0]=4 5260 B11R1.24 COCNc1cccc(n1)Cl 2edcbb65f7f23111b499cf9e20f392c8 [1,1,0,0,0,0|2,0,0]=4 5261 B11R1.24 COCNc1cccc(n1)F 807cd93285de966b23daa3eb4fcf3128 [1,1,0,0,0,0|2,0,0]=4 5262 B11R1.24 COCNc1cccc(n1)I 1f3d9167c3012aa39de560063ed29a2f [1,1,0,0,0,0|2,0,0]=4 5263 B11R1.24 COCOc1cc(ccn1)Br 65aed7a96671b122067c519313de7f92 [1,1,0,0,0,0|2,0,0]=4 5264 B11R1.24 COCOc1cc(ccn1)C 4e8a06007f28535df1d88671528d0566 [1,1,0,0,0,0|2,0,0]=4 5265 B11R1.24 COCOc1cc(ccn1)Cl dccc69d15f2c2d7e9438856402bd9972 [1,1,0,0,0,0|2,0,0]=4 5266 B11R1.24 COCOc1cc(ccn1)F 7b986b3d89c50d5fb9d05859547f4d63 [1,1,0,0,0,0|2,0,0]=4 5267 B11R1.24 COCOc1cccc(n1)Br cfccfad20d5c8551624ee27c2bf8d66b [1,1,0,0,0,0|2,0,0]=4 5268 B11R1.24 COCOc1cccc(n1)C fdff37993ec0f9f87123e33942d46a32 [1,1,0,0,0,0|2,0,0]=4 5269 B11R1.24 COCOc1cccc(n1)F 7295bdfeb7d8f2b4178f51c12a1cade1 [1,1,0,0,0,0|2,0,0]=4 5270 B11R1.24 CSCNc1cc(ccn1)Br 821e028b972ec93033f2f36cb1d10b53 [1,1,0,0,0,0|2,0,0]=4 5271 B11R1.24 CSCNc1cc(ccn1)C f59f3b34a1d6d5b58a9c3715147bb192 [1,1,0,0,0,0|2,0,0]=4 5272 B11R1.24 CSCNc1cc(ccn1)F b8725dd6b56860d09663dcb16ae3d185 [1,1,0,0,0,0|2,0,0]=4 5273 B11R1.24 CSCNc1cc(ccn1)I 8326232776928c130715f4052f8244a6 [1,1,0,0,0,0|2,0,0]=4 5274 B11R1.24 CSCNc1cccc(n1)Br 2c83887440e46bac8434e5134018863d [1,1,0,0,0,0|2,0,0]=4 5275 B11R1.24 CSCNc1cccc(n1)C 75461631c24f8880a127b1a36251a2bb [1,1,0,0,0,0|2,0,0]=4 5276 B11R1.24 CSCNc1cccc(n1)F 843bd2ecc7e55bd6274d61364e4e1e97 [1,1,0,0,0,0|2,0,0]=4 5277 B11R1.24 CSCNc1cccc(n1)I fa81b640f7e964620d7adf874a9ca42c [1,1,0,0,0,0|2,0,0]=4 5278 B11R1.24 CSCOc1cc(ccn1)Br 76e65c49389513f6fda25e13117f39a6 [1,1,0,0,0,0|2,0,0]=4 5279 B11R1.24 CSCOc1cc(ccn1)C 2faa44f135e08f68fd43d0cae3d26b0f [1,1,0,0,0,0|2,0,0]=4 5280 B11R1.24 CSCOc1cc(ccn1)Cl 9b042639528d2292c33f123ecf5f0ebb [1,1,0,0,0,0|2,0,0]=4 5281 B11R1.24 CSCOc1cc(ccn1)F bbc7633afade6181454c5eb55d8f15ef [1,1,0,0,0,0|2,0,0]=4 5282 B11R1.24 CSCOc1cccc(n1)Br adf643fe9b877dfeed3d0b1ba4335256 [1,1,0,0,0,0|2,0,0]=4 5283 B11R1.24 CSCOc1cccc(n1)C 0e5e219e6e56059f9820074336b83010 [1,1,0,0,0,0|2,0,0]=4 5284 B11R1.24 CSCOc1cccc(n1)F 42143d365a182477003511c6587dfea5 [1,1,0,0,0,0|2,0,0]=4 5285 B11R1.24 Cc1cccc(n1)CNCF 05a62d73686ee79fd8505033ca49baa7 [1,1,0,0,0,0|2,0,0]=4 5286 B11R1.24 Cc1cccc(n1)CNCO fe42a0006039c5b282c8b0832528d029 [1,1,0,0,0,0|2,0,0]=4 5287 B11R1.24 Cc1cccc(n1)COCF df2174f806dfe5ac9f4371901df5434b [1,1,0,0,0,0|2,0,0]=4 5288 B11R1.24 Cc1cccc(n1)NCCBr 64c88367448c4cdec21276d0c72daabb [1,1,0,0,0,0|2,0,0]=4 5289 B11R1.24 Cc1cccc(n1)NCCF 057f27df2885f14417b191b992ef5401 [1,1,0,0,0,0|2,0,0]=4 5290 B11R1.24 Cc1cccc(n1)NCCO 2f6549d226cf28bd97ca9c8eed2ac2de [1,1,0,0,0,0|2,0,0]=4 5291 B11R1.24 Cc1cccc(n1)NCCS 36bd046d2ddd5baddbc13ebc7f5b847d [1,1,0,0,0,0|2,0,0]=4 5292 B11R1.24 Cc1cccc(n1)OCCF 6ff7ad5de4e9691ad3a4728e4cae7eca [1,1,0,0,0,0|2,0,0]=4 5293 B11R1.24 Cc1cccc(n1)OCCS ed4e7e8c02da60cfbe11eb44fa79978d [1,1,0,0,0,0|2,0,0]=4 5294 B11R1.24 Cc1ccnc(c1)CNCF 99674922aee475568b4d41956b2b0398 [1,1,0,0,0,0|2,0,0]=4 5295 B11R1.24 Cc1ccnc(c1)CNCO 5f13cb4049c3b8923e25988be44c27eb [1,1,0,0,0,0|2,0,0]=4 5296 B11R1.24 Cc1ccnc(c1)COCF fb814cb9dbe25ac108086a6d9f09ab81 [1,1,0,0,0,0|2,0,0]=4 5297 B11R1.24 Cc1ccnc(c1)NCCF 93b1b7389c5f8edd4e3c8efc6039ebca [1,1,0,0,0,0|2,0,0]=4 5298 B11R1.24 Cc1ccnc(c1)NCCO 19d12f5117ef4128697081bba6fe0041 [1,1,0,0,0,0|2,0,0]=4 5299 B11R1.24 Cc1ccnc(c1)NCCS 31c9c0f7334f5c40ed6511187a82a336 [1,1,0,0,0,0|2,0,0]=4 5300 B11R1.24 Cc1ccnc(c1)OCCF a906c88e330094544711df3aa01bfa21 [1,1,0,0,0,0|2,0,0]=4 5301 B11R1.24 Cc1ccnc(c1)OCCS de4cc6ebba4c499e1a74b822748698ad [1,1,0,0,0,0|2,0,0]=4 5302 B11R1.24 FCCNc1cc(ccn1)Br 4a6b5e8f600aee059826f8f3f9ed428d [1,1,0,0,0,0|2,0,0]=4 5303 B11R1.24 FCCNc1cc(ccn1)Cl 1a96f3295cd74650d91ed41cfc6f5913 [1,1,0,0,0,0|2,0,0]=4 5304 B11R1.24 FCCNc1cc(ccn1)F a0dcfe0b9aad35cf8b290896d64fad58 [1,1,0,0,0,0|2,0,0]=4 5305 B11R1.24 FCCNc1cc(ccn1)I 61fec0d09cf481eeb2f81c0600a9438b [1,1,0,0,0,0|2,0,0]=4 5306 B11R1.24 FCCNc1cccc(n1)Br 4652555585ee3059cabbb95384b822bb [1,1,0,0,0,0|2,0,0]=4 5307 B11R1.24 FCCNc1cccc(n1)Cl d5ce1ccee9a860b61123b8467e52bb73 [1,1,0,0,0,0|2,0,0]=4 5308 B11R1.24 FCCNc1cccc(n1)F 584113863bceda79cd2c0a8005d9da06 [1,1,0,0,0,0|2,0,0]=4 5309 B11R1.24 FCCNc1cccc(n1)I c9fb46fba75fc33312e28dae03af6125 [1,1,0,0,0,0|2,0,0]=4 5310 B11R1.24 FCCOc1cc(ccn1)Br f0388fd8ccd4e51ab996757e84efca53 [1,1,0,0,0,0|2,0,0]=4 5311 B11R1.24 FCCOc1cc(ccn1)Cl a4e5aa2a406d2d6aca52aff75a588e2b [1,1,0,0,0,0|2,0,0]=4 5312 B11R1.24 FCCOc1cc(ccn1)F 8e60cd5b586a4a756a2b0e46d46e6ed5 [1,1,0,0,0,0|2,0,0]=4 5313 B11R1.24 FCCOc1cccc(n1)Br b17f0282e465f2a8b28fcbcc97898d3b [1,1,0,0,0,0|2,0,0]=4 5314 B11R1.24 FCCOc1cccc(n1)F ab36983c6faf1f9ba8588408e34e9670 [1,1,0,0,0,0|2,0,0]=4 5315 B11R1.24 FCNCc1cc(ccn1)Br be066e882bf44938d20a7f2de2adf4b1 [1,1,0,0,0,0|2,0,0]=4 5316 B11R1.24 FCNCc1cc(ccn1)Cl 23b52ced6e809b15a9df543546ea37f9 [1,1,0,0,0,0|2,0,0]=4 5317 B11R1.24 FCNCc1cccc(n1)Br 3724f51ba6ff3c96ec420cf7c80df3b2 [1,1,0,0,0,0|2,0,0]=4 5318 B11R1.24 FCNCc1cccc(n1)Cl 2cc2737f4751cf74de00fe93caa32bbe [1,1,0,0,0,0|2,0,0]=4 5319 B11R1.24 FCNCc1cccc(n1)F cbf62c887ad6c7d7b51542c2baa1df38 [1,1,0,0,0,0|2,0,0]=4 5320 B11R1.24 FCOCc1cc(ccn1)Br d8c50c7aa4e189977d6212e67cad14b5 [1,1,0,0,0,0|2,0,0]=4 5321 B11R1.24 FCOCc1cc(ccn1)Cl ebb5b2b45560791e51ff88c3be572ec9 [1,1,0,0,0,0|2,0,0]=4 5322 B11R1.24 FCOCc1cc(ccn1)F e837cdce786c885abf554cadca310231 [1,1,0,0,0,0|2,0,0]=4 5323 B11R1.24 FCOCc1cc(ccn1)I ba73c671e175eb64519d21c541d97cb5 [1,1,0,0,0,0|2,0,0]=4 5324 B11R1.24 FCOCc1cccc(n1)Br f17737ac643dcad7b00e8ca05281c65d [1,1,0,0,0,0|2,0,0]=4 5325 B11R1.24 FCOCc1cccc(n1)Cl 4f842acec6ada03117ebc1f002b9b6b6 [1,1,0,0,0,0|2,0,0]=4 5326 B11R1.24 FCOCc1cccc(n1)F 3429b62a2bf417f0315da409f5a6eddf [1,1,0,0,0,0|2,0,0]=4 5327 B11R1.24 FCOCc1cccc(n1)I d9488d4c3679b01456f34c8598cb4c1c [1,1,0,0,0,0|2,0,0]=4 5328 B11R1.24 Fc1cccc(n1)NCCS 7c09e052be8afc12a20dc4be58121665 [1,1,0,0,0,0|2,0,0]=4 5329 B11R1.24 Fc1cccc(n1)OCCS 6ba663c61de122c18358a1ab6e5f63d1 [1,1,0,0,0,0|2,0,0]=4 5330 B11R1.24 Fc1ccnc(c1)NCCS d602db65a060fb806f1f95ad69d10ab0 [1,1,0,0,0,0|2,0,0]=4 5331 B11R1.24 Fc1ccnc(c1)OCCS 8e1ae93291a291f9a78575650a068667 [1,1,0,0,0,0|2,0,0]=4 5332 B11R1.24 OCCNc1cc(ccn1)Br 0e5845a9d75897934a7ce851325e636b [1,1,0,0,0,0|2,0,0]=4 5333 B11R1.24 OCCNc1cc(ccn1)Cl 7c04defb8496760f37c26173d358f1c7 [1,1,0,0,0,0|2,0,0]=4 5334 B11R1.24 OCCNc1cc(ccn1)F 394032aa62c6106ac2a0a110fc66bc09 [1,1,0,0,0,0|2,0,0]=4 5335 B11R1.24 OCCNc1cc(ccn1)I c9c07f7ea916c489386a21b821d3dbff [1,1,0,0,0,0|2,0,0]=4 5336 B11R1.24 OCCNc1cccc(n1)Br 16afda6c91c8eb0785eae3aaeedeb0ff [1,1,0,0,0,0|2,0,0]=4 5337 B11R1.24 OCCNc1cccc(n1)Cl 0dd354cac868e8a2f5e6b90d2720b521 [1,1,0,0,0,0|2,0,0]=4 5338 B11R1.24 OCCNc1cccc(n1)F 5cca75db912fddd5272d0cd29841e998 [1,1,0,0,0,0|2,0,0]=4 5339 B11R1.24 OCCNc1cccc(n1)I c4affa9525427bd84927869b068208bf [1,1,0,0,0,0|2,0,0]=4 5340 B11R1.24 OCNCc1cc(ccn1)Br 06cb0b6f11d2df317f076a34cca73254 [1,1,0,0,0,0|2,0,0]=4 5341 B11R1.24 OCNCc1cc(ccn1)Cl 5646effac8639f8535d15a6b99ad056c [1,1,0,0,0,0|2,0,0]=4 5342 B11R1.24 OCNCc1cccc(n1)Br 23296dee875c9669a422613f06aeef06 [1,1,0,0,0,0|2,0,0]=4 5343 B11R1.24 OCNCc1cccc(n1)Cl faf46ab43f1e9a23a22115d506a7017c [1,1,0,0,0,0|2,0,0]=4 5344 B11R1.24 OCNCc1cccc(n1)F c5b650412f060761f1cc75a8aca4b5dd [1,1,0,0,0,0|2,0,0]=4 5345 B11R1.24 Oc1ccnc(c1)NCCS a3cd4fe526a7b40663b993ecde214579 [1,1,0,0,0,0|2,0,0]=4 5346 B11R1.24 SCCNc1cc(ccn1)Br 66f725b76f6a8000dfa8c77cdcb5587c [1,1,0,0,0,0|2,0,0]=4 5347 B11R1.24 SCCNc1cc(ccn1)Cl eb6af22889c51cbb9a9c3f56d9bce7a8 [1,1,0,0,0,0|2,0,0]=4 5348 B11R1.24 SCCNc1cc(ccn1)I c48f0d18a1cca196ede3a4f0b740dad1 [1,1,0,0,0,0|2,0,0]=4 5349 B11R1.24 SCCNc1cccc(n1)Br c9243d9c4d4684d6bbba9b4f9d614ebb [1,1,0,0,0,0|2,0,0]=4 5350 B11R1.24 SCCNc1cccc(n1)Cl 5dcef3b84c5751e952348165a25b6b2e [1,1,0,0,0,0|2,0,0]=4 5351 B11R1.24 SCCNc1cccc(n1)I aeceafdcd8b797a3755c8a5a1347e555 [1,1,0,0,0,0|2,0,0]=4 5352 B11R1.24 SCCOc1cc(ccn1)Br a2a0d4bd58875edc3f3faeab79307a1a [1,1,0,0,0,0|2,0,0]=4 5353 B11R1.24 SCCOc1cc(ccn1)Cl 6dd0e062116bfd0012e13413e203674a [1,1,0,0,0,0|2,0,0]=4 5354 B11R1.24 SCCOc1cccc(n1)Br 495fe021cb0786af87a96a7f4508b68a [1,1,0,0,0,0|2,0,0]=4 5355 B11R1.40 CC(CO)Nc1ccccn1 2e21620844440b7bb083395c24fa5d12 [1,1,0,0,0,0|2,0,0]=4 5356 B11R1.40 CCC(=O)Nc1ccccn1 5f642c62afae0a49ab875733e55fde1b [1,1,0,0,0,0|1,0,1]=4 5357 B11R1.40 CCC(C)Nc1ccccc1 0d73dedeab1dd8f5149c3124f0b802dc [1,1,0,0,0,0|2,0,0]=4 5358 B11R1.40 CCC(C)Nc1ccccn1 bb895d27f1d9ed94ab4cd5f93b01f0bd [1,1,0,0,0,0|1,0,0]=3 5359 B11R1.40 CCC(C)Nc1cccnn1 ff06696cf74f270fdba143978c62ac27 [1,1,0,0,0,0|2,0,0]=4 5360 B11R1.40 CCC(C)Nc1ccncn1 cdc50b843b9c714cbb9488ee87e2e9f4 [1,1,0,0,0,0|2,0,0]=4 5361 B11R1.40 CCC(C)Nc1cnccn1 218f39b97d2fc8b56d7c106256492dff [1,1,0,0,0,0|2,0,0]=4 5362 B11R1.40 CCC(C)Nc1ncccn1 11b2ce1094fd36a470194aa0ea19a19c [1,1,0,0,0,0|2,0,0]=4 5363 B11R1.40 CCC(C)Oc1ccccn1 b8b4a806c6af90298cf0d1454fda0647 [1,1,0,0,0,0|1,0,0]=3 5364 B11R1.40 CCC(C)Oc1cnccn1 259d43a94fcc1396cf4ed5279619bad5 [1,1,0,0,0,0|2,0,0]=4 5365 B11R1.40 CCC(C)Oc1ncccn1 2c3f480730b3d8e77d38029021131efd [1,1,0,0,0,0|2,0,0]=4 5366 B11R1.40 CCN(C)Cc1ccccc1 c214a7b7c23665abe56278baaf98348b [1,1,0,0,0,0|2,0,0]=4 5367 B11R1.40 CCN(C)Cc1ccccn1 e347cf6623c9ce49a1c94570b5d3844c [1,1,0,0,0,0|1,0,0]=3 5368 B11R1.40 CCN(C)Cc1cccnn1 ba8363aad2effd2a40895558d9f7d2cc [1,1,0,0,0,0|2,0,0]=4 5369 B11R1.40 CCN(C)Cc1ccncn1 83309bdc7d5b3f4e0468e934ea7be25a [1,1,0,0,0,0|2,0,0]=4 5370 B11R1.40 CCN(C)Cc1cnccn1 13139f85f2c80541c7a741660f0206e2 [1,1,0,0,0,0|2,0,0]=4 5371 B11R1.40 CCN(C)Cc1ncccn1 ebe3e637f0b1e6381a1d390f9229f3e9 [1,1,0,0,0,0|2,0,0]=4 5372 B11R1.40 CC[C@@H](C)Nc1ccccc1 405a065880ecff40d5c3aba49f23a60f [1,1,0,0,0,0|2,0,0]=4 5373 B11R1.40 CC[C@H](C)Nc1ccccc1 bdf0fca4eb541010d4b75cf2b0618571 [1,1,0,0,0,0|2,0,0]=4 5374 B11R1.40 CN(CF)Cc1ccccn1 0fb6d4fca1ae3b36d4aab61bd5289947 [1,1,0,0,0,0|2,0,0]=4 5375 B11R1.40 CN(CO)Cc1ccccn1 a4ef6b4247ef0972f7871752389806bb [1,1,0,0,0,0|2,0,0]=4 5376 B11R1.40 C[C@@H](CO)Nc1ccccn1 9ac7427612f5553e5180ee81712e35fd [1,1,0,0,0,0|2,0,0]=4 5377 B11R1.40 C[C@H](CO)Nc1ccccn1 01d2d5e2403842048f8ac810f41680f1 [1,1,0,0,0,0|2,0,0]=4 5378 B11R1.91 C=C(C)CNc1ccccn1 296f6d3c9e71203263ef4c60889651d0 [1,1,0,0,0,0|1,0,1]=4 5379 B11R1.91 C=C(C)COc1ccccn1 53d55f6223fd317f454a145f4adf39b2 [1,1,0,0,0,0|1,0,1]=4 5380 B11R1.91 CC(=O)CNc1ccccn1 9ef5867d6e28a360f3e560522ae4c545 [1,1,0,0,0,0|1,0,1]=4 5381 B11R1.91 CC(=O)NCc1ccccn1 4a5e0ad0f6fb64ba7eb4726872bef1d0 [1,1,0,0,0,0|1,0,1]=4 5382 B11R1.91 CC(C)CNc1ccccc1 408d8a64ab70f9eca096d81d546b6049 [1,1,0,0,0,0|2,0,0]=4 5383 B11R1.91 CC(C)CNc1ccccn1 7b009ca04377ecc13f70ec3cf4ebfeda [1,1,0,0,0,0|1,0,0]=3 5384 B11R1.91 CC(C)CNc1cccnn1 6e0a186ee92f69845b1d1e2faa4b9d99 [1,1,0,0,0,0|2,0,0]=4 5385 B11R1.91 CC(C)CNc1ccncn1 f3aaf01b8fb4390cec4d8d0c307de117 [1,1,0,0,0,0|2,0,0]=4 5386 B11R1.91 CC(C)CNc1cnccn1 95ddfe6d68910c614f0cbdfaa85d0133 [1,1,0,0,0,0|2,0,0]=4 5387 B11R1.91 CC(C)CNc1ncccn1 fb6ae2e310931ddbda6cf67796620c38 [1,1,0,0,0,0|2,0,0]=4 5388 B11R1.91 CC(C)COc1ccccn1 7b0823f232ca75667ab72b773cf2055c [1,1,0,0,0,0|1,0,0]=3 5389 B11R1.91 CC(C)COc1cnccn1 fca5516fc8fc749e126db826ec1364f8 [1,1,0,0,0,0|2,0,0]=4 5390 B11R1.91 CC(C)COc1ncccn1 1f457fce7df81ae19e8aadca0db78537 [1,1,0,0,0,0|2,0,0]=4 5391 B11R1.91 CC(C)NCc1ccccc1 60272e3c9303882f29d21331dcab1491 [1,1,0,0,0,0|2,0,0]=4 5392 B11R1.91 CC(C)NCc1ccccn1 856545f5d02de0038284fed0716bf52b [1,1,0,0,0,0|1,0,0]=3 5393 B11R1.91 CC(C)NCc1cccnn1 cccaf60f16873524c6ada28e623ee50e [1,1,0,0,0,0|2,0,0]=4 5394 B11R1.91 CC(C)NCc1ccncn1 36ee71268b7fc037f6d2456244279a98 [1,1,0,0,0,0|2,0,0]=4 5395 B11R1.91 CC(C)NCc1cnccn1 320d7f2d7b3c9da90f951a37d43af864 [1,1,0,0,0,0|2,0,0]=4 5396 B11R1.91 CC(C)NCc1ncccn1 248c6dc0e3f7cb9e6cb68053e65f796a [1,1,0,0,0,0|2,0,0]=4 5397 B11R1.91 CC(C)OCc1ccccc1 7aa508df1117d05227b589ad5630d192 [1,1,0,0,0,0|2,0,0]=4 5398 B11R1.91 CC(C)OCc1ccccn1 0763eb944dcd10bf40a6049a3281f0fa [1,1,0,0,0,0|1,0,0]=3 5399 B11R1.91 CC(C)OCc1cccnn1 9e75df7bf42bec5daa46f121cb3b2fee [1,1,0,0,0,0|2,0,0]=4 5400 B11R1.91 CC(C)OCc1ccncn1 8ca6a7835eff3f310e3286485f2bc8a3 [1,1,0,0,0,0|2,0,0]=4 5401 B11R1.91 CC(C)OCc1cnccn1 e68303144f36400499d51e9b07ed6d5f [1,1,0,0,0,0|2,0,0]=4 5402 B11R1.91 CC(C)OCc1ncccn1 38d74e076887ffaed244a2918ea05836 [1,1,0,0,0,0|2,0,0]=4 5403 B11R1.91 CC(O)CNc1ccccc1 bad1b8ce4c3d0d43f36328d30e7f1e89 [1,1,0,0,0,0|2,0,0]=4 5404 B11R1.91 CC(O)CNc1ccccn1 0b02a9fc805d3fdc80aa58b252d76fac [1,1,0,0,0,0|1,0,0]=3 5405 B11R1.91 CC(O)CNc1cccnn1 e8550c43b60b9bd9029917d25ea6398c [1,1,0,0,0,0|2,0,0]=4 5406 B11R1.91 CC(O)CNc1ccncn1 87e78bbdc595709f51d9a8bdf7f2897c [1,1,0,0,0,0|2,0,0]=4 5407 B11R1.91 CC(O)CNc1cnccn1 f991222b12e39f41fc4f22d1360207a1 [1,1,0,0,0,0|2,0,0]=4 5408 B11R1.91 CC(O)CNc1ncccn1 b6f7059776643b68745371242f2eebca [1,1,0,0,0,0|2,0,0]=4 5409 B11R1.91 CN(C)CNc1ccccn1 7dd3487cd8d87b9dce82d3b1e66d4dfe [1,1,0,0,0,0|2,0,0]=4 5410 B11R1.91 CN(C)COc1ccccn1 0d00edbce2a52e0b3d43150d9124361f [1,1,0,0,0,0|2,0,0]=4 5411 B11R1.91 C[C@@H](O)CNc1ccccc1 3364bd989574177eabc4c47575206f02 [1,1,0,0,0,0|2,0,0]=4 5412 B11R1.91 C[C@@H](O)CNc1ccccn1 2f50c5c35f8b03d00f3a417683f2e1c8 [1,1,0,0,0,0|1,0,0]=3 5413 B11R1.91 C[C@@H](O)CNc1cccnn1 6d7b3599ec55158b05cb5aa4687b61f0 [1,1,0,0,0,0|2,0,0]=4 5414 B11R1.91 C[C@@H](O)CNc1ccncn1 b017b3dcb881e43eb2f919cb0bf0d312 [1,1,0,0,0,0|2,0,0]=4 5415 B11R1.91 C[C@@H](O)CNc1cnccn1 eefedac70fb9e61b84978ca5f31e1024 [1,1,0,0,0,0|2,0,0]=4 5416 B11R1.91 C[C@@H](O)CNc1ncccn1 ec34d1470851807c1662c266c1187822 [1,1,0,0,0,0|2,0,0]=4 5417 B11R1.91 C[C@H](O)CNc1ccccc1 72a253baaf381f6699a10e01b0f0ab34 [1,1,0,0,0,0|2,0,0]=4 5418 B11R1.91 C[C@H](O)CNc1ccccn1 b5e1e178b39afd2578578a870577034a [1,1,0,0,0,0|1,0,0]=3 5419 B11R1.91 C[C@H](O)CNc1cccnn1 d1cbd42116d6dcb71e4b9c0be7e6b4b4 [1,1,0,0,0,0|2,0,0]=4 5420 B11R1.91 C[C@H](O)CNc1ccncn1 d98c0c85670dd7a9571673306a8a7bbe [1,1,0,0,0,0|2,0,0]=4 5421 B11R1.91 C[C@H](O)CNc1cnccn1 8436b233d47376aa6994f036c7608979 [1,1,0,0,0,0|2,0,0]=4 5422 B11R1.91 C[C@H](O)CNc1ncccn1 b8c9593e9f50f526bf52c6b1059528a2 [1,1,0,0,0,0|2,0,0]=4 5423 B11R1.91 FC(F)CNc1ccccn1 3e6bbc18fb170dbd99c0771b3f20bde4 [1,1,0,0,0,0|2,0,0]=4 5424 B11R1.91 FC(F)COc1ccccn1 5e0a1a0fa35c804046b8ebf535a7456b [1,1,0,0,0,0|2,0,0]=4 5425 B11R1.4 BrCCNCCc1c[nH]cn1 214fe1312f093f04d187bab9d6270019 [0,1,0,0,1,0|2,0,0]=4 5426 B11R1.4 BrCCNCCc1cccs1 62ac0d237af288e485e8f88442fb8c44 [0,1,0,0,1,0|2,0,0]=4 5427 B11R1.4 BrCCNCCc1ccsc1 4a35244a235a700a7a92fb84da95642f [0,1,0,0,1,0|2,0,0]=4 5428 B11R1.4 BrCCNCCc1cscn1 14be45d109f8b1547bbc0b2e8617f7a9 [0,1,0,0,1,0|2,0,0]=4 5429 B11R1.4 BrCCNCCn1cccc1 712895b0558141df4e08ad72c76d8050 [0,1,0,0,1,0|2,0,0]=4 5430 B11R1.4 BrCCNCCn1cccn1 277ff66a85e871d675ac9c43cf3dd664 [0,1,0,0,1,0|2,0,0]=4 5431 B11R1.4 CCCCCNc1c[nH]cn1 b01a7065862deeeed0d6b4ab0d92cb4f [0,1,0,0,1,0|1,0,0]=3 5432 B11R1.4 CCCCCNc1cc[nH]n1 db376cb6d60ec1a9d60cefdaded419c8 [0,1,0,0,1,0|1,0,0]=3 5433 B11R1.4 CCCCCNc1ccco1 f970cd05169f1dc22a2fc0868aa59ecb [0,1,0,0,1,0|1,0,0]=3 5434 B11R1.4 CCCCCNc1cccs1 b90d3a17dbc283de48613a781580a30c [0,1,0,0,1,0|1,0,0]=3 5435 B11R1.4 CCCCCNc1ccno1 8f6afcdc2b9aaefcececa096a682bd40 [0,1,0,0,1,0|2,0,0]=4 5436 B11R1.4 CCCCCNc1ccns1 a1a013cb44b6ab72f2e54169dc0ac10d [0,1,0,0,1,0|2,0,0]=4 5437 B11R1.4 CCCCCNc1ccoc1 873754c10feb0cec44bbaccf311bec49 [0,1,0,0,1,0|1,0,0]=3 5438 B11R1.4 CCCCCNc1ccon1 d671983adccc0fc95a3d5df61f1f0ab1 [0,1,0,0,1,0|1,0,0]=3 5439 B11R1.4 CCCCCNc1ccsc1 de022f84aa76209e7bcaabaa38bac726 [0,1,0,0,1,0|1,0,0]=3 5440 B11R1.4 CCCCCNc1ccsn1 f37f1e8db459e0bbbde0e108bc00eb26 [0,1,0,0,1,0|1,0,0]=3 5441 B11R1.4 CCCCCNc1cn[nH]c1 22fbd0626b78d7d59976dbe1fdb17a56 [0,1,0,0,1,0|2,0,0]=4 5442 B11R1.4 CCCCCNc1cncs1 8076e9df536a7028573987ad784e25c4 [0,1,0,0,1,0|2,0,0]=4 5443 B11R1.4 CCCCCNc1cnoc1 f0b067564a6f5daca89ac9267afcb411 [0,1,0,0,1,0|2,0,0]=4 5444 B11R1.4 CCCCCNc1cnon1 cf195b76bc311d4bfb9661d938cb25a2 [0,1,0,0,1,0|2,0,0]=4 5445 B11R1.4 CCCCCNc1cnsc1 d94b6362bafa749cc568490788175a75 [0,1,0,0,1,0|2,0,0]=4 5446 B11R1.4 CCCCCNc1cnsn1 4820d9605b3b2a1ca0e9f0f5f32e8463 [0,1,0,0,1,0|2,0,0]=4 5447 B11R1.4 CCCCCNc1cocn1 f83370ad18c59e371e17d97749d5d0e7 [0,1,0,0,1,0|1,0,0]=3 5448 B11R1.4 CCCCCNc1cscn1 80903fdff89c18ed604bedfac42394f8 [0,1,0,0,1,0|1,0,0]=3 5449 B11R1.4 CCCCCNc1nc[nH]n1 5080056bf63f8b7bf07a3f7dd04430b5 [0,1,0,0,1,0|2,0,0]=4 5450 B11R1.4 CCCCCNc1ncc[nH]1 c5ac4c702c46c1498e6542c46bf35e36 [0,1,0,0,1,0|1,0,0]=3 5451 B11R1.4 CCCCCNc1ncco1 2d0badb0f958a9679e2da64f0b39a666 [0,1,0,0,1,0|1,0,0]=3 5452 B11R1.4 CCCCCNc1nccs1 b21f76bed6b0f4f128053177274679fa [0,1,0,0,1,0|1,0,0]=3 5453 B11R1.4 CCCCCNc1ncns1 cdedf6a0259f45067f6a3e4901cd3890 [0,1,0,0,1,0|2,0,0]=4 5454 B11R1.4 CCCCCNc1ncon1 4bd8205b72a6292e40e676bd755ad062 [0,1,0,0,1,0|2,0,0]=4 5455 B11R1.4 CCCCCNc1ncsn1 0fe285a514824f242219f5a8786e1c0d [0,1,0,0,1,0|2,0,0]=4 5456 B11R1.4 CCCCCNc1nnco1 287266e74b62d44da5da5a35fa4f8996 [0,1,0,0,1,0|2,0,0]=4 5457 B11R1.4 CCCCCNc1nncs1 cbf75a2ac6a845c7f577c57ac6afd8fe [0,1,0,0,1,0|2,0,0]=4 5458 B11R1.4 CCCCCOc1c[nH]cn1 04b204461b754698acf232511926a4fb [0,1,0,0,1,0|1,0,0]=3 5459 B11R1.4 CCCCCOc1ccco1 765a6b19c6da88e1e0ac7cbcc3169645 [0,1,0,0,1,0|1,0,0]=3 5460 B11R1.4 CCCCCOc1cccs1 7728517f8bb9acd624edad115aa58ef5 [0,1,0,0,1,0|1,0,0]=3 5461 B11R1.4 CCCCCOc1ccn[nH]1 b30f2458d669fa133512e1bb7bc88472 [0,1,0,0,1,0|1,0,1]=4 5462 B11R1.4 CCCCCOc1ccsc1 dd49135ea18d372e9a057cf4e9f47384 [0,1,0,0,1,0|1,0,0]=3 5463 B11R1.4 CCCCCOc1cn[nH]c1 3e01a2142aceb0bf9197eddfe305fc30 [0,1,0,0,1,0|2,0,0]=4 5464 B11R1.4 CCCCCOc1cnoc1 b4a80ae7ae57b07406dfb88982be1595 [0,1,0,0,1,0|2,0,0]=4 5465 B11R1.4 CCCCCOc1cnsn1 8b3896fb44555040a1c7e03744f7ab98 [0,1,0,0,1,0|2,0,0]=4 5466 B11R1.4 CCCCCOc1nccs1 c15d79dcebf468b9a7a6e18d4c47ac7e [0,1,0,0,1,0|1,0,0]=3 5467 B11R1.4 CCCCCOc1nncs1 c27048d8f94f91c5cc5e4e46dac455ec [0,1,0,0,1,0|2,0,0]=4 5468 B11R1.4 CCCCCOn1cccn1 d67f000620fe7ed8e10e7011e00974af [0,1,0,0,1,0|1,0,0]=3 5469 B11R1.4 CCCCCOn1ccnc1 6ec52e97e965d56ede0a0fe42b72904e [0,1,0,0,1,0|2,0,0]=4 5470 B11R1.4 CCCCNCc1c[nH]nn1 ab152af34c6a0df1eed11b9be0ecebea [0,1,0,0,1,0|2,0,0]=4 5471 B11R1.4 CCCCNCc1cc[nH]c1 051fa8aa73cb52f6bf59a0b60ece2323 [0,1,0,0,1,0|1,0,0]=3 5472 B11R1.4 CCCCNCc1ccc[nH]1 8f70a5f3b98455984453df40f90e0765 [0,1,0,0,1,0|0,0,1]=3 5473 B11R1.4 CCCCNCc1ccco1 c9dd13c1879595fe1a868b7933bb7fce [0,1,0,0,1,0|1,0,0]=3 5474 B11R1.4 CCCCNCc1cccs1 af82f42e07056437823a093033a20c93 [0,1,0,0,1,0|1,0,0]=3 5475 B11R1.4 CCCCNCc1ccn[nH]1 f721c13c7513fb77dd689132298167aa [0,1,0,0,1,0|1,0,1]=4 5476 B11R1.4 CCCCNCc1ccno1 262684878b2e753dee1f03fefbb0ca8d [0,1,0,0,1,0|2,0,0]=4 5477 B11R1.4 CCCCNCc1ccns1 eb21c86b5291083181d32557d804d94a [0,1,0,0,1,0|2,0,0]=4 5478 B11R1.4 CCCCNCc1ccoc1 ab8253f518ded2d472c649b3f9cb4c45 [0,1,0,0,1,0|1,0,0]=3 5479 B11R1.4 CCCCNCc1ccon1 b62c6732cea5c05c18494a7f8bbe2930 [0,1,0,0,1,0|1,0,0]=3 5480 B11R1.4 CCCCNCc1ccsc1 fad81054f84c8302ac588ac9e034d301 [0,1,0,0,1,0|1,0,0]=3 5481 B11R1.4 CCCCNCc1ccsn1 432d82af7f45bc0d7670be7b3a4953a1 [0,1,0,0,1,0|1,0,0]=3 5482 B11R1.4 CCCCNCc1cn[nH]c1 ce16f6d4651d2220309f17643b1608b5 [0,1,0,0,1,0|2,0,0]=4 5483 B11R1.4 CCCCNCc1cnc[nH]1 d0f77acc87d391b1bc87fb75abe46343 [0,1,0,0,1,0|1,0,1]=4 5484 B11R1.4 CCCCNCc1cnco1 2a4a1249531c1591596b3e4f73ee8bbf [0,1,0,0,1,0|2,0,0]=4 5485 B11R1.4 CCCCNCc1cncs1 6f9d0d80478848b4f8a585f6562426f6 [0,1,0,0,1,0|2,0,0]=4 5486 B11R1.4 CCCCNCc1cnoc1 6570fbd71330c5dc430490f8166ca531 [0,1,0,0,1,0|2,0,0]=4 5487 B11R1.4 CCCCNCc1cnsc1 46dd532a6557a1c00fe87594b8243048 [0,1,0,0,1,0|2,0,0]=4 5488 B11R1.4 CCCCNCc1cocn1 ddd04785c5ef0f72273a47918f936b76 [0,1,0,0,1,0|1,0,0]=3 5489 B11R1.4 CCCCNCc1cscn1 60fe4db25f0072d94d6435844ed1fa33 [0,1,0,0,1,0|1,0,0]=3 5490 B11R1.4 CCCCNCc1ncc[nH]1 6432e2374baf5ff8d096fd207eb26bb4 [0,1,0,0,1,0|1,0,0]=3 5491 B11R1.4 CCCCNCc1ncco1 ff6e7c3b8aecd5b953ff555e22db7e3a [0,1,0,0,1,0|1,0,0]=3 5492 B11R1.4 CCCCNCc1nccs1 12ba848c9f36919e0db36e7fd377b69d [0,1,0,0,1,0|1,0,0]=3 5493 B11R1.4 CCCCNCc1ncn[nH]1 7bea41fe593ae62084a7d7b6a6929d8a [0,1,0,0,1,0|2,0,0]=4 5494 B11R1.4 CCCCNCc1ncon1 6bd292ede5c74a6df6acf28462138390 [0,1,0,0,1,0|2,0,0]=4 5495 B11R1.4 CCCCNCc1nnco1 29d11ad2299ca461f2f7bd42e5416daf [0,1,0,0,1,0|2,0,0]=4 5496 B11R1.4 CCCCNCn1cncn1 ab33804f028fc5e36dc6a25573ea229e [0,1,0,0,1,0|2,0,0]=4 5497 B11R1.4 CCCCNCn1nccn1 4a4ef4a644cc2c5bf15c7e98d3e533e9 [0,1,0,0,1,0|2,0,0]=4 5498 B11R1.4 CCCCOCc1cc[nH]c1 581bc78654672672d8839f84f1994efa [0,1,0,0,1,0|1,0,0]=3 5499 B11R1.4 CCCCOCc1ccc[nH]1 f3fb6b951360ba51a09fd1477fb79c9e [0,1,0,0,1,0|0,0,1]=3 5500 B11R1.4 CCCCOCc1ccco1 b9903212f19458d57de7d6a4cad87304 [0,1,0,0,1,0|1,0,0]=3 5501 B11R1.4 CCCCOCc1cccs1 9a50b928bc33363387fdc671f0c971e0 [0,1,0,0,1,0|1,0,0]=3 5502 B11R1.4 CCCCOCc1ccn[nH]1 e3d925e64305b357c5a52621be3478be [0,1,0,0,1,0|1,0,1]=4 5503 B11R1.4 CCCCOCc1ccno1 7e24cacd8fbec4788dc07b97168b43c4 [0,1,0,0,1,0|2,0,0]=4 5504 B11R1.4 CCCCOCc1ccns1 8cf31193369ccb0d41278a49cf5f813d [0,1,0,0,1,0|2,0,0]=4 5505 B11R1.4 CCCCOCc1ccoc1 1cadfa682bb5a9af12fa0ba0bf74414e [0,1,0,0,1,0|1,0,0]=3 5506 B11R1.4 CCCCOCc1ccon1 f54ac0bd5644c2d9e71697f56ba64fb7 [0,1,0,0,1,0|1,0,0]=3 5507 B11R1.4 CCCCOCc1ccsc1 758768cfe76022235190e084f876000a [0,1,0,0,1,0|1,0,0]=3 5508 B11R1.4 CCCCOCc1ccsn1 fee5f2971e6cac7e22aaf3ff31f53bbd [0,1,0,0,1,0|1,0,0]=3 5509 B11R1.4 CCCCOCc1cn[nH]c1 e9995b9ad1ab1db6d671c3beba64fb9a [0,1,0,0,1,0|2,0,0]=4 5510 B11R1.4 CCCCOCc1cnc[nH]1 e355f8f4c2016bcd990276b8842582c4 [0,1,0,0,1,0|1,0,1]=4 5511 B11R1.4 CCCCOCc1cnco1 b6ad95bec1ea4c873a4f7e0cca9dab2b [0,1,0,0,1,0|2,0,0]=4 5512 B11R1.4 CCCCOCc1cnoc1 ee6508e38e8d10631b773262b199b21d [0,1,0,0,1,0|2,0,0]=4 5513 B11R1.4 CCCCOCc1cnsc1 d000b4e022676a505ae296dbd6346fd6 [0,1,0,0,1,0|2,0,0]=4 5514 B11R1.4 CCCCOCc1cnsn1 2e32da5a799517c328c8ae476a91b531 [0,1,0,0,1,0|2,0,0]=4 5515 B11R1.4 CCCCOCc1cocn1 f40cb4d1367fb78504c0364d81cda33a [0,1,0,0,1,0|1,0,0]=3 5516 B11R1.4 CCCCOCc1cscn1 68e4eeea8b2c221b9ea78b8387e66ca6 [0,1,0,0,1,0|1,0,0]=3 5517 B11R1.4 CCCCOCc1csnn1 8a3955dab7271e28689dea3f47d417ce [0,1,0,0,1,0|2,0,0]=4 5518 B11R1.4 CCCCOCc1nc[nH]n1 6fa208504b7edc3daaff304891f94c13 [0,1,0,0,1,0|2,0,0]=4 5519 B11R1.4 CCCCOCc1ncc[nH]1 d085b1248507f896dbbc5d5c036125ef [0,1,0,0,1,0|1,0,0]=3 5520 B11R1.4 CCCCOCc1ncco1 b2e4254a3f75d1046eb12f6b76cb00ad [0,1,0,0,1,0|1,0,0]=3 5521 B11R1.4 CCCCOCc1nccs1 91dc9611d28910e945f6e6e5282eb7b4 [0,1,0,0,1,0|1,0,0]=3 5522 B11R1.4 CCCCOCc1ncno1 47f731d3bc89946d7b78ff679eefbeeb [0,1,0,0,1,0|2,0,0]=4 5523 B11R1.4 CCCCOCc1ncns1 019b2e6dbe99088a3f2881f93f050797 [0,1,0,0,1,0|2,0,0]=4 5524 B11R1.4 CCCCOCc1ncon1 3254fdd82b690fa812d0dbb38643114c [0,1,0,0,1,0|2,0,0]=4 5525 B11R1.4 CCCCOCc1nnco1 bb1addb0ed09d3d6fd0c80b9abb5711d [0,1,0,0,1,0|2,0,0]=4 5526 B11R1.4 CCCCOCn1cccn1 fcdcb47fd172c4c538bc17f9bbf65917 [0,1,0,0,1,0|1,0,0]=3 5527 B11R1.4 CCCCOCn1ccnc1 d472087870e1773b349b9db8fedf94db [0,1,0,0,1,0|2,0,0]=4 5528 B11R1.4 CCCCOCn1cncn1 90cf6ca475d1fbbe0a101f4b8103734b [0,1,0,0,1,0|2,0,0]=4 5529 B11R1.4 CCCCOCn1nccn1 7c95941c06dfff317951ddb94d72eaaf [0,1,0,0,1,0|2,0,0]=4 5530 B11R1.4 CCCNCCc1c[nH]cn1 b7f00a6a1372a16ef0e024ef22595d63 [0,1,0,0,1,0|1,0,0]=3 5531 B11R1.4 CCCNCCc1cc[nH]n1 2cbf5eb2f2911974054fa30b12e3c5dc [0,1,0,0,1,0|1,0,0]=3 5532 B11R1.4 CCCNCCc1ccc[nH]1 8147e22ed6a84884178e68e4a2d743df [0,1,0,0,1,0|0,0,1]=3 5533 B11R1.4 CCCNCCc1ccco1 6b925e785b195733bc9096e5bb1e098f [0,1,0,0,1,0|1,0,0]=3 5534 B11R1.4 CCCNCCc1cccs1 b4154059d941d51114a95a825d16ee4d [0,1,0,0,1,0|1,0,0]=3 5535 B11R1.4 CCCNCCc1ccsc1 1536374e7579f3b5df16484c53bd352f [0,1,0,0,1,0|1,0,0]=3 5536 B11R1.4 CCCNCCc1cn[nH]c1 513c32c798b5bb31004b9c370fba006d [0,1,0,0,1,0|2,0,0]=4 5537 B11R1.4 CCCNCCc1cnoc1 3f039175430ef1bc11e84a1263fabb98 [0,1,0,0,1,0|2,0,0]=4 5538 B11R1.4 CCCNCCc1cscn1 29f669849f317b7ecbc34774cd24e763 [0,1,0,0,1,0|1,0,0]=3 5539 B11R1.4 CCCNCCc1ncc[nH]1 dce33185164c7b398c2bcd01316f58bb [0,1,0,0,1,0|1,0,0]=3 5540 B11R1.4 CCCNCCc1nccs1 4c246ca97e0a7b051f38fcdfcace1b9e [0,1,0,0,1,0|1,0,0]=3 5541 B11R1.4 CCCNCCc1ncon1 e4ba9fd98e3fe8b2f3ccb4321e643ae4 [0,1,0,0,1,0|2,0,0]=4 5542 B11R1.4 CCCNCCc1nncs1 118ed2f1b13a7c10050825c77faeb60c [0,1,0,0,1,0|2,0,0]=4 5543 B11R1.4 CCCNCCn1cccc1 2c5d0ecf4255a9ecb9679f6052dd7095 [0,1,0,0,1,0|1,0,0]=3 5544 B11R1.4 CCCNCCn1cccn1 d5ff05a8334d4e31344e943883aba9a9 [0,1,0,0,1,0|1,0,0]=3 5545 B11R1.4 CCCNCCn1ccnc1 e80717316fb4a596919e4aa992048555 [0,1,0,0,1,0|2,0,0]=4 5546 B11R1.4 CCCNCCn1ccnn1 5929539587567cab206861b6d4fe4720 [0,1,0,0,1,0|2,0,0]=4 5547 B11R1.4 CCCNCCn1cncn1 5a7ee9a4c17460c74cf5368623c9292a [0,1,0,0,1,0|2,0,0]=4 5548 B11R1.4 CCCNCCn1nccn1 a84664272c862120646dc4835c5ee375 [0,1,0,0,1,0|2,0,0]=4 5549 B11R1.4 CCCOCCc1c[nH]cn1 b153bf5049d0a5387dd8550da7bcdec7 [0,1,0,0,1,0|1,0,0]=3 5550 B11R1.4 CCCOCCc1cc[nH]n1 f066b154a85b290b852e9bfb94955164 [0,1,0,0,1,0|1,0,0]=3 5551 B11R1.4 CCCOCCc1ccc[nH]1 5fef4db54b1b5d041886351ac954673a [0,1,0,0,1,0|0,0,1]=3 5552 B11R1.4 CCCOCCc1ccco1 7e3a9046d4399a2533dc33c2e64d0238 [0,1,0,0,1,0|1,0,0]=3 5553 B11R1.4 CCCOCCc1cccs1 3efc7159f8ad1bcf58697e9254fd54d1 [0,1,0,0,1,0|1,0,0]=3 5554 B11R1.4 CCCOCCc1ccoc1 bc991c92cafa29c358102c9d241d422b [0,1,0,0,1,0|1,0,0]=3 5555 B11R1.4 CCCOCCc1ccon1 fb90bcf3e81f1f8e1cf2ba4638065286 [0,1,0,0,1,0|1,0,0]=3 5556 B11R1.4 CCCOCCc1ccsc1 93af440748e435ae9ef2283312b49f0a [0,1,0,0,1,0|1,0,0]=3 5557 B11R1.4 CCCOCCc1cn[nH]c1 22ac4d3a04c1009471741cf3384aa0a7 [0,1,0,0,1,0|2,0,0]=4 5558 B11R1.4 CCCOCCc1cnoc1 60467f6de168935cafd09eaf3314d840 [0,1,0,0,1,0|2,0,0]=4 5559 B11R1.4 CCCOCCc1cscn1 eb46aaf56455d56b0b27aa516512be07 [0,1,0,0,1,0|1,0,0]=3 5560 B11R1.4 CCCOCCc1ncc[nH]1 c68df73e84a615ea812f8d81e4245ce4 [0,1,0,0,1,0|1,0,0]=3 5561 B11R1.4 CCCOCCc1nccs1 3ce3e927115e4152d78cb4a928be15f5 [0,1,0,0,1,0|1,0,0]=3 5562 B11R1.4 CCCOCCc1ncon1 d72a3a7a5f2eeb01979d72876ba9967d [0,1,0,0,1,0|2,0,0]=4 5563 B11R1.4 CCCOCCn1cccc1 56ffc6bce88a3c31d83fbdbc55fd9a5b [0,1,0,0,1,0|1,0,0]=3 5564 B11R1.4 CCCOCCn1cccn1 7f86f7be2d3c5f24ad59f6ae0dafa690 [0,1,0,0,1,0|1,0,0]=3 5565 B11R1.4 CCCOCCn1ccnc1 e23cfd88768b3dcf8950aa1759914316 [0,1,0,0,1,0|2,0,0]=4 5566 B11R1.4 CCCOCCn1ccnn1 4cb0a22ee0e0ea280ad4e0cdda960652 [0,1,0,0,1,0|2,0,0]=4 5567 B11R1.4 CCCOCCn1cncn1 724005032c8aefe97a195086c1771926 [0,1,0,0,1,0|2,0,0]=4 5568 B11R1.4 CCCOCCn1nccn1 b4b0b487db0eb4f31e137f777fbff8dd [0,1,0,0,1,0|2,0,0]=4 5569 B11R1.4 CCNCCCc1c[nH]cn1 964cc9cc7a3784a0fd2b3bea5b2627fd [0,1,0,0,1,0|1,0,0]=3 5570 B11R1.4 CCNCCCc1ccco1 43406731f71a6d17b9e88a0e0d1fd4a9 [0,1,0,0,1,0|1,0,0]=3 5571 B11R1.4 CCNCCCc1cccs1 4f6ad20c34b73563b328c34ff6e893f6 [0,1,0,0,1,0|1,0,0]=3 5572 B11R1.4 CCNCCCc1ncc[nH]1 f39534a40fb1f8de7cff1f44e4061cd9 [0,1,0,0,1,0|1,0,0]=3 5573 B11R1.4 CCNCCCn1cccc1 bd430d07ea67406d15430a2a7b88d638 [0,1,0,0,1,0|1,0,0]=3 5574 B11R1.4 CCNCCCn1cccn1 782e4194c9aeaf49175fc5734207892e [0,1,0,0,1,0|1,0,0]=3 5575 B11R1.4 CCNCCCn1ccnc1 cd7b919a0a610fbbdcbdfe873a5e4f68 [0,1,0,0,1,0|2,0,0]=4 5576 B11R1.4 CCNCCCn1ccnn1 a6f96b0e527b3d0ba815e1f3eba265f2 [0,1,0,0,1,0|2,0,0]=4 5577 B11R1.4 CCNCCCn1cncn1 6eadb76be7ecbe040f414a2b070b2efe [0,1,0,0,1,0|2,0,0]=4 5578 B11R1.4 CCOCCCc1ccco1 ff0106fb5384705690339b058590e0ea [0,1,0,0,1,0|1,0,0]=3 5579 B11R1.4 CCOCCCc1cccs1 4cd565c71e10cfbbaae862aee5b0d4e4 [0,1,0,0,1,0|1,0,0]=3 5580 B11R1.4 CCOCCCc1ccsc1 c73cd67ea9cc8ae727db74d99d865074 [0,1,0,0,1,0|1,0,0]=3 5581 B11R1.4 CCOCCCc1cn[nH]c1 0d16d406c78372b3219c10e03c7f71b4 [0,1,0,0,1,0|2,0,0]=4 5582 B11R1.4 CCOCCCc1cnc[nH]1 a4651b0b0227b9076c6a5dd10563d8a1 [0,1,0,0,1,0|1,0,1]=4 5583 B11R1.4 CCOCCCc1cnoc1 aa4748e3be263f0fdac37ef1d63139f6 [0,1,0,0,1,0|2,0,0]=4 5584 B11R1.4 CCOCCCn1cccc1 4c480c0d94da65b00d4b5e45367bfb8d [0,1,0,0,1,0|1,0,0]=3 5585 B11R1.4 CCOCCCn1cccn1 1d552a28a1bb4d02a4057be99b8e9cd2 [0,1,0,0,1,0|1,0,0]=3 5586 B11R1.4 CCOCCCn1ccnc1 ecc00565f4e19bb687f88796f2b1cff8 [0,1,0,0,1,0|2,0,0]=4 5587 B11R1.4 CCOCCCn1cncn1 7e1f9bae37a86ed991e393efd37bffbf [0,1,0,0,1,0|2,0,0]=4 5588 B11R1.4 CCOCCCn1nccn1 5f6a2f0151906cfcffe8e416579253d5 [0,1,0,0,1,0|2,0,0]=4 5589 B11R1.4 CCOCCNc1c[nH]cn1 21a482199857c17b6c0442bc67dcbefd [0,1,0,0,1,0|2,0,0]=4 5590 B11R1.4 CCOCCNc1cc[nH]n1 e8a454a0d6939150c0ff7322a853f434 [0,1,0,0,1,0|2,0,0]=4 5591 B11R1.4 CCOCCNc1ccco1 edf6bc75ce1ecbe8b2d1371fa0a7c7f7 [0,1,0,0,1,0|2,0,0]=4 5592 B11R1.4 CCOCCNc1cccs1 79e0477f625c49165dc9a730b6981ba2 [0,1,0,0,1,0|2,0,0]=4 5593 B11R1.4 CCOCCNc1ccoc1 ceb28da3f53f1a7b716fae0923cbcbba [0,1,0,0,1,0|2,0,0]=4 5594 B11R1.4 CCOCCNc1ccon1 10a514512d3fe7e2404001ef5de04c12 [0,1,0,0,1,0|2,0,0]=4 5595 B11R1.4 CCOCCNc1ccsc1 77b239f16add22f47574850ee05f114e [0,1,0,0,1,0|2,0,0]=4 5596 B11R1.4 CCOCCNc1ccsn1 598550ebbc741f457d6889e4143c86cd [0,1,0,0,1,0|2,0,0]=4 5597 B11R1.4 CCOCCNc1cocn1 55b387a647de47c6cf0791cc9465a0dd [0,1,0,0,1,0|2,0,0]=4 5598 B11R1.4 CCOCCNc1cscn1 d96bb0f3e706429a6b3c29d718ada96a [0,1,0,0,1,0|2,0,0]=4 5599 B11R1.4 CCOCCNc1ncc[nH]1 667faac364380e3b62d8e7006b500152 [0,1,0,0,1,0|2,0,0]=4 5600 B11R1.4 CCOCCNc1ncco1 ccc1aad269365522ab3e03e0b06f7fbe [0,1,0,0,1,0|2,0,0]=4 5601 B11R1.4 CCOCCNc1nccs1 9af09566ff3c87f17d984a5f536b52d5 [0,1,0,0,1,0|2,0,0]=4 5602 B11R1.4 CCOCCOc1c[nH]cn1 b5322efc4d13345ba7c455c0c2ffa2aa [0,1,0,0,1,0|2,0,0]=4 5603 B11R1.4 CCOCCOc1ccco1 6e9586a66d86444d56b340b3cf832d00 [0,1,0,0,1,0|2,0,0]=4 5604 B11R1.4 CCOCCOc1cccs1 ca5078397450ab8d451fd9979dfbaf8a [0,1,0,0,1,0|2,0,0]=4 5605 B11R1.4 CCOCCOc1ccsc1 b3aa8aa9bbc6db0bc99af4dbd211af11 [0,1,0,0,1,0|2,0,0]=4 5606 B11R1.4 CCOCCOc1nccs1 04f38438e215b95c3a5d026aeede96cd [0,1,0,0,1,0|2,0,0]=4 5607 B11R1.4 CCOCCOn1cccn1 43b2a2308bc4503f072c773b33da4f87 [0,1,0,0,1,0|2,0,0]=4 5608 B11R1.4 CCOCNCc1cc[nH]c1 5a7a47d0d2ddcd763b6583db82d0f797 [0,1,0,0,1,0|2,0,0]=4 5609 B11R1.4 CCOCNCc1ccc[nH]1 9be41b66058059b0d3cbc6a49de45841 [0,1,0,0,1,0|1,0,1]=4 5610 B11R1.4 CCOCNCc1ccco1 f8372757a797acd586fed673a112e283 [0,1,0,0,1,0|2,0,0]=4 5611 B11R1.4 CCOCNCc1cccs1 72e4789bc09ddbea420bdffe8a6a3776 [0,1,0,0,1,0|2,0,0]=4 5612 B11R1.4 CCOCNCc1ccon1 7fc4cd9670b0a82bb4f57bcd15bb4d3c [0,1,0,0,1,0|2,0,0]=4 5613 B11R1.4 CCOCNCc1ccsc1 fac8ee1efded62aab87045c8c1c4a2b3 [0,1,0,0,1,0|2,0,0]=4 5614 B11R1.4 CCOCNCc1ccsn1 d9dfb8eca01e96c77835be380d505283 [0,1,0,0,1,0|2,0,0]=4 5615 B11R1.4 CCOCNCc1cscn1 851b7d461fc8eebe0a1a2a6a61d3b8ed [0,1,0,0,1,0|2,0,0]=4 5616 B11R1.4 CCOCNCc1ncc[nH]1 f691e15c4159e1d607cfa0170dc7cdf0 [0,1,0,0,1,0|2,0,0]=4 5617 B11R1.4 CCOCNCc1ncco1 bdc6f12035dd5ee34afeee08d2bc95c3 [0,1,0,0,1,0|2,0,0]=4 5618 B11R1.4 CCOCNCc1nccs1 5729ac22dd0256104fff5c0ca11bdc64 [0,1,0,0,1,0|2,0,0]=4 5619 B11R1.4 CCOCOCc1ccc[nH]1 211c96508dedb2910a380eaf1ce01b5c [0,1,0,0,1,0|1,0,1]=4 5620 B11R1.4 CCOCOCc1ccsc1 0b65207f8fd466ee44b0b843dde2cd0a [0,1,0,0,1,0|2,0,0]=4 5621 B11R1.4 CCOCOCc1ncc[nH]1 369bc455ddf1aff79d3df71f1f55e537 [0,1,0,0,1,0|2,0,0]=4 5622 B11R1.4 CCOCOCc1ncco1 be1e48421d11f9735ead88960fd147d3 [0,1,0,0,1,0|2,0,0]=4 5623 B11R1.4 CCOCOCc1nccs1 4bc8a65f74a1b73cdb5b8b88b1fe974f [0,1,0,0,1,0|2,0,0]=4 5624 B11R1.4 CCOCOCn1cccn1 6b459b209b19907969cbaf6f8f0933d0 [0,1,0,0,1,0|2,0,0]=4 5625 B11R1.4 CCSCCNc1cc[nH]n1 167de37bff4afc7978b20184219e592e [0,1,0,0,1,0|2,0,0]=4 5626 B11R1.4 CCSCCNc1cccs1 0d22172f1c832a97dffde5682e3eb2ba [0,1,0,0,1,0|2,0,0]=4 5627 B11R1.4 CCSCCNc1ccoc1 8228fb92ed8b83be507a70e2c2053f07 [0,1,0,0,1,0|2,0,0]=4 5628 B11R1.4 CCSCCNc1ccon1 4504b2c954f8f9c224628acbfd91a2e0 [0,1,0,0,1,0|2,0,0]=4 5629 B11R1.4 CCSCCNc1ccsc1 2a6e8f6959a0eed051e6d60dc8f9ce0a [0,1,0,0,1,0|2,0,0]=4 5630 B11R1.4 CCSCCNc1cocn1 229309044e424b71aad9413bbb84c1f1 [0,1,0,0,1,0|2,0,0]=4 5631 B11R1.4 CCSCCNc1cscn1 d447ecd424e7306db9c7486e2939ec84 [0,1,0,0,1,0|2,0,0]=4 5632 B11R1.4 CCSCCNc1ncc[nH]1 6606e174edb26b4e33d97263f8f58348 [0,1,0,0,1,0|2,0,0]=4 5633 B11R1.4 CCSCCNc1ncco1 3d36db83ec78b028549a82477600a0d3 [0,1,0,0,1,0|2,0,0]=4 5634 B11R1.4 CCSCCNc1nccs1 71b9434ad2484a035ec7bd57bd3fd796 [0,1,0,0,1,0|2,0,0]=4 5635 B11R1.4 CCSCCOc1c[nH]cn1 3f29bd6aef2a79356b95d64a29796001 [0,1,0,0,1,0|2,0,0]=4 5636 B11R1.4 CCSCCOc1ccco1 66dcfad105f9a9cb50616cc928734ed8 [0,1,0,0,1,0|2,0,0]=4 5637 B11R1.4 CCSCCOc1cccs1 3b5a7441262a5fcdcb52fe6c4daa82ae [0,1,0,0,1,0|2,0,0]=4 5638 B11R1.4 CCSCCOc1ccsc1 1606b2de4b1dde47188107bb8cb477e6 [0,1,0,0,1,0|2,0,0]=4 5639 B11R1.4 CCSCCOc1nccs1 4ca8c155c9896210e3f541ff12b6ed65 [0,1,0,0,1,0|2,0,0]=4 5640 B11R1.4 CCSCCOn1cccn1 d69e786dfd8f23faf01bbd1922743563 [0,1,0,0,1,0|2,0,0]=4 5641 B11R1.4 COCCCNc1c[nH]cn1 4690f87c46396c4000ca4a22dd46d5f3 [0,1,0,0,1,0|2,0,0]=4 5642 B11R1.4 COCCCNc1cc[nH]n1 0a61c55cfba96f2c701e5b00d5c5e841 [0,1,0,0,1,0|2,0,0]=4 5643 B11R1.4 COCCCNc1ccco1 2698f49049786585ce01cc05e9674da8 [0,1,0,0,1,0|2,0,0]=4 5644 B11R1.4 COCCCNc1cccs1 7f7a5af46ea6e9f0c52e59c7f1d832ed [0,1,0,0,1,0|2,0,0]=4 5645 B11R1.4 COCCCNc1ccoc1 7da15c00e1bcececad0a7fd6f14428fe [0,1,0,0,1,0|2,0,0]=4 5646 B11R1.4 COCCCNc1ccon1 d641cc22ceaee451e19e2f634c1246d7 [0,1,0,0,1,0|2,0,0]=4 5647 B11R1.4 COCCCNc1ccsc1 d910de907982bdb6d2cbea7665877ea7 [0,1,0,0,1,0|2,0,0]=4 5648 B11R1.4 COCCCNc1ccsn1 5c592747708c4dd4f39d19d247b26190 [0,1,0,0,1,0|2,0,0]=4 5649 B11R1.4 COCCCNc1cocn1 09c105eb4fe3411c2a77b9be8a55af8d [0,1,0,0,1,0|2,0,0]=4 5650 B11R1.4 COCCCNc1cscn1 fe23937fa2f0f15acf151e61359a09db [0,1,0,0,1,0|2,0,0]=4 5651 B11R1.4 COCCCNc1ncc[nH]1 5ca99874c98cd9c2900be8425b076b41 [0,1,0,0,1,0|2,0,0]=4 5652 B11R1.4 COCCCNc1ncco1 e9dd8234360b9a5d70ee7d8634015004 [0,1,0,0,1,0|2,0,0]=4 5653 B11R1.4 COCCCNc1nccs1 11ad58361977dfbe168bb856e4f05b74 [0,1,0,0,1,0|2,0,0]=4 5654 B11R1.4 COCCCOc1c[nH]cn1 65068a29f5c1582135acb5b6715c546e [0,1,0,0,1,0|2,0,0]=4 5655 B11R1.4 COCCCOc1ccco1 fdae3f18325cc419b6230e879537460e [0,1,0,0,1,0|2,0,0]=4 5656 B11R1.4 COCCCOc1cccs1 cd4a824920495624ceda3bdff6698441 [0,1,0,0,1,0|2,0,0]=4 5657 B11R1.4 COCCCOc1ccsc1 f37b02f502cfcdead48bf16d2ce511a2 [0,1,0,0,1,0|2,0,0]=4 5658 B11R1.4 COCCCOc1nccs1 3aa44f6508bbf78153a4e349824e82af [0,1,0,0,1,0|2,0,0]=4 5659 B11R1.4 COCCCOn1cccn1 e223a3a703c067034697d369aa12a680 [0,1,0,0,1,0|2,0,0]=4 5660 B11R1.4 COCCNCc1cc[nH]c1 37a8a257ef69e67b4c5c8b139741b499 [0,1,0,0,1,0|2,0,0]=4 5661 B11R1.4 COCCNCc1ccc[nH]1 ba1dafb10fa16689658524458913d3e3 [0,1,0,0,1,0|1,0,1]=4 5662 B11R1.4 COCCNCc1ccco1 95b208c7b624cddd811e5f2a5fcb58cd [0,1,0,0,1,0|2,0,0]=4 5663 B11R1.4 COCCNCc1cccs1 b64f6cbf986a6fce5f237ce3c5cace5d [0,1,0,0,1,0|2,0,0]=4 5664 B11R1.4 COCCNCc1ccoc1 2897bb321a698f16a6d87bd3a04096e7 [0,1,0,0,1,0|2,0,0]=4 5665 B11R1.4 COCCNCc1ccon1 f681f1d4e6f9c192f26080b25980c74c [0,1,0,0,1,0|2,0,0]=4 5666 B11R1.4 COCCNCc1ccsc1 541b35d2334b84a1d599839e5bcb03bc [0,1,0,0,1,0|2,0,0]=4 5667 B11R1.4 COCCNCc1ccsn1 f9f529fc3d3e40b2382c7ca93ad8c401 [0,1,0,0,1,0|2,0,0]=4 5668 B11R1.4 COCCNCc1cocn1 dc4e0cda35f1a2a2004fe2204248002a [0,1,0,0,1,0|2,0,0]=4 5669 B11R1.4 COCCNCc1cscn1 90a031bf8e5e34407ab5457829bd049b [0,1,0,0,1,0|2,0,0]=4 5670 B11R1.4 COCCNCc1ncc[nH]1 693d6bf675ad1f3b9ccca1d325dae838 [0,1,0,0,1,0|2,0,0]=4 5671 B11R1.4 COCCNCc1ncco1 6058f48f2667fa5c9072b4bff8919b03 [0,1,0,0,1,0|2,0,0]=4 5672 B11R1.4 COCCNCc1nccs1 6ffc3ea34ca6d573446860ba8b3f6e20 [0,1,0,0,1,0|2,0,0]=4 5673 B11R1.4 COCCOCc1cc[nH]c1 642e078d891d98cb6df02afb6738b066 [0,1,0,0,1,0|2,0,0]=4 5674 B11R1.4 COCCOCc1ccc[nH]1 5ec658ee6d77dfc99d5a47486a1dea19 [0,1,0,0,1,0|1,0,1]=4 5675 B11R1.4 COCCOCc1ccco1 725e3ef2791da41304e32ce1e5b866bc [0,1,0,0,1,0|2,0,0]=4 5676 B11R1.4 COCCOCc1cccs1 f71d1903930bb151d95b050c4831fcdc [0,1,0,0,1,0|2,0,0]=4 5677 B11R1.4 COCCOCc1ccoc1 8aa5b618d954632c161b50baf6b29d3e [0,1,0,0,1,0|2,0,0]=4 5678 B11R1.4 COCCOCc1ccon1 6bc163d9b89afb6d1840b71f910c27b7 [0,1,0,0,1,0|2,0,0]=4 5679 B11R1.4 COCCOCc1ccsc1 8f6fab02b5ace309a7ff01c05375888c [0,1,0,0,1,0|2,0,0]=4 5680 B11R1.4 COCCOCc1ccsn1 797c55451bef14213fe7342021de8adb [0,1,0,0,1,0|2,0,0]=4 5681 B11R1.4 COCCOCc1cocn1 1ebe54eb445f0966602b3edc41257e51 [0,1,0,0,1,0|2,0,0]=4 5682 B11R1.4 COCCOCc1cscn1 197719d3c45ddfc23c59e9170b5c9099 [0,1,0,0,1,0|2,0,0]=4 5683 B11R1.4 COCCOCc1ncc[nH]1 ae8be3b68de223cbe92a01aef24e5bf7 [0,1,0,0,1,0|2,0,0]=4 5684 B11R1.4 COCCOCc1ncco1 7dbb3f508d930a39573504b9fd1639fe [0,1,0,0,1,0|2,0,0]=4 5685 B11R1.4 COCCOCc1nccs1 fef8214473beec5abdc7d2c96e8b6011 [0,1,0,0,1,0|2,0,0]=4 5686 B11R1.4 COCCOCn1cccn1 83d1703845e9794910cdbe9a443bb006 [0,1,0,0,1,0|2,0,0]=4 5687 B11R1.4 COCNCCc1c[nH]cn1 9a88dc6a2ab6a7d66ec9eddc40961899 [0,1,0,0,1,0|2,0,0]=4 5688 B11R1.4 COCNCCc1cc[nH]n1 9484c0628e37c9b1bb204e9671319856 [0,1,0,0,1,0|2,0,0]=4 5689 B11R1.4 COCNCCc1ccc[nH]1 38efdc886105d94cf9821aa71642e5c9 [0,1,0,0,1,0|1,0,1]=4 5690 B11R1.4 COCNCCc1ccco1 01716a3a6ad3af574182df1f09e586ab [0,1,0,0,1,0|2,0,0]=4 5691 B11R1.4 COCNCCc1cccs1 d1f55c6b770ea09a64354d1cdc6d63a9 [0,1,0,0,1,0|2,0,0]=4 5692 B11R1.4 COCNCCc1ccsc1 26515c6119bc9d848b06ede2a4bb45e5 [0,1,0,0,1,0|2,0,0]=4 5693 B11R1.4 COCNCCc1cscn1 9ddb058d3133772eae465b3afb4355f2 [0,1,0,0,1,0|2,0,0]=4 5694 B11R1.4 COCNCCc1ncc[nH]1 68183a48d70a05fd244b45fb47d70ab2 [0,1,0,0,1,0|2,0,0]=4 5695 B11R1.4 COCNCCc1nccs1 8510b6d5716b6b974f5cc6fd935ba933 [0,1,0,0,1,0|2,0,0]=4 5696 B11R1.4 COCNCCn1cccc1 d22a9761eeee22b4a29078b613183ad8 [0,1,0,0,1,0|2,0,0]=4 5697 B11R1.4 COCNCCn1cccn1 a25242bb6934c8d7661bf553a71bc711 [0,1,0,0,1,0|2,0,0]=4 5698 B11R1.4 COCOCCc1c[nH]cn1 6fcbe4c14c5ba24dfed665b43553ea94 [0,1,0,0,1,0|2,0,0]=4 5699 B11R1.4 COCOCCc1cc[nH]n1 f33687120d28bb79f94010257b59cc80 [0,1,0,0,1,0|2,0,0]=4 5700 B11R1.4 COCOCCc1ccc[nH]1 9728b75800dac484394c34a2d99089b0 [0,1,0,0,1,0|1,0,1]=4 5701 B11R1.4 COCOCCc1ccco1 f2f63f9f1bf1f51f1af61b5279480956 [0,1,0,0,1,0|2,0,0]=4 5702 B11R1.4 COCOCCc1cccs1 a9c4173df95f3fc4dfab58c1b2cb6458 [0,1,0,0,1,0|2,0,0]=4 5703 B11R1.4 COCOCCc1ccoc1 51b3dd371af199ca604991f5cf3a72ce [0,1,0,0,1,0|2,0,0]=4 5704 B11R1.4 COCOCCc1ccon1 da1d46e401acc2483ff3e4bf5d1f611f [0,1,0,0,1,0|2,0,0]=4 5705 B11R1.4 COCOCCc1ccsc1 58e1b514e5363b59740ca9634d97ea6c [0,1,0,0,1,0|2,0,0]=4 5706 B11R1.4 COCOCCc1cscn1 32aad87b43d535d694bc03e7078a2d6c [0,1,0,0,1,0|2,0,0]=4 5707 B11R1.4 COCOCCc1ncc[nH]1 5900081daad7747dfed539cfbb019144 [0,1,0,0,1,0|2,0,0]=4 5708 B11R1.4 COCOCCc1nccs1 5ecf62df0db05b6786b486805043e52c [0,1,0,0,1,0|2,0,0]=4 5709 B11R1.4 COCOCCn1cccc1 91d74a48c3113d6c5df58c1ef0479a01 [0,1,0,0,1,0|2,0,0]=4 5710 B11R1.4 COCOCCn1cccn1 22aec0e3ad6b23a7561694347c485094 [0,1,0,0,1,0|2,0,0]=4 5711 B11R1.4 CSCCCNc1c[nH]cn1 8ef70c9b07767162fc03a9dab8f5a750 [0,1,0,0,1,0|2,0,0]=4 5712 B11R1.4 CSCCCNc1cc[nH]n1 4c86a1dc07ce06b61ba351efb89a37ce [0,1,0,0,1,0|2,0,0]=4 5713 B11R1.4 CSCCCNc1ccco1 223703238a745a139187ced906fbfa6e [0,1,0,0,1,0|2,0,0]=4 5714 B11R1.4 CSCCCNc1cccs1 7047ab441ce8681f3f802adb99adf1d4 [0,1,0,0,1,0|2,0,0]=4 5715 B11R1.4 CSCCCNc1ccoc1 2fedea1604e6d299476007ddb7de1b1e [0,1,0,0,1,0|2,0,0]=4 5716 B11R1.4 CSCCCNc1ccon1 3a88c799939e0de8e3ebf25afad2d678 [0,1,0,0,1,0|2,0,0]=4 5717 B11R1.4 CSCCCNc1ccsc1 b3c2acf3d8f35348b19107c842963b14 [0,1,0,0,1,0|2,0,0]=4 5718 B11R1.4 CSCCCNc1cocn1 13c2cb5dea049697dd8674e2fc7dcfdf [0,1,0,0,1,0|2,0,0]=4 5719 B11R1.4 CSCCCNc1cscn1 c514e83be8d58cdb55d6a28d29de0b22 [0,1,0,0,1,0|2,0,0]=4 5720 B11R1.4 CSCCCNc1ncc[nH]1 ffb3d214f99237f6f1ffe4967edad9d1 [0,1,0,0,1,0|2,0,0]=4 5721 B11R1.4 CSCCCNc1ncco1 4f36d93c87f185c5cd23840a68aea376 [0,1,0,0,1,0|2,0,0]=4 5722 B11R1.4 CSCCCNc1nccs1 7ec61843ed45935aeeea825a53c37116 [0,1,0,0,1,0|2,0,0]=4 5723 B11R1.4 CSCCCOc1c[nH]cn1 bf9a4caed1a4bcc29617d389401cb31d [0,1,0,0,1,0|2,0,0]=4 5724 B11R1.4 CSCCCOc1ccco1 e2133051d839d99bbaa38e4710539e4b [0,1,0,0,1,0|2,0,0]=4 5725 B11R1.4 CSCCCOc1cccs1 ffdb55b785cf0e61a2599e679c479d0c [0,1,0,0,1,0|2,0,0]=4 5726 B11R1.4 CSCCCOc1ccsc1 dadd93741486f40343b6f812952a1972 [0,1,0,0,1,0|2,0,0]=4 5727 B11R1.4 CSCCCOc1nccs1 4d1b721a162cdfb0d6d1bc7d5f1242da [0,1,0,0,1,0|2,0,0]=4 5728 B11R1.4 CSCCCOn1cccn1 a195c1fb37b5b726a24ed682f340ef27 [0,1,0,0,1,0|2,0,0]=4 5729 B11R1.4 CSCCNCc1cc[nH]c1 d5ef17bb9afd3a8e726462c7cdf12c0d [0,1,0,0,1,0|2,0,0]=4 5730 B11R1.4 CSCCNCc1ccc[nH]1 663c165ee784e75651acb378068d177c [0,1,0,0,1,0|1,0,1]=4 5731 B11R1.4 CSCCNCc1ccco1 42df10d55abb408d0ad366e0a0c4708d [0,1,0,0,1,0|2,0,0]=4 5732 B11R1.4 CSCCNCc1cccs1 406001f20844c09468e0ec14fbbb7d49 [0,1,0,0,1,0|2,0,0]=4 5733 B11R1.4 CSCCNCc1ccoc1 59d8d440416ef1a9141a5bd2a2a0e524 [0,1,0,0,1,0|2,0,0]=4 5734 B11R1.4 CSCCNCc1ccon1 43f31b4a05d89b0863e7a8e145e047e9 [0,1,0,0,1,0|2,0,0]=4 5735 B11R1.4 CSCCNCc1ccsc1 e44cf78862996290bed04b8bceabc28e [0,1,0,0,1,0|2,0,0]=4 5736 B11R1.4 CSCCNCc1ccsn1 970d37899290358dac9e0db3aa72e01c [0,1,0,0,1,0|2,0,0]=4 5737 B11R1.4 CSCCNCc1cocn1 2bab9be8b3078f26deb70851bbc149ba [0,1,0,0,1,0|2,0,0]=4 5738 B11R1.4 CSCCNCc1cscn1 312c796d6d166ce45c9de65a1c9285d3 [0,1,0,0,1,0|2,0,0]=4 5739 B11R1.4 CSCCNCc1ncc[nH]1 323c9dfc43f7927d903de4315b621d9f [0,1,0,0,1,0|2,0,0]=4 5740 B11R1.4 CSCCNCc1ncco1 3824395e3f7c405a1e18c0dfe69c5d55 [0,1,0,0,1,0|2,0,0]=4 5741 B11R1.4 CSCCNCc1nccs1 522f5bf693ceae7f2e385201a49f5db9 [0,1,0,0,1,0|2,0,0]=4 5742 B11R1.4 CSCCOCc1cc[nH]c1 08fea5e015c4a3d04cbe6b565e712060 [0,1,0,0,1,0|2,0,0]=4 5743 B11R1.4 CSCCOCc1ccc[nH]1 6905b6bd351b8c08d76ceed74f76249a [0,1,0,0,1,0|1,0,1]=4 5744 B11R1.4 CSCCOCc1ccco1 eac04375621a34591b4b2bb2707e69f4 [0,1,0,0,1,0|2,0,0]=4 5745 B11R1.4 CSCCOCc1cccs1 27fe4247bee9a12769bf2086a28cd033 [0,1,0,0,1,0|2,0,0]=4 5746 B11R1.4 CSCCOCc1ccoc1 cd55e314581ad3093df73b5d4f73731c [0,1,0,0,1,0|2,0,0]=4 5747 B11R1.4 CSCCOCc1ccon1 26e003bbc3be80d07c65c5181d2f7f53 [0,1,0,0,1,0|2,0,0]=4 5748 B11R1.4 CSCCOCc1ccsc1 861aaddf20053ff3e3279bae84ce3a94 [0,1,0,0,1,0|2,0,0]=4 5749 B11R1.4 CSCCOCc1ccsn1 0160342dc999b38781627aaa12560333 [0,1,0,0,1,0|2,0,0]=4 5750 B11R1.4 CSCCOCc1cocn1 68f39ec0ec8508b531d4f85927c8ec84 [0,1,0,0,1,0|2,0,0]=4 5751 B11R1.4 CSCCOCc1cscn1 e0a714db992b49a6c059079210f1a199 [0,1,0,0,1,0|2,0,0]=4 5752 B11R1.4 CSCCOCc1ncc[nH]1 d6b2553b7cfb43eb92ead8aca44ae2ca [0,1,0,0,1,0|2,0,0]=4 5753 B11R1.4 CSCCOCc1ncco1 59fe839471d2f2fe036614bfbdc9066c [0,1,0,0,1,0|2,0,0]=4 5754 B11R1.4 CSCCOCc1nccs1 b1478b5a01c582993aeb9801545101d7 [0,1,0,0,1,0|2,0,0]=4 5755 B11R1.4 CSCCOCn1cccn1 746ddeae327f051ba9dcf6a706abafc6 [0,1,0,0,1,0|2,0,0]=4 5756 B11R1.4 CSCNCCc1c[nH]cn1 56f9e493a17ecc4a3ecb62ef095ebc2b [0,1,0,0,1,0|2,0,0]=4 5757 B11R1.4 CSCNCCc1cc[nH]n1 aa32549179241789f07f4f9ffcbaa47b [0,1,0,0,1,0|2,0,0]=4 5758 B11R1.4 CSCNCCc1ccc[nH]1 f3ac006640e0c931018b79c4194d9e5a [0,1,0,0,1,0|1,0,1]=4 5759 B11R1.4 CSCNCCc1ccco1 955d7527c9b30b0eeb00d78c8d1ca80c [0,1,0,0,1,0|2,0,0]=4 5760 B11R1.4 CSCNCCc1cccs1 29f01b51043bdd08be9a0bb27c5d1ce4 [0,1,0,0,1,0|2,0,0]=4 5761 B11R1.4 CSCNCCc1ccsc1 108cbe713a53259557996461f775d07a [0,1,0,0,1,0|2,0,0]=4 5762 B11R1.4 CSCNCCc1cscn1 f8617fb3fb5d1e106eb147ff88d0301c [0,1,0,0,1,0|2,0,0]=4 5763 B11R1.4 CSCNCCc1ncc[nH]1 2f0b39dec906f7935c8f6724b51095b8 [0,1,0,0,1,0|2,0,0]=4 5764 B11R1.4 CSCNCCc1nccs1 4d7e8f209871747c1602274e12e10cab [0,1,0,0,1,0|2,0,0]=4 5765 B11R1.4 CSCNCCn1cccc1 7f40b2f31e24ef499f5c1964404d60be [0,1,0,0,1,0|2,0,0]=4 5766 B11R1.4 CSCNCCn1cccn1 11a0a5a06c84f4d25247702961413a38 [0,1,0,0,1,0|2,0,0]=4 5767 B11R1.4 CSCOCCc1c[nH]cn1 28ba63414b90c4d86f11fd807bc57da2 [0,1,0,0,1,0|2,0,0]=4 5768 B11R1.4 CSCOCCc1cc[nH]n1 8fdcf7c58988900958dfe78666b91aa4 [0,1,0,0,1,0|2,0,0]=4 5769 B11R1.4 CSCOCCc1ccc[nH]1 a44acba0819df33cad3b4edc3b253b87 [0,1,0,0,1,0|1,0,1]=4 5770 B11R1.4 CSCOCCc1ccco1 8dea1195639a3e1bcc76e392ed019f61 [0,1,0,0,1,0|2,0,0]=4 5771 B11R1.4 CSCOCCc1cccs1 128babf07c40198c5238350227e4de19 [0,1,0,0,1,0|2,0,0]=4 5772 B11R1.4 CSCOCCc1ccoc1 0c66f31bd56d8b072f17dd2757b61fa2 [0,1,0,0,1,0|2,0,0]=4 5773 B11R1.4 CSCOCCc1ccon1 dd074217dfdae31156166346c3a65e71 [0,1,0,0,1,0|2,0,0]=4 5774 B11R1.4 CSCOCCc1ccsc1 50095dc198c6dc0f5dd2f7fb06a0b813 [0,1,0,0,1,0|2,0,0]=4 5775 B11R1.4 CSCOCCc1cscn1 195966d4f536840856634de95de788ee [0,1,0,0,1,0|2,0,0]=4 5776 B11R1.4 CSCOCCc1ncc[nH]1 020ded2b61e5f3711418ab7d9e42666d [0,1,0,0,1,0|2,0,0]=4 5777 B11R1.4 CSCOCCc1nccs1 4bb757923ca214e4211101fcdb1f4fbf [0,1,0,0,1,0|2,0,0]=4 5778 B11R1.4 CSCOCCn1cccc1 a3c24f899e7082a5a6a6c17585823d17 [0,1,0,0,1,0|2,0,0]=4 5779 B11R1.4 CSCOCCn1cccn1 760b60622bfea01a03c6ee78c49ae8ae [0,1,0,0,1,0|2,0,0]=4 5780 B11R1.4 ClCCCCNc1c[nH]cn1 977c7cbcbfdb02986b69e0b912153ad9 [0,1,0,0,1,0|2,0,0]=4 5781 B11R1.4 ClCCCCNc1cc[nH]n1 ae00b2b6913d6462450ea55436ffff77 [0,1,0,0,1,0|2,0,0]=4 5782 B11R1.4 ClCCCCNc1ccco1 4f6047e8053e4ca5b20756d4602d7b57 [0,1,0,0,1,0|2,0,0]=4 5783 B11R1.4 ClCCCCNc1cccs1 6b3f2c92909060f20e07e192b348e7ff [0,1,0,0,1,0|2,0,0]=4 5784 B11R1.4 ClCCCCNc1ccoc1 771cbc91e9831047a3b4b5849879de18 [0,1,0,0,1,0|2,0,0]=4 5785 B11R1.4 ClCCCCNc1ccon1 bdf06c79831f778a94c5f6671e0db85f [0,1,0,0,1,0|2,0,0]=4 5786 B11R1.4 ClCCCCNc1ccsc1 5e59622f571d768b86af2240cee65364 [0,1,0,0,1,0|2,0,0]=4 5787 B11R1.4 ClCCCCNc1ccsn1 5714b87c811bfd9992dfcaca69dddb68 [0,1,0,0,1,0|2,0,0]=4 5788 B11R1.4 ClCCCCNc1cocn1 c65e7ed7c4920883aa7f1c7cff9e2cd9 [0,1,0,0,1,0|2,0,0]=4 5789 B11R1.4 ClCCCCNc1cscn1 604b46cb139878ab65924ec362f02518 [0,1,0,0,1,0|2,0,0]=4 5790 B11R1.4 ClCCCCNc1ncc[nH]1 49c1fd38f96c4d31727301734cbcaf00 [0,1,0,0,1,0|2,0,0]=4 5791 B11R1.4 ClCCCCNc1ncco1 72a7d5310ba6c76a178f7a4f21ce07bd [0,1,0,0,1,0|2,0,0]=4 5792 B11R1.4 ClCCCCNc1nccs1 0a85a337d821f4718f993f92463dab95 [0,1,0,0,1,0|2,0,0]=4 5793 B11R1.4 ClCCCNCc1ccco1 d4243492a69efa66f1e7fb6a77308e50 [0,1,0,0,1,0|2,0,0]=4 5794 B11R1.4 ClCCCNCc1cccs1 22325fc75e412ffdabfb9058e1260a45 [0,1,0,0,1,0|2,0,0]=4 5795 B11R1.4 ClCCCNCc1ccon1 5dae4f5d57345c0a2dec8f9f02e9ec35 [0,1,0,0,1,0|2,0,0]=4 5796 B11R1.4 ClCCCNCc1ccsc1 a8486adc4bf73826c2ab1ff68a9c9b33 [0,1,0,0,1,0|2,0,0]=4 5797 B11R1.4 ClCCCNCc1cocn1 d17ded16426ed87da5bbadd7a29ed513 [0,1,0,0,1,0|2,0,0]=4 5798 B11R1.4 ClCCCNCc1cscn1 efcbc2c04551947b8a012bb7bc8e3292 [0,1,0,0,1,0|2,0,0]=4 5799 B11R1.4 ClCCCNCc1ncc[nH]1 2fa8a0ac7c465a7c3c2acb2af6b10837 [0,1,0,0,1,0|2,0,0]=4 5800 B11R1.4 ClCCCNCc1ncco1 0ba4f86ac9a859f062b05e13a10c9beb [0,1,0,0,1,0|2,0,0]=4 5801 B11R1.4 ClCCCNCc1nccs1 4efebe5068c8828907e39fdc24441893 [0,1,0,0,1,0|2,0,0]=4 5802 B11R1.4 FCCCCNc1cc[nH]n1 655bf583735f0b873b70683002c0c3d9 [0,1,0,0,1,0|2,0,0]=4 5803 B11R1.4 FCCCCNc1cccs1 10178c144a22aa3cb2dc580b04173624 [0,1,0,0,1,0|2,0,0]=4 5804 B11R1.4 FCCCCNc1ccon1 8d6617fffe1f1916ab9a0d1731f3a84f [0,1,0,0,1,0|2,0,0]=4 5805 B11R1.4 FCCCCNc1ccsc1 190388be255589a76c0c42805309b035 [0,1,0,0,1,0|2,0,0]=4 5806 B11R1.4 FCCCCNc1cocn1 3e87d0840e20cbe17615e18b644bc753 [0,1,0,0,1,0|2,0,0]=4 5807 B11R1.4 FCCCCNc1cscn1 1d6419b41df4785b4d5926eebff0c64b [0,1,0,0,1,0|2,0,0]=4 5808 B11R1.4 FCCCCNc1ncc[nH]1 79bd6154041d1b1156c4e1212d1016c8 [0,1,0,0,1,0|2,0,0]=4 5809 B11R1.4 FCCCCNc1ncco1 a65493e8220391156b57a92c3bfc5c18 [0,1,0,0,1,0|2,0,0]=4 5810 B11R1.4 FCCCCNc1nccs1 c9bae48c01a5c08c98409ab73a55535e [0,1,0,0,1,0|2,0,0]=4 5811 B11R1.4 FCCCCOc1c[nH]cn1 bff215c37c07e48a6bc1af5702f68aee [0,1,0,0,1,0|2,0,0]=4 5812 B11R1.4 FCCCCOc1ccco1 3b5c1d18672ef37f9a77a1d4822c80a3 [0,1,0,0,1,0|2,0,0]=4 5813 B11R1.4 FCCCCOc1cccs1 df311f8707202d078f51aecc58b1dd60 [0,1,0,0,1,0|2,0,0]=4 5814 B11R1.4 FCCCCOc1ccsc1 694031f572054149f8c6174bd3298b91 [0,1,0,0,1,0|2,0,0]=4 5815 B11R1.4 FCCCCOc1nccs1 b4afce47a27856f4ccf7d36f59c17f79 [0,1,0,0,1,0|2,0,0]=4 5816 B11R1.4 FCCCCOn1cccn1 900f5bade9e01f09e5275c13f7bc75bc [0,1,0,0,1,0|2,0,0]=4 5817 B11R1.4 FCCCNCc1cc[nH]c1 d89bb3ca0c0b8cd4633fff512e6b00a4 [0,1,0,0,1,0|2,0,0]=4 5818 B11R1.4 FCCCNCc1ccc[nH]1 4afa2badc34d7dc38016e5d484a753fc [0,1,0,0,1,0|1,0,1]=4 5819 B11R1.4 FCCCNCc1ccco1 836b8bdb852f84cab6130efd98b98b93 [0,1,0,0,1,0|2,0,0]=4 5820 B11R1.4 FCCCNCc1cccs1 5a3b72d0c0f17fbc792f26a7cc009d2a [0,1,0,0,1,0|2,0,0]=4 5821 B11R1.4 FCCCNCc1ccoc1 31040cbd62b6f16134c1f6f037b48edd [0,1,0,0,1,0|2,0,0]=4 5822 B11R1.4 FCCCNCc1ccon1 5d6656edec6e1bce5923ca532bb9ed42 [0,1,0,0,1,0|2,0,0]=4 5823 B11R1.4 FCCCNCc1ccsc1 0e667941d81b2c39210021d5612ef6f1 [0,1,0,0,1,0|2,0,0]=4 5824 B11R1.4 FCCCNCc1ccsn1 65f57459a2a08d2a77e159568c103580 [0,1,0,0,1,0|2,0,0]=4 5825 B11R1.4 FCCCNCc1cocn1 415240196d3a8bb73d39942b4922e0a7 [0,1,0,0,1,0|2,0,0]=4 5826 B11R1.4 FCCCNCc1cscn1 94cc349ac3fc08e83642f05a57280f39 [0,1,0,0,1,0|2,0,0]=4 5827 B11R1.4 FCCCNCc1ncc[nH]1 eb23ce5ecd79185c26c173c3119077f5 [0,1,0,0,1,0|2,0,0]=4 5828 B11R1.4 FCCCNCc1ncco1 e9fed45dee39b4aed30c895807c03237 [0,1,0,0,1,0|2,0,0]=4 5829 B11R1.4 FCCCNCc1nccs1 68404319bc6a5616190dfa98fdf1d499 [0,1,0,0,1,0|2,0,0]=4 5830 B11R1.4 FCCCOCc1cc[nH]c1 e41a875131265e995f4be0f3ee25202e [0,1,0,0,1,0|2,0,0]=4 5831 B11R1.4 FCCCOCc1ccc[nH]1 69719709fe965e96bece65accc09f13e [0,1,0,0,1,0|1,0,1]=4 5832 B11R1.4 FCCCOCc1ccco1 94372377083fec1a5603bb5c43f9ac14 [0,1,0,0,1,0|2,0,0]=4 5833 B11R1.4 FCCCOCc1cccs1 c4749abd0338e9b64bcf0fe4bd81b1a6 [0,1,0,0,1,0|2,0,0]=4 5834 B11R1.4 FCCCOCc1ccoc1 5a0d690f493bdb49f3af3b903502941a [0,1,0,0,1,0|2,0,0]=4 5835 B11R1.4 FCCCOCc1ccon1 1baf703b9ad0d7fb2e02916ff623436f [0,1,0,0,1,0|2,0,0]=4 5836 B11R1.4 FCCCOCc1ccsc1 efc33fc4d228e4142cdf14948c66e0ec [0,1,0,0,1,0|2,0,0]=4 5837 B11R1.4 FCCCOCc1ccsn1 3327e9c7fde236537619b48a5c3d39da [0,1,0,0,1,0|2,0,0]=4 5838 B11R1.4 FCCCOCc1cocn1 e273dfb1424fc8b7d95d8f19becce176 [0,1,0,0,1,0|2,0,0]=4 5839 B11R1.4 FCCCOCc1cscn1 b0b445903642dbfddcf11cde194c3f42 [0,1,0,0,1,0|2,0,0]=4 5840 B11R1.4 FCCCOCc1ncc[nH]1 6f550c1aa59ec4dddf7912445346e50b [0,1,0,0,1,0|2,0,0]=4 5841 B11R1.4 FCCCOCc1ncco1 f626ea96f2bec2b7766ad43be1858b55 [0,1,0,0,1,0|2,0,0]=4 5842 B11R1.4 FCCCOCc1nccs1 575b17e44ad85c72d57b17b33c10b9aa [0,1,0,0,1,0|2,0,0]=4 5843 B11R1.4 FCCCOCn1cccn1 29adc29552ee0be4d1a7868e1a064a1d [0,1,0,0,1,0|2,0,0]=4 5844 B11R1.4 FCCNCCc1c[nH]cn1 c04262d71458490a6630e23e9511a295 [0,1,0,0,1,0|2,0,0]=4 5845 B11R1.4 FCCNCCc1cc[nH]n1 6c9ec946eec10a2fc1d47fff3ddb4e8a [0,1,0,0,1,0|2,0,0]=4 5846 B11R1.4 FCCNCCc1ccc[nH]1 4515e817818d93201484ee7633d8f6e3 [0,1,0,0,1,0|1,0,1]=4 5847 B11R1.4 FCCNCCc1ccco1 bbe974173ff688a990c92e6cecdfca9b [0,1,0,0,1,0|2,0,0]=4 5848 B11R1.4 FCCNCCc1cccs1 75482361be701a299fcc5bd6a1a0b494 [0,1,0,0,1,0|2,0,0]=4 5849 B11R1.4 FCCNCCc1ccsc1 aa3933d06339128561ef2b306ff9a7e9 [0,1,0,0,1,0|2,0,0]=4 5850 B11R1.4 FCCNCCc1cscn1 cb6d17bf0c5768e752d1b39c5818322b [0,1,0,0,1,0|2,0,0]=4 5851 B11R1.4 FCCNCCc1ncc[nH]1 df706bef82294e8b7adea96a76ee4186 [0,1,0,0,1,0|2,0,0]=4 5852 B11R1.4 FCCNCCc1nccs1 c952cbc949ceaac58f85cb929c6091b5 [0,1,0,0,1,0|2,0,0]=4 5853 B11R1.4 FCCNCCn1cccc1 53cc2a82b193eff4c1a7734a4d67b39e [0,1,0,0,1,0|2,0,0]=4 5854 B11R1.4 FCCNCCn1cccn1 72172785bcb5ff7cf916915e0a36e0d4 [0,1,0,0,1,0|2,0,0]=4 5855 B11R1.4 FCCOCCc1c[nH]cn1 026cd78d47398ff87f3accfb46124d4e [0,1,0,0,1,0|2,0,0]=4 5856 B11R1.4 FCCOCCc1cc[nH]n1 be898b1bbc26608f6791d658ad1601bf [0,1,0,0,1,0|2,0,0]=4 5857 B11R1.4 FCCOCCc1ccc[nH]1 f2f71f956c17e1cfce870a3440e61c15 [0,1,0,0,1,0|1,0,1]=4 5858 B11R1.4 FCCOCCc1ccco1 5e5e15a1764c722df3073dcf518946b1 [0,1,0,0,1,0|2,0,0]=4 5859 B11R1.4 FCCOCCc1cccs1 438258edc4e36e8c0b4f384531b9d94e [0,1,0,0,1,0|2,0,0]=4 5860 B11R1.4 FCCOCCc1ccoc1 e73706a1be5772d6d3a0b68ab617c993 [0,1,0,0,1,0|2,0,0]=4 5861 B11R1.4 FCCOCCc1ccon1 0776fbb2834a60a542931354f938a024 [0,1,0,0,1,0|2,0,0]=4 5862 B11R1.4 FCCOCCc1ccsc1 d12d940e9620a9cdf1911b2a5fb4c4a2 [0,1,0,0,1,0|2,0,0]=4 5863 B11R1.4 FCCOCCc1cscn1 a6c5ea155c25ff5357e165113da8889e [0,1,0,0,1,0|2,0,0]=4 5864 B11R1.4 FCCOCCc1ncc[nH]1 8cf732c276f10d0d941f4252b66e78b2 [0,1,0,0,1,0|2,0,0]=4 5865 B11R1.4 FCCOCCc1nccs1 9c496ea264999b5857cb43c622f09778 [0,1,0,0,1,0|2,0,0]=4 5866 B11R1.4 FCCOCCn1cccc1 9945f333f9bce052879f87ec3e91bee2 [0,1,0,0,1,0|2,0,0]=4 5867 B11R1.4 FCCOCCn1cccn1 1876b234033d761b40af321c3bb8fa93 [0,1,0,0,1,0|2,0,0]=4 5868 B11R1.4 FCNCCCc1c[nH]cn1 c47cc90906cf9e1490932036c30bbce2 [0,1,0,0,1,0|2,0,0]=4 5869 B11R1.4 FCNCCCc1ccco1 bfc44031b7a1395ee9f41bbfb06de8cc [0,1,0,0,1,0|2,0,0]=4 5870 B11R1.4 FCNCCCc1ncc[nH]1 c7cd56645534d5c0ff51ead75751f154 [0,1,0,0,1,0|2,0,0]=4 5871 B11R1.4 FCNCCCn1cccc1 00b0405c927ee380fde23766c7808c8b [0,1,0,0,1,0|2,0,0]=4 5872 B11R1.4 FCNCCCn1cccn1 64b29de7a960e81fd8c7997988be6f8e [0,1,0,0,1,0|2,0,0]=4 5873 B11R1.4 FCOCCCc1ccco1 ed76e12af137d43613d1af14dec05e88 [0,1,0,0,1,0|2,0,0]=4 5874 B11R1.4 FCOCCCc1cccs1 738559239cbdf8bb6496fa38443c6368 [0,1,0,0,1,0|2,0,0]=4 5875 B11R1.4 FCOCCCc1ccsc1 2323e903b4d1e0dac82ea6ccf588daf2 [0,1,0,0,1,0|2,0,0]=4 5876 B11R1.4 FCOCCCn1cccc1 99d7f0eca5cba0e89962674474d9f17c [0,1,0,0,1,0|2,0,0]=4 5877 B11R1.4 FCOCCCn1cccn1 b79ea996d784f81c4f9b11aa79adc0b2 [0,1,0,0,1,0|2,0,0]=4 5878 B11R1.4 ICCNCCc1c[nH]cn1 46c07a44188f8b2bfc6be626e4d2c2a3 [0,1,0,0,1,0|2,0,0]=4 5879 B11R1.4 ICCNCCc1cccs1 f9870a07a19881e189afbe938043274c [0,1,0,0,1,0|2,0,0]=4 5880 B11R1.4 ICCNCCc1ccsc1 93c7547c377eb8f2e9025f4ddb3c42e6 [0,1,0,0,1,0|2,0,0]=4 5881 B11R1.4 ICCNCCc1cscn1 a22570961ae5026044933e059bca2405 [0,1,0,0,1,0|2,0,0]=4 5882 B11R1.4 ICCNCCn1cccc1 277678d6d214d3c4af7d19f18b3b23ba [0,1,0,0,1,0|2,0,0]=4 5883 B11R1.4 ICCNCCn1cccn1 9de0668c6f068a4e2e5c067fcab7b13d [0,1,0,0,1,0|2,0,0]=4 5884 B11R1.4 OCCCCNc1c[nH]cn1 827a352ee9e81344320c3cb2b6912e4e [0,1,0,0,1,0|2,0,0]=4 5885 B11R1.4 OCCCCNc1cc[nH]n1 65698444ea5056c97cca119596d19fc4 [0,1,0,0,1,0|2,0,0]=4 5886 B11R1.4 OCCCCNc1ccco1 30c195c8aa3a91ef01061653326494d0 [0,1,0,0,1,0|2,0,0]=4 5887 B11R1.4 OCCCCNc1cccs1 84bc6766d6c8e7b66c767040cd840d9c [0,1,0,0,1,0|2,0,0]=4 5888 B11R1.4 OCCCCNc1ccoc1 b3b4900a73e189905b02829a78e386d1 [0,1,0,0,1,0|2,0,0]=4 5889 B11R1.4 OCCCCNc1ccon1 69c66f303db1692d61646404c93bc44f [0,1,0,0,1,0|2,0,0]=4 5890 B11R1.4 OCCCCNc1ccsc1 3ab3aa81764baf3c24010ab5b600fb55 [0,1,0,0,1,0|2,0,0]=4 5891 B11R1.4 OCCCCNc1ccsn1 796708d0365405fdd3c3f7d065c6e750 [0,1,0,0,1,0|2,0,0]=4 5892 B11R1.4 OCCCCNc1cocn1 b450010a6e7187277d44abd4d59fae2c [0,1,0,0,1,0|2,0,0]=4 5893 B11R1.4 OCCCCNc1cscn1 ae9dec82bc022fa54c08c828f46ab729 [0,1,0,0,1,0|2,0,0]=4 5894 B11R1.4 OCCCCNc1ncc[nH]1 7d9cdae6a1b5eedbda867ba260e62d18 [0,1,0,0,1,0|2,0,0]=4 5895 B11R1.4 OCCCCNc1ncco1 4fe7833c923ca4c1079b301e13933d98 [0,1,0,0,1,0|2,0,0]=4 5896 B11R1.4 OCCCCNc1nccs1 0972368be17621aacf5d2db5bd383125 [0,1,0,0,1,0|2,0,0]=4 5897 B11R1.4 OCCCNCc1cc[nH]c1 7c35ac1a90315347ba5c94ec4b70036d [0,1,0,0,1,0|2,0,0]=4 5898 B11R1.4 OCCCNCc1ccc[nH]1 d9e9831912f5074df4eea48a266b2c8a [0,1,0,0,1,0|1,0,1]=4 5899 B11R1.4 OCCCNCc1ccco1 62e48e7cb9db31099b0624d2f9d3a61b [0,1,0,0,1,0|2,0,0]=4 5900 B11R1.4 OCCCNCc1cccs1 88bc94852974b4551a7841459b7165b7 [0,1,0,0,1,0|2,0,0]=4 5901 B11R1.4 OCCCNCc1ccoc1 cb6d6c10c8d1e9fbb486a611728fd9ee [0,1,0,0,1,0|2,0,0]=4 5902 B11R1.4 OCCCNCc1ccon1 8a3b8fda9a9b3d0b9b577d07b6d3dcb3 [0,1,0,0,1,0|2,0,0]=4 5903 B11R1.4 OCCCNCc1ccsc1 349fbd5eafa36beb8430bdc4b8b02903 [0,1,0,0,1,0|2,0,0]=4 5904 B11R1.4 OCCCNCc1ccsn1 f75bee0446bd3b6a93c071732e9b8236 [0,1,0,0,1,0|2,0,0]=4 5905 B11R1.4 OCCCNCc1cocn1 67b3d67c1b238942c3d0dfdc3f5b6dae [0,1,0,0,1,0|2,0,0]=4 5906 B11R1.4 OCCCNCc1cscn1 2fc02265a8adf7560bb622337c5699b2 [0,1,0,0,1,0|2,0,0]=4 5907 B11R1.4 OCCCNCc1ncc[nH]1 2d3ac628613228dd2d98baa555d3dba3 [0,1,0,0,1,0|2,0,0]=4 5908 B11R1.4 OCCCNCc1ncco1 987b17dbd45b3e85af1e3f60fb6c357d [0,1,0,0,1,0|2,0,0]=4 5909 B11R1.4 OCCCNCc1nccs1 4a5e53fa276c788ac1f7066055bc0728 [0,1,0,0,1,0|2,0,0]=4 5910 B11R1.4 OCCNCCc1c[nH]cn1 7265fa602cc3fd239fa763186f7ee489 [0,1,0,0,1,0|2,0,0]=4 5911 B11R1.4 OCCNCCc1cc[nH]n1 727ca4a809a7a58ec590766b3a899b34 [0,1,0,0,1,0|2,0,0]=4 5912 B11R1.4 OCCNCCc1ccc[nH]1 5d2d8048903556b7c332401fbd20e9b4 [0,1,0,0,1,0|1,0,1]=4 5913 B11R1.4 OCCNCCc1ccco1 078e622e2d862de800291c9a8873a5c8 [0,1,0,0,1,0|2,0,0]=4 5914 B11R1.4 OCCNCCc1cccs1 dc65fa9fd4b336c41fc766f2b9c0b1a5 [0,1,0,0,1,0|2,0,0]=4 5915 B11R1.4 OCCNCCc1ccsc1 a65da01e99f833f056da0c38a50e94fa [0,1,0,0,1,0|2,0,0]=4 5916 B11R1.4 OCCNCCc1cscn1 f1bcea372efdae7f654524cc1729d29b [0,1,0,0,1,0|2,0,0]=4 5917 B11R1.4 OCCNCCc1ncc[nH]1 40df81b96422a0e237809d06e5139acc [0,1,0,0,1,0|2,0,0]=4 5918 B11R1.4 OCCNCCc1nccs1 2c2b237d931fb68e18163d3a91ccacdf [0,1,0,0,1,0|2,0,0]=4 5919 B11R1.4 OCCNCCn1cccc1 8ea7d3138b4e71726ede40363c7e88f7 [0,1,0,0,1,0|2,0,0]=4 5920 B11R1.4 OCCNCCn1cccn1 29d92519902a2b424c0c9a778677112c [0,1,0,0,1,0|2,0,0]=4 5921 B11R1.4 OCNCCCc1c[nH]cn1 c43622a38316abb5398debd7be93d47b [0,1,0,0,1,0|2,0,0]=4 5922 B11R1.4 OCNCCCc1ccco1 b43418c58856cd447aaa0d9db254c5c2 [0,1,0,0,1,0|2,0,0]=4 5923 B11R1.4 OCNCCCc1cccs1 0857ed8cccc5342bb41a90b070bf8865 [0,1,0,0,1,0|2,0,0]=4 5924 B11R1.4 OCNCCCc1ncc[nH]1 d9dca8686e9dc7c65105186631380fe4 [0,1,0,0,1,0|2,0,0]=4 5925 B11R1.4 OCNCCCn1cccc1 aae093ab0373e006422d97710e0593c9 [0,1,0,0,1,0|2,0,0]=4 5926 B11R1.4 OCNCCCn1cccn1 75656f057ef0ffb2ab4216b8e6cebfc5 [0,1,0,0,1,0|2,0,0]=4 5927 B11R1.4 SCCCCNc1cc[nH]n1 e53d8fe3826583e2e301653f952191a2 [0,1,0,0,1,0|2,0,0]=4 5928 B11R1.4 SCCCCNc1ccco1 c4ffbf8523f3562a735e40e5b446c17e [0,1,0,0,1,0|2,0,0]=4 5929 B11R1.4 SCCCCNc1cccs1 daef65ab797c6bc3af78012f35919db1 [0,1,0,0,1,0|2,0,0]=4 5930 B11R1.4 SCCCCNc1ccoc1 494470c53d8ee9c5709ac4ca04ab3233 [0,1,0,0,1,0|2,0,0]=4 5931 B11R1.4 SCCCCNc1ccon1 1c290646363f1cbdc160760c12d0c3d9 [0,1,0,0,1,0|2,0,0]=4 5932 B11R1.4 SCCCCNc1ccsc1 bd62732610fcbeedf2443069e3c75c28 [0,1,0,0,1,0|2,0,0]=4 5933 B11R1.4 SCCCCNc1ccsn1 107721a1431867025cf72bac427eed6f [0,1,0,0,1,0|2,0,0]=4 5934 B11R1.4 SCCCCNc1cocn1 debb5200b41daf47d8cee403cfe2e50b [0,1,0,0,1,0|2,0,0]=4 5935 B11R1.4 SCCCCNc1cscn1 0de6d4b675fb9bf8f47b275b28362d2e [0,1,0,0,1,0|2,0,0]=4 5936 B11R1.4 SCCCCNc1ncco1 9fd1e2bdc2e697f025405192aeabaacd [0,1,0,0,1,0|2,0,0]=4 5937 B11R1.4 SCCCCNc1nccs1 a4618ba02258479e12a242baa560ef22 [0,1,0,0,1,0|2,0,0]=4 5938 B11R1.4 SCCCNCc1cc[nH]c1 7ddc362ce03dacd6e46839ec1f8f2c49 [0,1,0,0,1,0|2,0,0]=4 5939 B11R1.4 SCCCNCc1ccc[nH]1 db518c23fc2fe970606f6e2a295c6d40 [0,1,0,0,1,0|1,0,1]=4 5940 B11R1.4 SCCCNCc1ccco1 937f34ea36e72a87839f4cf926474e38 [0,1,0,0,1,0|2,0,0]=4 5941 B11R1.4 SCCCNCc1cccs1 495f2d4adf50cca9e9dafa1b06af711f [0,1,0,0,1,0|2,0,0]=4 5942 B11R1.4 SCCCNCc1ccoc1 c4e2dea12f827e7f17147b83e6fa0c1d [0,1,0,0,1,0|2,0,0]=4 5943 B11R1.4 SCCCNCc1ccon1 c97140f23c4f399bc94cc9093c5c5c98 [0,1,0,0,1,0|2,0,0]=4 5944 B11R1.4 SCCCNCc1ccsc1 b9e087670d631fa065603032f6a81957 [0,1,0,0,1,0|2,0,0]=4 5945 B11R1.4 SCCCNCc1ccsn1 3c5e52b8ca8e84b02bcc7d149a5c7062 [0,1,0,0,1,0|2,0,0]=4 5946 B11R1.4 SCCCNCc1cocn1 66dd223dbc2a1504e7418101cfc8f2ed [0,1,0,0,1,0|2,0,0]=4 5947 B11R1.4 SCCCNCc1cscn1 23c5f9674ca9454725994683d16d7906 [0,1,0,0,1,0|2,0,0]=4 5948 B11R1.4 SCCCNCc1ncc[nH]1 5999540cc28f7e44251dc20b288f5a0b [0,1,0,0,1,0|2,0,0]=4 5949 B11R1.4 SCCCNCc1ncco1 9642ab905f20baddf0989bc88b060557 [0,1,0,0,1,0|2,0,0]=4 5950 B11R1.4 SCCCNCc1nccs1 89270b5573d3574f5c57e7f45eb97883 [0,1,0,0,1,0|2,0,0]=4 5951 B11R1.4 SCCCOCc1cc[nH]c1 98170f61c76b016abb7d5f43c6126d8d [0,1,0,0,1,0|2,0,0]=4 5952 B11R1.4 SCCCOCc1ccc[nH]1 09bdd1fba039201b91cf35bce9c67285 [0,1,0,0,1,0|1,0,1]=4 5953 B11R1.4 SCCCOCc1ccco1 0907f515a46060017fc310df122362dd [0,1,0,0,1,0|2,0,0]=4 5954 B11R1.4 SCCCOCc1cccs1 affcb7469d43df8d28416eea8f1f777d [0,1,0,0,1,0|2,0,0]=4 5955 B11R1.4 SCCCOCc1ccoc1 6fa7c6662ec9123ef0150c1436bf84e6 [0,1,0,0,1,0|2,0,0]=4 5956 B11R1.4 SCCCOCc1ccon1 deff82aca0272efd5422b57b5029ffd4 [0,1,0,0,1,0|2,0,0]=4 5957 B11R1.4 SCCCOCc1ccsc1 27409bb04c3340abc05d647c61a5bb27 [0,1,0,0,1,0|2,0,0]=4 5958 B11R1.4 SCCCOCc1ccsn1 d56ea962e5cb377abf32b84486e9ed06 [0,1,0,0,1,0|2,0,0]=4 5959 B11R1.4 SCCCOCc1cocn1 49ccc24ea3de7afbf6b2c13c06874474 [0,1,0,0,1,0|2,0,0]=4 5960 B11R1.4 SCCCOCc1cscn1 7878e08b72090f1ae364b0ad2e4ca7dd [0,1,0,0,1,0|2,0,0]=4 5961 B11R1.4 SCCCOCc1ncc[nH]1 09e52aa3345af524735d4deaa8fb08b8 [0,1,0,0,1,0|2,0,0]=4 5962 B11R1.4 SCCCOCc1ncco1 20f9da36c9503ac471d889969399ffef [0,1,0,0,1,0|2,0,0]=4 5963 B11R1.4 SCCCOCc1nccs1 2917353ed9c123e4e747e26d903d43c8 [0,1,0,0,1,0|2,0,0]=4 5964 B11R1.4 SCCCOCn1cccn1 0c8c6d752821785dc6212d899c4f751c [0,1,0,0,1,0|2,0,0]=4 5965 B11R1.4 SCCNCCc1c[nH]cn1 6ebfd1982a2e6ceb7ca49d458cf68d88 [0,1,0,0,1,0|2,0,0]=4 5966 B11R1.4 SCCNCCc1cc[nH]n1 c9ec74b2738f9724806f316b128368a3 [0,1,0,0,1,0|2,0,0]=4 5967 B11R1.4 SCCNCCc1ccc[nH]1 98e6c19d012ec7894b28fd2c81ef1897 [0,1,0,0,1,0|1,0,1]=4 5968 B11R1.4 SCCNCCc1ccco1 a35ba048862c20b3a475eaf580131d98 [0,1,0,0,1,0|2,0,0]=4 5969 B11R1.4 SCCNCCc1cccs1 30cc78b40d826f2d5f136907e3314f1d [0,1,0,0,1,0|2,0,0]=4 5970 B11R1.4 SCCNCCc1ccsc1 1bc5fe907cb8887ead961e1960594c7b [0,1,0,0,1,0|2,0,0]=4 5971 B11R1.4 SCCNCCc1cscn1 6924c314bd6a8f410e7781f72515b2ee [0,1,0,0,1,0|2,0,0]=4 5972 B11R1.4 SCCNCCc1ncc[nH]1 e25ee32e7ad0b839e5ac5b6143735bd8 [0,1,0,0,1,0|2,0,0]=4 5973 B11R1.4 SCCNCCc1nccs1 706401275004aa5133abb96ebee0629a [0,1,0,0,1,0|2,0,0]=4 5974 B11R1.4 SCCNCCn1cccc1 cebff623b8073cb775afcbb1f13f6da6 [0,1,0,0,1,0|2,0,0]=4 5975 B11R1.4 SCCNCCn1cccn1 f12b25388bdc3f4332e0f23adeb02168 [0,1,0,0,1,0|2,0,0]=4 5976 B11R1.4 SCCOCCc1c[nH]cn1 4acdc1eec2a35737728987391ce73925 [0,1,0,0,1,0|2,0,0]=4 5977 B11R1.4 SCCOCCc1cc[nH]n1 6af8728480f5f215a9ddb34ea0838820 [0,1,0,0,1,0|2,0,0]=4 5978 B11R1.4 SCCOCCc1ccc[nH]1 4b915ad309b2bfa3eb4764d16096ce86 [0,1,0,0,1,0|1,0,1]=4 5979 B11R1.4 SCCOCCc1ccco1 0771d63b2ff8d578850944dff45c7085 [0,1,0,0,1,0|2,0,0]=4 5980 B11R1.4 SCCOCCc1cccs1 f54d920cf3ba83542b89933d4862af2b [0,1,0,0,1,0|2,0,0]=4 5981 B11R1.4 SCCOCCc1ccoc1 69d2912519fcf54fad8da34c2819e5bd [0,1,0,0,1,0|2,0,0]=4 5982 B11R1.4 SCCOCCc1ccon1 1b3558b5f69c370ad9403d96a2556bb5 [0,1,0,0,1,0|2,0,0]=4 5983 B11R1.4 SCCOCCc1ccsc1 3df72841d238242b7b23680e4f40e0d7 [0,1,0,0,1,0|2,0,0]=4 5984 B11R1.4 SCCOCCc1cscn1 a80c0d699e4a54b47618fa1817f90870 [0,1,0,0,1,0|2,0,0]=4 5985 B11R1.4 SCCOCCc1ncc[nH]1 abb3f0f217c7b2cbd097e749b3fa03eb [0,1,0,0,1,0|2,0,0]=4 5986 B11R1.4 SCCOCCc1nccs1 55273865c8eeaa7430e944630ae5cbf5 [0,1,0,0,1,0|2,0,0]=4 5987 B11R1.4 SCCOCCn1cccc1 9d550e84224d7f3ccb77c9c0139feaf7 [0,1,0,0,1,0|2,0,0]=4 5988 B11R1.4 SCCOCCn1cccn1 0967cd597841c7c8b3f44024e74e2d6b [0,1,0,0,1,0|2,0,0]=4 5989 B11R1.25 CCC(C)CNc1c[nH]cn1 feacb1dd138e77387faebefd1836e096 [0,1,0,0,1,0|2,0,0]=4 5990 B11R1.25 CCC(C)CNc1cc[nH]n1 9062e94d03b5995899fb54d4af7cd72e [0,1,0,0,1,0|2,0,0]=4 5991 B11R1.25 CCC(C)CNc1cccs1 719002605602d496bf65e7aa6778850d [0,1,0,0,1,0|2,0,0]=4 5992 B11R1.25 CCC(C)CNc1ccoc1 b996204742a27f41a0bc070ef3e80806 [0,1,0,0,1,0|2,0,0]=4 5993 B11R1.25 CCC(C)CNc1ccon1 5c8a42d1795a33ce2f986ff000ec8d28 [0,1,0,0,1,0|2,0,0]=4 5994 B11R1.25 CCC(C)CNc1ccsc1 176cfb6d9ab57fcee60bce4f05fbefa6 [0,1,0,0,1,0|2,0,0]=4 5995 B11R1.25 CCC(C)CNc1cocn1 e4e4c893c6773d08c2ec28f0f01f2669 [0,1,0,0,1,0|2,0,0]=4 5996 B11R1.25 CCC(C)CNc1cscn1 71da227adf0a473bb6fc55520ac1f382 [0,1,0,0,1,0|2,0,0]=4 5997 B11R1.25 CCC(C)CNc1ncc[nH]1 7ab47af6d52f0f81f7ea4bf98538d712 [0,1,0,0,1,0|2,0,0]=4 5998 B11R1.25 CCC(C)CNc1ncco1 9bff6017d9e131868149393a9636320f [0,1,0,0,1,0|2,0,0]=4 5999 B11R1.25 CCC(C)CNc1nccs1 9a650a0be5c9d2f1d733cccfe8b54c36 [0,1,0,0,1,0|2,0,0]=4 6000 B11R1.25 CCC(C)COc1c[nH]cn1 81c421f75b24b87e7698071fa13440c5 [0,1,0,0,1,0|2,0,0]=4 6001 B11R1.25 CCC(C)COc1ccco1 82daf9b75022db52f0e1a8a1ed2263d3 [0,1,0,0,1,0|2,0,0]=4 6002 B11R1.25 CCC(C)COc1cccs1 22937857e8dff98d6437b2766e53db72 [0,1,0,0,1,0|2,0,0]=4 6003 B11R1.25 CCC(C)COc1ccsc1 82d359e1e92307ccc24b4631dd89326e [0,1,0,0,1,0|2,0,0]=4 6004 B11R1.25 CCC(C)COc1nccs1 534a5123408a807e859f19cf7b5354b2 [0,1,0,0,1,0|2,0,0]=4 6005 B11R1.25 CCC(C)COn1cccn1 becf077d791e2cc0aeedace549fcea7b [0,1,0,0,1,0|2,0,0]=4 6006 B11R1.25 CCC(C)NCc1cc[nH]c1 9ef07b394785f8d116e3feed59914c1f [0,1,0,0,1,0|2,0,0]=4 6007 B11R1.25 CCC(C)NCc1ccc[nH]1 dfe1641eb23b0efdceb0290726a654e3 [0,1,0,0,1,0|1,0,1]=4 6008 B11R1.25 CCC(C)NCc1ccco1 5f8142dfde0b789474d1611a11bd8a03 [0,1,0,0,1,0|2,0,0]=4 6009 B11R1.25 CCC(C)NCc1cccs1 f4bcf10ac56668adcfee83149ad55330 [0,1,0,0,1,0|2,0,0]=4 6010 B11R1.25 CCC(C)NCc1ccoc1 8c02b655539c9007d5e8f97ef5952ea6 [0,1,0,0,1,0|2,0,0]=4 6011 B11R1.25 CCC(C)NCc1ccon1 f0ba1b7fec8685c635a1841aa831e5bf [0,1,0,0,1,0|2,0,0]=4 6012 B11R1.25 CCC(C)NCc1ccsc1 071312636f13f6094e29f49c4b6d97b8 [0,1,0,0,1,0|2,0,0]=4 6013 B11R1.25 CCC(C)NCc1ccsn1 1bd61f6799ec35faa528b337bf63363f [0,1,0,0,1,0|2,0,0]=4 6014 B11R1.25 CCC(C)NCc1cocn1 95653cfc38046df4c595d9332be3f888 [0,1,0,0,1,0|2,0,0]=4 6015 B11R1.25 CCC(C)NCc1cscn1 3f36e14eb8acb2a3868067189729c57a [0,1,0,0,1,0|2,0,0]=4 6016 B11R1.25 CCC(C)NCc1ncc[nH]1 231b7801e3e25e1e656d75e8148ead7a [0,1,0,0,1,0|2,0,0]=4 6017 B11R1.25 CCC(C)NCc1ncco1 b2a3e5f302e72b4baaa7fa833eb43a6d [0,1,0,0,1,0|2,0,0]=4 6018 B11R1.25 CCC(C)NCc1nccs1 f1806a38612384d531431fbb92493421 [0,1,0,0,1,0|2,0,0]=4 6019 B11R1.25 CCC(C)OCc1cc[nH]c1 8f3f6052fcdb822b3d965a714d3b9aad [0,1,0,0,1,0|2,0,0]=4 6020 B11R1.25 CCC(C)OCc1ccc[nH]1 9704405f8dd480f3861820e81be98d46 [0,1,0,0,1,0|1,0,1]=4 6021 B11R1.25 CCC(C)OCc1ccco1 1d3865e51cab5c0be5992c253ab61007 [0,1,0,0,1,0|2,0,0]=4 6022 B11R1.25 CCC(C)OCc1cccs1 ed5b0e54c3ce9b4fbd0e1c89d3109802 [0,1,0,0,1,0|2,0,0]=4 6023 B11R1.25 CCC(C)OCc1ccon1 32a6519a8830b341843518eb0942c06a [0,1,0,0,1,0|2,0,0]=4 6024 B11R1.25 CCC(C)OCc1ccsc1 9f2e6bf6ffce700beda1cd6b46d3b590 [0,1,0,0,1,0|2,0,0]=4 6025 B11R1.25 CCC(C)OCc1ccsn1 325fa044018c01cd3b301301402dcb69 [0,1,0,0,1,0|2,0,0]=4 6026 B11R1.25 CCC(C)OCc1cocn1 76d0ce33b3982f6b55613b2bad799bba [0,1,0,0,1,0|2,0,0]=4 6027 B11R1.25 CCC(C)OCc1cscn1 0614ad1eb89bf66a4d97c59a7d0987f1 [0,1,0,0,1,0|2,0,0]=4 6028 B11R1.25 CCC(C)OCc1ncc[nH]1 39447ce50b3391ec5951144939042b20 [0,1,0,0,1,0|2,0,0]=4 6029 B11R1.25 CCC(C)OCc1ncco1 904158ce6bcd0097d4f0ca8fee5a984d [0,1,0,0,1,0|2,0,0]=4 6030 B11R1.25 CCC(C)OCc1nccs1 d5b27e792ce284504f9f4dced85178ec [0,1,0,0,1,0|2,0,0]=4 6031 B11R1.25 CCC(C)OCn1cccn1 e9eef6f41ed2720c01b6aaec2fb015b0 [0,1,0,0,1,0|2,0,0]=4 6032 B11R1.25 CCC(O)CNc1c[nH]cn1 352f239535f2fa9e21fefff4fbb1d58d [0,1,0,0,1,0|2,0,0]=4 6033 B11R1.25 CCC(O)CNc1cc[nH]n1 8305884153ff2eeb09ff583c1527d22e [0,1,0,0,1,0|2,0,0]=4 6034 B11R1.25 CCC(O)CNc1ccoc1 af3de1eebca676b63539dc0f61addb24 [0,1,0,0,1,0|2,0,0]=4 6035 B11R1.25 CCC(O)CNc1ccon1 7f062967dc6c838e1b2296c75ebd2e6a [0,1,0,0,1,0|2,0,0]=4 6036 B11R1.25 CCC(O)CNc1ccsc1 0e260aa3c6da0b07eb63be37c7451a28 [0,1,0,0,1,0|2,0,0]=4 6037 B11R1.25 CCC(O)CNc1cocn1 68daa871b418e04072881a5010c884b1 [0,1,0,0,1,0|2,0,0]=4 6038 B11R1.25 CCC(O)CNc1cscn1 145c0fe33b6ad1db5da4cba5212e335d [0,1,0,0,1,0|2,0,0]=4 6039 B11R1.25 CCC(O)CNc1ncc[nH]1 b5253a0dacb763b45f456b2b904ee950 [0,1,0,0,1,0|2,0,0]=4 6040 B11R1.25 CCC(O)CNc1ncco1 07030d95b264524e26936f7ebb505323 [0,1,0,0,1,0|2,0,0]=4 6041 B11R1.25 CCC(O)CNc1nccs1 19df48c4da5478fe504cd24a1465b4e0 [0,1,0,0,1,0|2,0,0]=4 6042 B11R1.25 CCN(C)CCc1c[nH]cn1 6d06ee2cf4ac187e9996d3f73566a236 [0,1,0,0,1,0|2,0,0]=4 6043 B11R1.25 CCN(C)CCc1cccs1 ba1df1d99619458f39bdb79d38c399fb [0,1,0,0,1,0|2,0,0]=4 6044 B11R1.25 CCN(C)CCc1ccsc1 51f474b26424a145f9d9f689b0c20889 [0,1,0,0,1,0|2,0,0]=4 6045 B11R1.25 CCN(C)CCc1cscn1 76be0f92bc1b84a0ed347bab3fa7389a [0,1,0,0,1,0|2,0,0]=4 6046 B11R1.25 CCN(C)CCn1cccc1 982a42fb95ee405d75fe829544f4fb09 [0,1,0,0,1,0|2,0,0]=4 6047 B11R1.25 CCN(C)CCn1cccn1 b8bfc7d6528e28001c46007c21090465 [0,1,0,0,1,0|2,0,0]=4 6048 B11R1.25 CC[C@@H](C)CNc1cc[nH]n1 a9f5d93cfb14e450b281e019b27981e6 [0,1,0,0,1,0|2,0,0]=4 6049 B11R1.25 CC[C@@H](C)CNc1cccs1 f88bb69c6e9f83a12f594a06fdf66307 [0,1,0,0,1,0|2,0,0]=4 6050 B11R1.25 CC[C@@H](C)CNc1ccon1 63c3c0769c080dc40442f672775021d1 [0,1,0,0,1,0|2,0,0]=4 6051 B11R1.25 CC[C@@H](C)CNc1ccsc1 2c95cc70794e9023b5847e17c3f69511 [0,1,0,0,1,0|2,0,0]=4 6052 B11R1.25 CC[C@@H](C)CNc1cocn1 53bb98b1c36fe3bbe10b223e69d2e918 [0,1,0,0,1,0|2,0,0]=4 6053 B11R1.25 CC[C@@H](C)CNc1cscn1 238a945bbd462f88863f62f195ae040e [0,1,0,0,1,0|2,0,0]=4 6054 B11R1.25 CC[C@@H](C)CNc1ncc[nH]1 27ddb121146d7a2088e49581d982e416 [0,1,0,0,1,0|2,0,0]=4 6055 B11R1.25 CC[C@@H](C)CNc1ncco1 27405b8857f0fa342cdba4ca8b725aad [0,1,0,0,1,0|2,0,0]=4 6056 B11R1.25 CC[C@@H](C)CNc1nccs1 86e4ed310c9b665501173f790eb317b4 [0,1,0,0,1,0|2,0,0]=4 6057 B11R1.25 CC[C@@H](C)COc1c[nH]cn1 e2fd17a4f003ab36044266e600b814d9 [0,1,0,0,1,0|2,0,0]=4 6058 B11R1.25 CC[C@@H](C)COc1ccco1 fe756872e20a8d4589f7190b98a97cbb [0,1,0,0,1,0|2,0,0]=4 6059 B11R1.25 CC[C@@H](C)COc1cccs1 a8a82373e9b283f8c47ede5693410289 [0,1,0,0,1,0|2,0,0]=4 6060 B11R1.25 CC[C@@H](C)COc1ccsc1 941a6702b3917cd622c8b2f6d24bd6ce [0,1,0,0,1,0|2,0,0]=4 6061 B11R1.25 CC[C@@H](C)COc1nccs1 0f0cba1ec56fc9fe075c3ad4382f1654 [0,1,0,0,1,0|2,0,0]=4 6062 B11R1.25 CC[C@@H](C)COn1cccn1 5f8dd20ec4ef613bf9aad4e16a58dbe2 [0,1,0,0,1,0|2,0,0]=4 6063 B11R1.25 CC[C@@H](C)NCc1cccs1 176e8bf973939cacbab0c9f61c945a33 [0,1,0,0,1,0|2,0,0]=4 6064 B11R1.25 CC[C@@H](C)NCc1ccon1 7c194756c2d4b22893e5255ce3ae51df [0,1,0,0,1,0|2,0,0]=4 6065 B11R1.25 CC[C@@H](C)NCc1ccsc1 23e937cab11f6f1e01ec241e5cabd389 [0,1,0,0,1,0|2,0,0]=4 6066 B11R1.25 CC[C@@H](C)NCc1cocn1 4d1e2f4a41b28f69f764c2b35178e560 [0,1,0,0,1,0|2,0,0]=4 6067 B11R1.25 CC[C@@H](C)NCc1cscn1 bc8ebedea57c41ec98f92548173bf5a6 [0,1,0,0,1,0|2,0,0]=4 6068 B11R1.25 CC[C@@H](C)NCc1ncc[nH]1 40dfb055566880d8936bdd2397f2510d [0,1,0,0,1,0|2,0,0]=4 6069 B11R1.25 CC[C@@H](C)NCc1ncco1 bf3cc43e5d4513b5b816d55d67b8664e [0,1,0,0,1,0|2,0,0]=4 6070 B11R1.25 CC[C@@H](C)NCc1nccs1 3696c22674463bf4a1fc394b63b8e0e2 [0,1,0,0,1,0|2,0,0]=4 6071 B11R1.25 CC[C@@H](C)OCc1ccco1 a76b1dfd367e870139dad05cc969c789 [0,1,0,0,1,0|2,0,0]=4 6072 B11R1.25 CC[C@@H](C)OCc1cccs1 3647e5c786191fbccae15396ed3cbc17 [0,1,0,0,1,0|2,0,0]=4 6073 B11R1.25 CC[C@@H](C)OCc1ccon1 f479e4939879d806b3bee6c276beeac7 [0,1,0,0,1,0|2,0,0]=4 6074 B11R1.25 CC[C@@H](C)OCc1ccsc1 87d13b0324c22f47d422c68cae09d978 [0,1,0,0,1,0|2,0,0]=4 6075 B11R1.25 CC[C@@H](C)OCc1cocn1 a3334214bcbdbcee0a28a0043a3b6704 [0,1,0,0,1,0|2,0,0]=4 6076 B11R1.25 CC[C@@H](C)OCc1cscn1 79ca41c10e3826388b2ad4e16031242f [0,1,0,0,1,0|2,0,0]=4 6077 B11R1.25 CC[C@@H](C)OCc1ncc[nH]1 f832afe3d0883dca96404e072f71257c [0,1,0,0,1,0|2,0,0]=4 6078 B11R1.25 CC[C@@H](C)OCc1ncco1 a31617493743d569d00eac329d66c5a7 [0,1,0,0,1,0|2,0,0]=4 6079 B11R1.25 CC[C@@H](C)OCc1nccs1 b635d6b73497b300b93deccd1879dff5 [0,1,0,0,1,0|2,0,0]=4 6080 B11R1.25 CC[C@@H](O)CNc1c[nH]cn1 882c08a9289b2aae2b5b9dea4365d242 [0,1,0,0,1,0|2,0,0]=4 6081 B11R1.25 CC[C@@H](O)CNc1ccoc1 adb57c64716ed05698c95128eb081729 [0,1,0,0,1,0|2,0,0]=4 6082 B11R1.25 CC[C@@H](O)CNc1ncco1 2eb07283e2f4550a6a54c236f764da8a [0,1,0,0,1,0|2,0,0]=4 6083 B11R1.25 CC[C@@H](O)CNc1nccs1 363bddd81469c5defd006f53566f7e9f [0,1,0,0,1,0|2,0,0]=4 6084 B11R1.25 CC[C@H](C)CNc1c[nH]cn1 31504ffae08635387f8f401604ae2d55 [0,1,0,0,1,0|2,0,0]=4 6085 B11R1.25 CC[C@H](C)CNc1cc[nH]n1 d873a488e23bccccff27bcb9ed632ee0 [0,1,0,0,1,0|2,0,0]=4 6086 B11R1.25 CC[C@H](C)CNc1cccs1 528b0369c1a80c82b116b99478794ea0 [0,1,0,0,1,0|2,0,0]=4 6087 B11R1.25 CC[C@H](C)CNc1ccoc1 04df10668397f8172e021865054bc0ae [0,1,0,0,1,0|2,0,0]=4 6088 B11R1.25 CC[C@H](C)CNc1ccon1 036d5e1fae4813e9f7cac2413ed8ab57 [0,1,0,0,1,0|2,0,0]=4 6089 B11R1.25 CC[C@H](C)CNc1ccsc1 2bfb920422c2c6f65065cff1d4c7c403 [0,1,0,0,1,0|2,0,0]=4 6090 B11R1.25 CC[C@H](C)CNc1cocn1 8a1e1363b618ac7ecb6acd6a9f3b3679 [0,1,0,0,1,0|2,0,0]=4 6091 B11R1.25 CC[C@H](C)CNc1cscn1 46938cc590189f82a7ae3b9488b01b4d [0,1,0,0,1,0|2,0,0]=4 6092 B11R1.25 CC[C@H](C)CNc1ncc[nH]1 0441c54ca5c0f34b78fee0ce00a40db6 [0,1,0,0,1,0|2,0,0]=4 6093 B11R1.25 CC[C@H](C)CNc1ncco1 d706acc2b66dd572d8d748bd2230e850 [0,1,0,0,1,0|2,0,0]=4 6094 B11R1.25 CC[C@H](C)CNc1nccs1 5999010e82803f13c7c51e869e43576e [0,1,0,0,1,0|2,0,0]=4 6095 B11R1.25 CC[C@H](C)COc1c[nH]cn1 af1b05be2d0b3b21c6ae7f26b601ccc6 [0,1,0,0,1,0|2,0,0]=4 6096 B11R1.25 CC[C@H](C)COc1ccco1 350557fd898c2c60bb4ffc046ace81ec [0,1,0,0,1,0|2,0,0]=4 6097 B11R1.25 CC[C@H](C)COc1cccs1 a1cf12afbd0571b4289f48578ecfad7c [0,1,0,0,1,0|2,0,0]=4 6098 B11R1.25 CC[C@H](C)COc1ccsc1 08e6848fcfd20daf08ae271ed6df09f0 [0,1,0,0,1,0|2,0,0]=4 6099 B11R1.25 CC[C@H](C)COc1nccs1 4351045ddfb572a1de0480c3f9f67325 [0,1,0,0,1,0|2,0,0]=4 6100 B11R1.25 CC[C@H](C)COn1cccn1 c43f2f602d3a4388eb0c5131ed766d1b [0,1,0,0,1,0|2,0,0]=4 6101 B11R1.25 CC[C@H](C)NCc1cccs1 cc8e2cf48d22633247d559ee5b10c832 [0,1,0,0,1,0|2,0,0]=4 6102 B11R1.25 CC[C@H](C)NCc1ccon1 01da349bff64e08285e9934d70833776 [0,1,0,0,1,0|2,0,0]=4 6103 B11R1.25 CC[C@H](C)NCc1ccsc1 6a0a804c53358ae48257d4de0aa8174d [0,1,0,0,1,0|2,0,0]=4 6104 B11R1.25 CC[C@H](C)NCc1cocn1 3d6dea379e0d08202473245169db556d [0,1,0,0,1,0|2,0,0]=4 6105 B11R1.25 CC[C@H](C)NCc1cscn1 7c1ff44812c2b9f5f2e5b8a18da39124 [0,1,0,0,1,0|2,0,0]=4 6106 B11R1.25 CC[C@H](C)NCc1ncc[nH]1 e63d9b904ec8dfb1fe1ce445c10d7a2d [0,1,0,0,1,0|2,0,0]=4 6107 B11R1.25 CC[C@H](C)NCc1ncco1 5fac855b5b0c1bc33b4cf33f54d7dc74 [0,1,0,0,1,0|2,0,0]=4 6108 B11R1.25 CC[C@H](C)NCc1nccs1 8f56052b04c82fa642a57b186989db05 [0,1,0,0,1,0|2,0,0]=4 6109 B11R1.25 CC[C@H](C)OCc1ccco1 f9cdf73fec17b5adbe5d6d95690f8ec6 [0,1,0,0,1,0|2,0,0]=4 6110 B11R1.25 CC[C@H](C)OCc1cccs1 bd45cdf2dba9c6543a04d66b2d5ac835 [0,1,0,0,1,0|2,0,0]=4 6111 B11R1.25 CC[C@H](C)OCc1ccon1 fc6bd14a0bc3040ebe193daf0a42265e [0,1,0,0,1,0|2,0,0]=4 6112 B11R1.25 CC[C@H](C)OCc1ccsc1 eece2c50364b12157d82dbdea6704f0f [0,1,0,0,1,0|2,0,0]=4 6113 B11R1.25 CC[C@H](C)OCc1cocn1 4083c839d7e4833247919dcbade8b4ec [0,1,0,0,1,0|2,0,0]=4 6114 B11R1.25 CC[C@H](C)OCc1cscn1 c0b1bb4c83484cc13917e4eaf88a9c45 [0,1,0,0,1,0|2,0,0]=4 6115 B11R1.25 CC[C@H](C)OCc1ncc[nH]1 82ac3bb5d59644b7594b30e475cb48e3 [0,1,0,0,1,0|2,0,0]=4 6116 B11R1.25 CC[C@H](C)OCc1ncco1 48bd22762b919f6018f53ef0d0fd1aa4 [0,1,0,0,1,0|2,0,0]=4 6117 B11R1.25 CC[C@H](C)OCc1nccs1 61b9f5f48e5d78c76237e2a5cbc8d384 [0,1,0,0,1,0|2,0,0]=4 6118 B11R1.27 CCCCNc1c[nH]c(n1)N 7b1326cda86cb3c4940c5e5122c53ff4 [0,1,0,0,1,0|2,0,0]=4 6119 B11R1.27 CCCCNc1cc([nH]n1)Br b72b60b286ab49dffc279cb773c4e5a3 [0,1,0,0,1,0|2,0,0]=4 6120 B11R1.27 CCCCNc1cc([nH]n1)C aa70ef9113b507cbbc9a3fd46b159002 [0,1,0,0,1,0|2,0,0]=4 6121 B11R1.27 CCCCNc1cc([nH]n1)F 0d4eec37a46f8c57a33f3c7b7cdfe68c [0,1,0,0,1,0|2,0,0]=4 6122 B11R1.27 CCCCNc1cc(on1)C bb2a1519a361d1f0c867f93d83c67ac8 [0,1,0,0,1,0|2,0,0]=4 6123 B11R1.27 CCCCNc1cc(sn1)Br c84e7e52f2764aa9a7c29e12ad3b2ec7 [0,1,0,0,1,0|2,0,0]=4 6124 B11R1.27 CCCCNc1ccc(o1)C 54a31b1b1db1c0b2c103168592fd1e58 [0,1,0,0,1,0|2,0,0]=4 6125 B11R1.27 CCCCNc1ccc(s1)Br 95cec4bfbe1aa504e7bf64f6d4666be9 [0,1,0,0,1,0|2,0,0]=4 6126 B11R1.27 CCCCNc1ccc(s1)C 9a43ce195f1ee434010c1ff36b1221dd [0,1,0,0,1,0|2,0,0]=4 6127 B11R1.27 CCCCNc1ccc(s1)F 5f453420ca21f6fd205c4f45e4439869 [0,1,0,0,1,0|2,0,0]=4 6128 B11R1.27 CCCCNc1ccn(n1)C b907b80bf21e6b827c93080f2df21f34 [0,1,0,0,1,0|2,0,0]=4 6129 B11R1.27 CCCCNc1cn(cn1)C 418d2f43dc8f89e14ee9023a451c0d1c [0,1,0,0,1,0|2,0,0]=4 6130 B11R1.27 CCCCNc1coc(n1)N 09426f7c81841e4b890222aa89a483b8 [0,1,0,0,1,0|2,0,0]=4 6131 B11R1.27 CCCCNc1csc(n1)Br 44f388c45c4c364d6ab31f6587051e9b [0,1,0,0,1,0|2,0,0]=4 6132 B11R1.27 CCCCNc1csc(n1)N 5b7f6c2abae8e9568519e761bf26719a [0,1,0,0,1,0|2,0,0]=4 6133 B11R1.27 CCCCNc1nc(c[nH]1)Br 27ae17f52fcffb2c9a9c9da0eec7b80c [0,1,0,0,1,0|2,0,0]=4 6134 B11R1.27 CCCCNc1nc(co1)Br cfca28ac6e9e9262d6c23fd0e0d3a9c2 [0,1,0,0,1,0|2,0,0]=4 6135 B11R1.27 CCCCNc1nc(co1)C e20aedaf9810db8cd099cb2efd9f1c7f [0,1,0,0,1,0|2,0,0]=4 6136 B11R1.27 CCCCNc1nc(cs1)Br 817e0d4eb9bf021ce91ac66380380c8d [0,1,0,0,1,0|2,0,0]=4 6137 B11R1.27 CCCCNc1nc(cs1)C 087f0c3344ca8602a3013f1fb8b6b35d [0,1,0,0,1,0|2,0,0]=4 6138 B11R1.27 CCCCNc1nc(cs1)Cl 174d01359bbdd47447f7dbfffe6a3fdb [0,1,0,0,1,0|2,0,0]=4 6139 B11R1.27 CCCCNc1ncc([nH]1)C 208da2a38c63b3958dba9e7e7a56845c [0,1,0,0,1,0|2,0,0]=4 6140 B11R1.27 CCCCNc1ncc(o1)C 738dc8ef97abdc62d7575db3055ea12b [0,1,0,0,1,0|2,0,0]=4 6141 B11R1.27 CCCCNc1ncc(s1)Br 4f8917a5a66903f2341c6d2ca4baeb40 [0,1,0,0,1,0|2,0,0]=4 6142 B11R1.27 CCCCNc1ncc(s1)C 46fd67c81c15e58397cc580442f78e8c [0,1,0,0,1,0|2,0,0]=4 6143 B11R1.27 CCCCNc1ncc(s1)Cl 0978211b1ab4e0013972f2923e7a9a70 [0,1,0,0,1,0|2,0,0]=4 6144 B11R1.27 CCCCNc1ncc(s1)F a5edcee8a001e01f471a52013d714d2b [0,1,0,0,1,0|2,0,0]=4 6145 B11R1.27 CCCCOc1cc(cs1)C 329233269477c7378803f4cb63e8a0af [0,1,0,0,1,0|2,0,0]=4 6146 B11R1.27 CCCCOc1cc(sn1)Cl 75b7f19610cd5cb2754a41688d1160cf [0,1,0,0,1,0|2,0,0]=4 6147 B11R1.27 CCCCOc1ccc(s1)Br c5d0589b1649f6f62786ee5968bf4d93 [0,1,0,0,1,0|2,0,0]=4 6148 B11R1.27 CCCCOc1ccn(n1)C f5e0c4458ff0e8fa12749069508272d8 [0,1,0,0,1,0|2,0,0]=4 6149 B11R1.27 CCCCOc1nc(cs1)Br 68569594c1d1a2279e6c50b5c5d7ec3f [0,1,0,0,1,0|2,0,0]=4 6150 B11R1.27 CCCCOn1cc(cn1)I 28338e5ed59d0a4453858f7982a4dab3 [0,1,0,0,1,0|2,0,0]=4 6151 B11R1.27 CCCNCc1c[nH]c(n1)C 5b7ffb0f9e26284cdea78ed64462ddea [0,1,0,0,1,0|2,0,0]=4 6152 B11R1.27 CCCNCc1cc(c[nH]1)Br 0287a2fca255e9b081dc66bc5627d5ed [0,1,0,0,1,0|1,0,1]=4 6153 B11R1.27 CCCNCc1cc(co1)C cfa2d3379118e389ad04c13e63b9ec9a [0,1,0,0,1,0|2,0,0]=4 6154 B11R1.27 CCCNCc1cc(cs1)Br 6cda27765e5bec289ad7d2d2b8e4562c [0,1,0,0,1,0|2,0,0]=4 6155 B11R1.27 CCCNCc1cc(cs1)C c18718752381def38e7cc5cdaa829dff [0,1,0,0,1,0|2,0,0]=4 6156 B11R1.27 CCCNCc1cc(cs1)Cl d08f3dc6227e80b8a113c67ebc7acc9b [0,1,0,0,1,0|2,0,0]=4 6157 B11R1.27 CCCNCc1cc(on1)C 04c3f8aa1e38a8364d8495e2ad6712b6 [0,1,0,0,1,0|2,0,0]=4 6158 B11R1.27 CCCNCc1cc(sn1)Br ee2e186587473698d3edfa13e56e529b [0,1,0,0,1,0|2,0,0]=4 6159 B11R1.27 CCCNCc1ccc(o1)Br 304e44400ec5f59c8a510759c73f6f7f [0,1,0,0,1,0|2,0,0]=4 6160 B11R1.27 CCCNCc1ccc(o1)C 62eaddc55a3431ff1bc6049cfb34132d [0,1,0,0,1,0|2,0,0]=4 6161 B11R1.27 CCCNCc1ccc(s1)Br 85a241804764d85738308f23c111a279 [0,1,0,0,1,0|2,0,0]=4 6162 B11R1.27 CCCNCc1ccc(s1)C 6e3cccd615675e59890e2f487e8c8a2f [0,1,0,0,1,0|2,0,0]=4 6163 B11R1.27 CCCNCc1ccc(s1)Cl b6cba9a8e04102638d34fa5333462d53 [0,1,0,0,1,0|2,0,0]=4 6164 B11R1.27 CCCNCc1ccc(s1)F d7ff4eb282f1f2a1e071221bd2297262 [0,1,0,0,1,0|2,0,0]=4 6165 B11R1.27 CCCNCc1ccn(n1)C 4afc42eaed777708f955fb4c8333aabd [0,1,0,0,1,0|2,0,0]=4 6166 B11R1.27 CCCNCc1cn(cn1)C 4dc1ee01e2ddb7708c79196118577e7a [0,1,0,0,1,0|2,0,0]=4 6167 B11R1.27 CCCNCc1coc(n1)C 85c28b540d928c4f3550dd4519a22094 [0,1,0,0,1,0|2,0,0]=4 6168 B11R1.27 CCCNCc1csc(c1)Br dc2000e219887a9eb565b916137fa9ac [0,1,0,0,1,0|2,0,0]=4 6169 B11R1.27 CCCNCc1csc(c1)C 9a64ea93073e56a042d4e4dddb9fd87b [0,1,0,0,1,0|2,0,0]=4 6170 B11R1.27 CCCNCc1csc(c1)Cl 36cd6a2742819879cd2a4414f7eeda29 [0,1,0,0,1,0|2,0,0]=4 6171 B11R1.27 CCCNCc1csc(n1)Br 86c4f749f488eb0d49a336614f421493 [0,1,0,0,1,0|2,0,0]=4 6172 B11R1.27 CCCNCc1csc(n1)C 63bffb9b376ee85f8df76a63be0c25d0 [0,1,0,0,1,0|2,0,0]=4 6173 B11R1.27 CCCNCc1nc(co1)C e807049bb1775eedb0bc4f5f3c9a0686 [0,1,0,0,1,0|2,0,0]=4 6174 B11R1.27 CCCNCc1nc(cs1)Br b1101a3fafc54250af414e838a24c325 [0,1,0,0,1,0|2,0,0]=4 6175 B11R1.27 CCCNCc1nc(cs1)C e951c3aa087ea526641797b53cd90212 [0,1,0,0,1,0|2,0,0]=4 6176 B11R1.27 CCCNCc1nc(cs1)Cl 7a96fb2032d5ac85bc2bef2e6e876dd7 [0,1,0,0,1,0|2,0,0]=4 6177 B11R1.27 CCCNCc1ncc(o1)Br 2b08561914acd53b20564234eab1d84a [0,1,0,0,1,0|2,0,0]=4 6178 B11R1.27 CCCNCc1ncc(o1)C 2fa0f5d239b8f7e43d75fa76dafdab7f [0,1,0,0,1,0|2,0,0]=4 6179 B11R1.27 CCCNCc1ncc(s1)Br 07fd01bc5ff7696f5a436e43b63f8e7a [0,1,0,0,1,0|2,0,0]=4 6180 B11R1.27 CCCNCc1ncc(s1)C 7c1b40c55e4d073e1a0da2c71caa84c8 [0,1,0,0,1,0|2,0,0]=4 6181 B11R1.27 CCCNCc1ncc(s1)Cl da587229c9a1f6ca0e7399e755108c0e [0,1,0,0,1,0|2,0,0]=4 6182 B11R1.27 CCCNCn1cc(cn1)Cl 42f5b4526dceb53e85a1c139967b62e2 [0,1,0,0,1,0|2,0,0]=4 6183 B11R1.27 CCCOCc1c[nH]c(n1)C 9da441ee75a4335824d1ccbd3c3d8fe6 [0,1,0,0,1,0|2,0,0]=4 6184 B11R1.27 CCCOCc1cc(co1)Br bd4978901df827d0d2c777a4f7fe2493 [0,1,0,0,1,0|2,0,0]=4 6185 B11R1.27 CCCOCc1cc(cs1)Br 16e0afc01c2f1cc058f30fd526e05f4e [0,1,0,0,1,0|2,0,0]=4 6186 B11R1.27 CCCOCc1cc(cs1)C 134757468ac818f8e059e65a17835fae [0,1,0,0,1,0|2,0,0]=4 6187 B11R1.27 CCCOCc1cc(cs1)Cl ccc5249690a3228a497f8ca3dd952f91 [0,1,0,0,1,0|2,0,0]=4 6188 B11R1.27 CCCOCc1cc(on1)C 68daf4c3d3a39ed123c6a7add525e734 [0,1,0,0,1,0|2,0,0]=4 6189 B11R1.27 CCCOCc1cc(sn1)Br 858658b9ea2e876c7f580db960acf7b5 [0,1,0,0,1,0|2,0,0]=4 6190 B11R1.27 CCCOCc1cc(sn1)C 17e27507a1ca3aef7130895b1a4161cb [0,1,0,0,1,0|2,0,0]=4 6191 B11R1.27 CCCOCc1ccc(o1)Br ee996c349c568cda2668245671e4e970 [0,1,0,0,1,0|2,0,0]=4 6192 B11R1.27 CCCOCc1ccc(o1)C 44413ee853d5fc7b158361bd02b5f576 [0,1,0,0,1,0|2,0,0]=4 6193 B11R1.27 CCCOCc1ccc(s1)Br 3b0f69564055c930b5aac018b97dcdf1 [0,1,0,0,1,0|2,0,0]=4 6194 B11R1.27 CCCOCc1ccc(s1)C a53515dcde56e3e08c5ba6ce14d09eca [0,1,0,0,1,0|2,0,0]=4 6195 B11R1.27 CCCOCc1ccc(s1)Cl 11f1cc106cc463e4813be7acec53534b [0,1,0,0,1,0|2,0,0]=4 6196 B11R1.27 CCCOCc1ccc(s1)F 6fea5d7627641ed6cfce775416ba17e4 [0,1,0,0,1,0|2,0,0]=4 6197 B11R1.27 CCCOCc1ccn(c1)C 04487c356d6b86329f0e108dac432029 [0,1,0,0,1,0|2,0,0]=4 6198 B11R1.27 CCCOCc1ccn(n1)C 8762ffd80c8160048d0d245af105b24f [0,1,0,0,1,0|2,0,0]=4 6199 B11R1.27 CCCOCc1cn(cn1)C 37ff5f35f41eb4276e294a9c7b990f04 [0,1,0,0,1,0|2,0,0]=4 6200 B11R1.27 CCCOCc1coc(c1)Br 3d4050a756fcb8346ff7f38eca57b798 [0,1,0,0,1,0|2,0,0]=4 6201 B11R1.27 CCCOCc1coc(n1)Br 03f329f696860757b801026f469e217e [0,1,0,0,1,0|2,0,0]=4 6202 B11R1.27 CCCOCc1coc(n1)C 5481de95b91a0ce48ac510e155b0b93d [0,1,0,0,1,0|2,0,0]=4 6203 B11R1.27 CCCOCc1coc(n1)Cl 5108cf324978ef81cbc841bc5e122f76 [0,1,0,0,1,0|2,0,0]=4 6204 B11R1.27 CCCOCc1csc(c1)Br f5598edec0612d47c9ed7f26f47ea87a [0,1,0,0,1,0|2,0,0]=4 6205 B11R1.27 CCCOCc1csc(c1)C 6ed9e15134f28daa9511353c1276449d [0,1,0,0,1,0|2,0,0]=4 6206 B11R1.27 CCCOCc1csc(c1)Cl c3fd261c42f6d50e4c1cea8f4f35dfe3 [0,1,0,0,1,0|2,0,0]=4 6207 B11R1.27 CCCOCc1csc(n1)Br be788f6e8bfe6c2f703f0833073cf3df [0,1,0,0,1,0|2,0,0]=4 6208 B11R1.27 CCCOCc1csc(n1)C c617f24a54e3a89d9e178135919c8334 [0,1,0,0,1,0|2,0,0]=4 6209 B11R1.27 CCCOCc1csc(n1)Cl aa3dc849b4acadb8873f822c4904f62a [0,1,0,0,1,0|2,0,0]=4 6210 B11R1.27 CCCOCc1nc(c[nH]1)C a95ffcaace27d82990835d7e7fe4680c [0,1,0,0,1,0|2,0,0]=4 6211 B11R1.27 CCCOCc1nc(co1)Br 93190c733b63a30690c3e8413a1040e3 [0,1,0,0,1,0|2,0,0]=4 6212 B11R1.27 CCCOCc1nc(cs1)Br e7d700b536d67b9fc053f969a4c2df43 [0,1,0,0,1,0|2,0,0]=4 6213 B11R1.27 CCCOCc1nc(cs1)C 5773f2d3c893b73e6b270577cebb835d [0,1,0,0,1,0|2,0,0]=4 6214 B11R1.27 CCCOCc1ncc(o1)Br 9aac6ef0873b0884087f4e4f9afd83aa [0,1,0,0,1,0|2,0,0]=4 6215 B11R1.27 CCCOCc1ncc(o1)C d377400034e4f0b61e9eea1ac3d7a3d9 [0,1,0,0,1,0|2,0,0]=4 6216 B11R1.27 CCCOCc1ncc(s1)Br 067ce8396fd38bff3ca1a4ca5c3983be [0,1,0,0,1,0|2,0,0]=4 6217 B11R1.27 CCCOCc1ncc(s1)C 7faed5ba87616087c263ab8c278a4262 [0,1,0,0,1,0|2,0,0]=4 6218 B11R1.27 CCCOCc1ncc(s1)Cl 18db5daf71f7a5c21d2e012d98b020db [0,1,0,0,1,0|2,0,0]=4 6219 B11R1.27 CCCOCn1cc(cn1)Br 086bbe8e8fd8a69402ac3897f37522c4 [0,1,0,0,1,0|2,0,0]=4 6220 B11R1.27 CCCOCn1cc(cn1)Cl e7c4f3c32a071b24aec798ff7f724278 [0,1,0,0,1,0|2,0,0]=4 6221 B11R1.27 CCCOCn1ccc(n1)Br ecafd3101e65aca6e7126293dee492a1 [0,1,0,0,1,0|2,0,0]=4 6222 B11R1.27 CCCOCn1ccc(n1)I 784d917820fefb68860202f94b0a9699 [0,1,0,0,1,0|2,0,0]=4 6223 B11R1.27 CCNCCc1cc([nH]n1)C 8d3c1aae53b77552999fc62aac828a85 [0,1,0,0,1,0|2,0,0]=4 6224 B11R1.27 CCNCCc1ccc(o1)C 970942009447c5bc88a3bda9d5d6e2a8 [0,1,0,0,1,0|2,0,0]=4 6225 B11R1.27 CCNCCc1ccc(s1)Br 9d5dce4e1dc369af8507ab38fb5850c2 [0,1,0,0,1,0|2,0,0]=4 6226 B11R1.27 CCNCCc1ccc(s1)C 946a531859238212224da114755c5f6d [0,1,0,0,1,0|2,0,0]=4 6227 B11R1.27 CCNCCc1ccn(n1)C fe937397e351d43abf27c9bc7b85f0d2 [0,1,0,0,1,0|2,0,0]=4 6228 B11R1.27 CCNCCc1cn(cn1)C 4d1a7eb5558775f23f913631273ff7f0 [0,1,0,0,1,0|2,0,0]=4 6229 B11R1.27 CCNCCc1csc(n1)C 5156e21f8d58d9ee47a166d40c504bce [0,1,0,0,1,0|2,0,0]=4 6230 B11R1.27 CCNCCc1nc(c[nH]1)C 1b2a292e0986296ed791b87f19b953e4 [0,1,0,0,1,0|2,0,0]=4 6231 B11R1.27 CCNCCc1nc(cs1)C f0f6609ad9633e3e1f7dfd4cca0770b3 [0,1,0,0,1,0|2,0,0]=4 6232 B11R1.27 CCNCCc1ncc(o1)C 49fdaa052a93004dcd03c0fe0cbdb49f [0,1,0,0,1,0|2,0,0]=4 6233 B11R1.27 CCNCCn1cc(cn1)Br daef956c8d6c6b0e6c9a4c11381f10e5 [0,1,0,0,1,0|2,0,0]=4 6234 B11R1.27 CCNCCn1cc(cn1)C 0d0b21f179c4cc6121c18bd0789d19e4 [0,1,0,0,1,0|2,0,0]=4 6235 B11R1.27 CCNCCn1cc(cn1)Cl e5ca00a5dd5327e350b0165cbe03fb35 [0,1,0,0,1,0|2,0,0]=4 6236 B11R1.27 CCNCCn1cc(cn1)F 24b44f073c5346d0d07c3e2bc74bed19 [0,1,0,0,1,0|2,0,0]=4 6237 B11R1.27 CCNCCn1cc(cn1)I b52f9a7784b6bae3df73173fdd03d965 [0,1,0,0,1,0|2,0,0]=4 6238 B11R1.27 CCNCCn1ccc(n1)C 6df5fb83723e9eabc8e9934f125da654 [0,1,0,0,1,0|2,0,0]=4 6239 B11R1.27 CCOCCc1ccc(o1)C 4ddf07a2cc1d2413b762eea0519bec00 [0,1,0,0,1,0|2,0,0]=4 6240 B11R1.27 CCOCCc1ccn(n1)C 413db2bfb8d939e8d441c3c86f8b3efd [0,1,0,0,1,0|2,0,0]=4 6241 B11R1.27 CCOCCc1csc(c1)Cl 5cd34378a05b2078f31a91e731343749 [0,1,0,0,1,0|2,0,0]=4 6242 B11R1.27 CCOCCc1csc(n1)Br 0a7c1985fcced7eaeadcef43ff5a7a7b [0,1,0,0,1,0|2,0,0]=4 6243 B11R1.27 CCOCCc1csc(n1)C e151994f5f66dcad8625f6167831a70b [0,1,0,0,1,0|2,0,0]=4 6244 B11R1.27 CCOCCc1nc(cs1)Br 0106bddc29b8781486e086b996d01653 [0,1,0,0,1,0|2,0,0]=4 6245 B11R1.27 CCOCCc1nc(cs1)C 00c5730f238505ef74629604aa577801 [0,1,0,0,1,0|2,0,0]=4 6246 B11R1.27 CCOCCn1cc(cn1)Br 7e5a47539bbb702d5f214562ad41e223 [0,1,0,0,1,0|2,0,0]=4 6247 B11R1.27 CCOCCn1cc(cn1)C 09827685f8741cb5bd5b2d42b4bdfc61 [0,1,0,0,1,0|2,0,0]=4 6248 B11R1.27 CCOCCn1cc(cn1)Cl 6a7154b42c658fd7b275fb5184235301 [0,1,0,0,1,0|2,0,0]=4 6249 B11R1.27 CCOCCn1cc(cn1)F 76c367547c0bee06529d9b66bc7a9691 [0,1,0,0,1,0|2,0,0]=4 6250 B11R1.27 CCOCCn1cc(cn1)I d4d2f8c6eb095e0a60c41c9dad013e60 [0,1,0,0,1,0|2,0,0]=4 6251 B11R1.27 CCOCCn1ccc(n1)Br 7e22d0c4efdb24d5b3f4c31e380b0e6f [0,1,0,0,1,0|2,0,0]=4 6252 B11R1.27 CCOCCn1ccc(n1)C 570daca27b3ff53098f5cb08b45b5184 [0,1,0,0,1,0|2,0,0]=4 6253 B11R1.29 CCCCN(C)c1cc[nH]n1 ff5a256682bfe23bc13c94f52bfe4083 [0,1,0,0,1,0|2,0,0]=4 6254 B11R1.29 CCCCN(C)c1ccon1 bbfea199669bed60955e9ac7520d0fce [0,1,0,0,1,0|2,0,0]=4 6255 B11R1.29 CCCCN(C)c1ccsc1 73e8d03923f6fe8b0d0808b0a2b3448a [0,1,0,0,1,0|2,0,0]=4 6256 B11R1.29 CCCCN(C)c1ncc[nH]1 576b07109087348130088b54d54f6fe0 [0,1,0,0,1,0|2,0,0]=4 6257 B11R1.29 CCCCN(C)c1ncco1 86bdcf44921157adba12893b90cc5d2b [0,1,0,0,1,0|2,0,0]=4 6258 B11R1.29 CCCCN(C)c1nccs1 38174c21b3f5686eb8777300f990dbe9 [0,1,0,0,1,0|2,0,0]=4 6259 B11R1.29 CCCNC(C)c1cc[nH]n1 28e3d989293ac995617eba62b62b6d59 [0,1,0,0,1,0|2,0,0]=4 6260 B11R1.29 CCCNC(C)c1ccco1 7e86f1ea622a23860ffb4a628b926f5c [0,1,0,0,1,0|2,0,0]=4 6261 B11R1.29 CCCNC(C)c1cccs1 5aa9843479ce77815080bd0dc1188a66 [0,1,0,0,1,0|2,0,0]=4 6262 B11R1.29 CCCNC(C)c1ccoc1 ef27b7e57df58245be3f3d8d20e03887 [0,1,0,0,1,0|2,0,0]=4 6263 B11R1.29 CCCNC(C)c1ccon1 67656f1890715bf8dc850bd40dbce331 [0,1,0,0,1,0|2,0,0]=4 6264 B11R1.29 CCCNC(C)c1ccsc1 3762ff78ffa47e82acc1654c8ad2a60a [0,1,0,0,1,0|2,0,0]=4 6265 B11R1.29 CCCNC(C)c1cscn1 ad7d90ea73700b59777dc1c5f6cd1f8c [0,1,0,0,1,0|2,0,0]=4 6266 B11R1.29 CCCNC(C)c1ncco1 7e876297f86bbbf2c23cc8f221d3f51e [0,1,0,0,1,0|2,0,0]=4 6267 B11R1.29 CCCNC(C)c1nccs1 4b153d61787ddbfb65149bddfbbc6838 [0,1,0,0,1,0|2,0,0]=4 6268 B11R1.29 CCCN[C@@H](C)c1cccs1 098413012ff26c797e0fcae43b28d795 [0,1,0,0,1,0|2,0,0]=4 6269 B11R1.29 CCCN[C@@H](C)c1ccoc1 b71226b1dd3058ada600f00f02af999d [0,1,0,0,1,0|2,0,0]=4 6270 B11R1.29 CCCN[C@@H](C)c1ccsc1 13a0bed531fe17a778f469fca8f6dbe4 [0,1,0,0,1,0|2,0,0]=4 6271 B11R1.29 CCCN[C@@H](C)c1nccs1 984d86b0b6ea319f15a29a69c1546559 [0,1,0,0,1,0|2,0,0]=4 6272 B11R1.29 CCCN[C@H](C)c1ccco1 842b31baf27b8ee70706649ada8ebef1 [0,1,0,0,1,0|2,0,0]=4 6273 B11R1.29 CCCN[C@H](C)c1cccs1 d06b2fe6113708b6534bdf5ede68b17d [0,1,0,0,1,0|2,0,0]=4 6274 B11R1.29 CCCOC(C)c1cc[nH]n1 d6a0ce1f98f8bd28d133e0d86e63b8ad [0,1,0,0,1,0|2,0,0]=4 6275 B11R1.29 CCCOC(C)c1ccco1 0c8192b3fce9fa8d97db205912c0cbc9 [0,1,0,0,1,0|2,0,0]=4 6276 B11R1.29 CCCOC(C)c1cccs1 7b6bdb3f83eaafe65831e71864baaf4a [0,1,0,0,1,0|2,0,0]=4 6277 B11R1.29 CCCOC(C)c1ccoc1 cd17fc6327b8a7dbf5c2dabbfe8c9b51 [0,1,0,0,1,0|2,0,0]=4 6278 B11R1.29 CCCOC(C)c1ccsc1 84fd32ab7c3c8822913027317a1ec36e [0,1,0,0,1,0|2,0,0]=4 6279 B11R1.29 CCCOC(C)c1ncc[nH]1 6b368c98d064f0f46fbea455c224981b [0,1,0,0,1,0|2,0,0]=4 6280 B11R1.29 CCCOC(C)c1nccs1 326ac3f09a63a9ce63f16659a3405401 [0,1,0,0,1,0|2,0,0]=4 6281 B11R1.29 CCCO[C@@H](C)c1cccs1 21ea319236f123ccc86c3b2cf90832cc [0,1,0,0,1,0|2,0,0]=4 6282 B11R1.29 CCCO[C@@H](C)c1nccs1 5769645f545128b436ab29090befb3b8 [0,1,0,0,1,0|2,0,0]=4 6283 B11R1.29 CCCO[C@H](C)c1ccco1 8a90bd4017346c35e1595975c1908a98 [0,1,0,0,1,0|2,0,0]=4 6284 B11R1.29 CCCO[C@H](C)c1cccs1 29e31d089cc062e1ef867d38e325320e [0,1,0,0,1,0|2,0,0]=4 6285 B11R1.29 CCCO[C@H](C)c1nccs1 661662ff2b4d6076cceaec1a6e6d6f54 [0,1,0,0,1,0|2,0,0]=4 6286 B11R1.29 CCNCC(C)n1cccn1 fdd638cb0a525134b4972d535cd7bb34 [0,1,0,0,1,0|2,0,0]=4 6287 B11R1.29 CCNCC(O)c1ccco1 528c2aad00677439131d2a8d894a2f6c [0,1,0,0,1,0|2,0,0]=4 6288 B11R1.29 CCNCC(O)c1cccs1 0c5890746682937c6b36dd00db074136 [0,1,0,0,1,0|2,0,0]=4 6289 B11R1.29 CCOCC(C)n1cccn1 55f85cb0f7dca8112a7bc40c5ff47992 [0,1,0,0,1,0|2,0,0]=4 6290 B11R1.30 CCCC(C)Nc1cc[nH]n1 b4b065909ce688095c4b048bb7b7386d [0,1,0,0,1,0|2,0,0]=4 6291 B11R1.30 CCCC(C)Nc1ccon1 ffad106731436be8ced1d762a3f2f8bd [0,1,0,0,1,0|2,0,0]=4 6292 B11R1.30 CCCC(C)Nc1ccsc1 fbef47c4458c88f411c7bd1d2ff9ed15 [0,1,0,0,1,0|2,0,0]=4 6293 B11R1.30 CCCC(C)Nc1cocn1 8a9f92e5b79c3d6facca7b044e5f8762 [0,1,0,0,1,0|2,0,0]=4 6294 B11R1.30 CCCC(C)Nc1cscn1 715eb8e2fd04c8850cf5ebef75b911c9 [0,1,0,0,1,0|2,0,0]=4 6295 B11R1.30 CCCC(C)Nc1ncco1 3b3abc37f1b3c759cd4bd5bbcc94dd4c [0,1,0,0,1,0|2,0,0]=4 6296 B11R1.30 CCCC(C)Nc1nccs1 c7695b71c92cc9661656c60f4813a6a2 [0,1,0,0,1,0|2,0,0]=4 6297 B11R1.30 CCCC(C)Oc1c[nH]cn1 978c9ea3b13cfd71c1faeecf279a2fef [0,1,0,0,1,0|2,0,0]=4 6298 B11R1.30 CCCC(C)Oc1ccco1 715c6a459f942b82fe295bae77d57485 [0,1,0,0,1,0|2,0,0]=4 6299 B11R1.30 CCCC(C)Oc1cccs1 796dc12e7e3554432ba77b7bb6595c04 [0,1,0,0,1,0|2,0,0]=4 6300 B11R1.30 CCCC(C)Oc1ccsc1 ee117a61ff3684278ad9cc49fc666a26 [0,1,0,0,1,0|2,0,0]=4 6301 B11R1.30 CCCC(C)Oc1nccs1 800276f9fd018d94b21807354c854724 [0,1,0,0,1,0|2,0,0]=4 6302 B11R1.30 CCCC(C)On1cccn1 ff5ef82a61920299b2b78e85ba84b66b [0,1,0,0,1,0|2,0,0]=4 6303 B11R1.30 CCCN(C)Cc1ccc[nH]1 d8cc80f127505f144f5e5a57f8d3a508 [0,1,0,0,1,0|1,0,1]=4 6304 B11R1.30 CCCN(C)Cc1ccco1 13f6d562055bcf95cd6da20bf92f66e4 [0,1,0,0,1,0|2,0,0]=4 6305 B11R1.30 CCCN(C)Cc1cccs1 d47aa17881ff2fe293557d1c1372694d [0,1,0,0,1,0|2,0,0]=4 6306 B11R1.30 CCCN(C)Cc1ccoc1 8977ce9718cfaad00a8f445e9e6ba097 [0,1,0,0,1,0|2,0,0]=4 6307 B11R1.30 CCCN(C)Cc1ccon1 9360b71ddbdf78ab54d898ab34c7168f [0,1,0,0,1,0|2,0,0]=4 6308 B11R1.30 CCCN(C)Cc1ccsc1 5deed8c7bb0c8e4de79b0984350406fd [0,1,0,0,1,0|2,0,0]=4 6309 B11R1.30 CCCN(C)Cc1cocn1 c48c6b8af62af191f3cb84b0792f8a25 [0,1,0,0,1,0|2,0,0]=4 6310 B11R1.30 CCCN(C)Cc1cscn1 692950a50c7d9ed7195091a63430f2b4 [0,1,0,0,1,0|2,0,0]=4 6311 B11R1.30 CCCN(C)Cc1ncc[nH]1 489b95e2e3333e535afc4c7e057bb8bd [0,1,0,0,1,0|2,0,0]=4 6312 B11R1.30 CCCN(C)Cc1ncco1 69cfe9ea54e60b6bea38f714de2a46b1 [0,1,0,0,1,0|2,0,0]=4 6313 B11R1.30 CCCN(C)Cc1nccs1 00005974bb045b8b599c15d103d80ced [0,1,0,0,1,0|2,0,0]=4 6314 B11R1.30 CCNC(C)Cc1c[nH]cn1 890adc82d4ddb1d850124c26f5e2d212 [0,1,0,0,1,0|2,0,0]=4 6315 B11R1.30 CCNC(C)Cc1ccc[nH]1 9544ecf8ad212305936bbb7c8680e8b3 [0,1,0,0,1,0|1,0,1]=4 6316 B11R1.30 CCNC(C)Cc1ccco1 d3bc82612ebcebe3fdc3daa746d06097 [0,1,0,0,1,0|2,0,0]=4 6317 B11R1.30 CCNC(C)Cc1ccsc1 83308ceaeea130f4b35183b354587cd5 [0,1,0,0,1,0|2,0,0]=4 6318 B11R1.30 CCNC(C)Cn1cccn1 18b0f4ebf8da6ffae9e2e2a4707b1524 [0,1,0,0,1,0|2,0,0]=4 6319 B11R1.30 CCN[C@@H](C)Cc1c[nH]cn1 9a181267ba59ccaafbc8207412e20465 [0,1,0,0,1,0|2,0,0]=4 6320 B11R1.30 CCN[C@H](C)Cc1c[nH]cn1 213cc2413d44b8115606eef751860d0c [0,1,0,0,1,0|2,0,0]=4 6321 B11R1.30 CCOC(C)Cc1ccco1 4721e32c92e264327edcbf525712e92a [0,1,0,0,1,0|2,0,0]=4 6322 B11R1.30 CCOC(C)Cc1ccsc1 2743e83faf7d5517bf7a4e302aee5558 [0,1,0,0,1,0|2,0,0]=4 6323 B11R1.172 CC(C)CCNc1c[nH]cn1 7ae04c4a3f44fe3217857895da9d7971 [0,1,0,0,1,0|2,0,0]=4 6324 B11R1.172 CC(C)CCNc1cc[nH]n1 c4f7f5af6881a43dfe0f27811cba86ba [0,1,0,0,1,0|2,0,0]=4 6325 B11R1.172 CC(C)CCNc1ccco1 0e041b2f4b640f51ce49397377a10223 [0,1,0,0,1,0|2,0,0]=4 6326 B11R1.172 CC(C)CCNc1cccs1 b29fb4c479a2f9ae2c76659a475dd1e2 [0,1,0,0,1,0|2,0,0]=4 6327 B11R1.172 CC(C)CCNc1ccoc1 7ebe9b14796b4c217c38dc26f6fec162 [0,1,0,0,1,0|2,0,0]=4 6328 B11R1.172 CC(C)CCNc1ccon1 0892a67cd95a19f3fad96d24db1b5363 [0,1,0,0,1,0|2,0,0]=4 6329 B11R1.172 CC(C)CCNc1ccsc1 b1936e67b0f711f22daf46cd19cf1f7b [0,1,0,0,1,0|2,0,0]=4 6330 B11R1.172 CC(C)CCNc1cocn1 bfea655ed1575f1b0dd1ca89604103c2 [0,1,0,0,1,0|2,0,0]=4 6331 B11R1.172 CC(C)CCNc1cscn1 c8a2387e0a0065f8cb937b99e1077f71 [0,1,0,0,1,0|2,0,0]=4 6332 B11R1.172 CC(C)CCNc1ncc[nH]1 be5a7158985d2b330535a065f4a3be64 [0,1,0,0,1,0|2,0,0]=4 6333 B11R1.172 CC(C)CCNc1ncco1 8fa04247aab3e66a2755473ad1724e74 [0,1,0,0,1,0|2,0,0]=4 6334 B11R1.172 CC(C)CCNc1nccs1 b1bb0da2418fff61f8b73320cc1c0a4b [0,1,0,0,1,0|2,0,0]=4 6335 B11R1.172 CC(C)CCOc1c[nH]cn1 9e5c4f69ca08c5d42944d2ec9516f86a [0,1,0,0,1,0|2,0,0]=4 6336 B11R1.172 CC(C)CCOc1ccco1 8d841360fc8b7eeb8a9816f92abe8dd7 [0,1,0,0,1,0|2,0,0]=4 6337 B11R1.172 CC(C)CCOc1cccs1 06337048459e9830423ea92a8c3a7917 [0,1,0,0,1,0|2,0,0]=4 6338 B11R1.172 CC(C)CCOc1ccsc1 9ce5b490ff0614ff8e34f5809b096b0e [0,1,0,0,1,0|2,0,0]=4 6339 B11R1.172 CC(C)CCOc1nccs1 e16583ace1d8b9ff1e24d5ae20e14243 [0,1,0,0,1,0|2,0,0]=4 6340 B11R1.172 CC(C)CCOn1cccn1 95fe1279c7ee57fa23644ca2bf29f2da [0,1,0,0,1,0|2,0,0]=4 6341 B11R1.172 CC(C)CNCc1cc[nH]c1 cc846d9e1d89b6014f7bfe04355228b4 [0,1,0,0,1,0|2,0,0]=4 6342 B11R1.172 CC(C)CNCc1ccc[nH]1 bd3755f5e4d405dc3cb2b6dadc26391b [0,1,0,0,1,0|1,0,1]=4 6343 B11R1.172 CC(C)CNCc1ccco1 1b61b056633b02c6b253717bdc3f6b4e [0,1,0,0,1,0|2,0,0]=4 6344 B11R1.172 CC(C)CNCc1cccs1 5df1be8740ff9b60507f6e6c6139b4e1 [0,1,0,0,1,0|2,0,0]=4 6345 B11R1.172 CC(C)CNCc1ccoc1 abdce0e0b6e3e9e183851a8f16b7972b [0,1,0,0,1,0|2,0,0]=4 6346 B11R1.172 CC(C)CNCc1ccon1 05c603c24cb56ebe1cf6a9f48742bfc3 [0,1,0,0,1,0|2,0,0]=4 6347 B11R1.172 CC(C)CNCc1ccsc1 e375da7936875e25995a75a273cb508f [0,1,0,0,1,0|2,0,0]=4 6348 B11R1.172 CC(C)CNCc1ccsn1 8a1d893d693a0ae0935cdbca0b629c66 [0,1,0,0,1,0|2,0,0]=4 6349 B11R1.172 CC(C)CNCc1cocn1 d473fdf953f5dcc481e81f7f468b8658 [0,1,0,0,1,0|2,0,0]=4 6350 B11R1.172 CC(C)CNCc1cscn1 9f98f81de7b76a6b06052361c46a0b95 [0,1,0,0,1,0|2,0,0]=4 6351 B11R1.172 CC(C)CNCc1ncc[nH]1 f10597b04f80aa8c8deacce451617a7f [0,1,0,0,1,0|2,0,0]=4 6352 B11R1.172 CC(C)CNCc1ncco1 47599f932c2b2b8dc110466137871c15 [0,1,0,0,1,0|2,0,0]=4 6353 B11R1.172 CC(C)CNCc1nccs1 35ee93ab0f27b94e170825e886d2ea02 [0,1,0,0,1,0|2,0,0]=4 6354 B11R1.172 CC(C)COCc1cc[nH]c1 d32a56aaff287a7a2d3ee05c33df49e4 [0,1,0,0,1,0|2,0,0]=4 6355 B11R1.172 CC(C)COCc1ccc[nH]1 5a8c3097a96460e302a65efef3ee13ad [0,1,0,0,1,0|1,0,1]=4 6356 B11R1.172 CC(C)COCc1ccco1 99062e49951b35e6277ae5df50b7eb8b [0,1,0,0,1,0|2,0,0]=4 6357 B11R1.172 CC(C)COCc1cccs1 9d12584da4da3768cc88ad1ee50f3323 [0,1,0,0,1,0|2,0,0]=4 6358 B11R1.172 CC(C)COCc1ccoc1 f9f3dacca4368645a18802fe7b1f131d [0,1,0,0,1,0|2,0,0]=4 6359 B11R1.172 CC(C)COCc1ccon1 a7a2fc37ea8a558c0c8328c30627fcda [0,1,0,0,1,0|2,0,0]=4 6360 B11R1.172 CC(C)COCc1ccsc1 5f9ec88250d33adb77f1a6ab8ef0f92a [0,1,0,0,1,0|2,0,0]=4 6361 B11R1.172 CC(C)COCc1ccsn1 ad886a34784e0e09bff30c01ee6a080b [0,1,0,0,1,0|2,0,0]=4 6362 B11R1.172 CC(C)COCc1cocn1 3477ea232e124e6f2045b520de137047 [0,1,0,0,1,0|2,0,0]=4 6363 B11R1.172 CC(C)COCc1cscn1 32993c89feb07607d6a9d27cd4988da3 [0,1,0,0,1,0|2,0,0]=4 6364 B11R1.172 CC(C)COCc1ncc[nH]1 7fbb1ae0ca2c1b3f95efb21fb2e3c7fa [0,1,0,0,1,0|2,0,0]=4 6365 B11R1.172 CC(C)COCc1ncco1 987d59bd6b526214c9dfc70588ee37f2 [0,1,0,0,1,0|2,0,0]=4 6366 B11R1.172 CC(C)COCc1nccs1 79e37879de0795b0ec50770976898442 [0,1,0,0,1,0|2,0,0]=4 6367 B11R1.172 CC(C)COCn1cccn1 3a7d10593f54869b931fa8d834e14cbd [0,1,0,0,1,0|2,0,0]=4 6368 B11R1.172 CC(C)NCCc1c[nH]cn1 d9b1093684083398f09b2bcc7c136d3f [0,1,0,0,1,0|2,0,0]=4 6369 B11R1.172 CC(C)NCCc1cc[nH]n1 19f8bfea33503f6d301578a663802f79 [0,1,0,0,1,0|2,0,0]=4 6370 B11R1.172 CC(C)NCCc1ccc[nH]1 2373d6633e894ab6620732174fbf2348 [0,1,0,0,1,0|1,0,1]=4 6371 B11R1.172 CC(C)NCCc1ccco1 f5a48b9013a3de5311256701c81ca609 [0,1,0,0,1,0|2,0,0]=4 6372 B11R1.172 CC(C)NCCc1ccsc1 635101e28400fe3ec9e545656df9f636 [0,1,0,0,1,0|2,0,0]=4 6373 B11R1.172 CC(C)NCCc1cscn1 8268b8eefd70916f6371029db98c0cad [0,1,0,0,1,0|2,0,0]=4 6374 B11R1.172 CC(C)NCCc1ncc[nH]1 a69741db26734503d0ab0defbe57728b [0,1,0,0,1,0|2,0,0]=4 6375 B11R1.172 CC(C)NCCc1nccs1 22245f012db5b34cbd3c6d6fbc31907a [0,1,0,0,1,0|2,0,0]=4 6376 B11R1.172 CC(C)NCCn1cccc1 3f8b4596f98c55810820db0b27d21631 [0,1,0,0,1,0|2,0,0]=4 6377 B11R1.172 CC(C)NCCn1cccn1 d6b7145559ee08162a45046e431411c0 [0,1,0,0,1,0|2,0,0]=4 6378 B11R1.172 CC(C)OCCc1c[nH]cn1 afa4852823a31685051d73ac8913effc [0,1,0,0,1,0|2,0,0]=4 6379 B11R1.172 CC(C)OCCc1cc[nH]n1 e689d5d9c86bbb9489a6e9aebb82f3ec [0,1,0,0,1,0|2,0,0]=4 6380 B11R1.172 CC(C)OCCc1ccc[nH]1 b795ec8b9482be4f91d31fc84cdf4434 [0,1,0,0,1,0|1,0,1]=4 6381 B11R1.172 CC(C)OCCc1ccco1 e7f3ba800a326f72fff6110f1619a3df [0,1,0,0,1,0|2,0,0]=4 6382 B11R1.172 CC(C)OCCc1cccs1 2146c5876f28335c6af6107c79243d30 [0,1,0,0,1,0|2,0,0]=4 6383 B11R1.172 CC(C)OCCc1ccon1 6edfaca2055ed03eccf5f2973cbbe579 [0,1,0,0,1,0|2,0,0]=4 6384 B11R1.172 CC(C)OCCc1ccsc1 49bd09b63533e3db912f0818d987b581 [0,1,0,0,1,0|2,0,0]=4 6385 B11R1.172 CC(C)OCCc1cscn1 fc1cb18e419ffcc961dd1ccb5c250885 [0,1,0,0,1,0|2,0,0]=4 6386 B11R1.172 CC(C)OCCc1ncc[nH]1 092da5d9821e201f2d60de4bed55e682 [0,1,0,0,1,0|2,0,0]=4 6387 B11R1.172 CC(C)OCCc1nccs1 b595e721a30a74a4fc888d5c50af8b58 [0,1,0,0,1,0|2,0,0]=4 6388 B11R1.172 CC(C)OCCn1cccc1 1c91ae9527fd65aa47ad054313c29fd4 [0,1,0,0,1,0|2,0,0]=4 6389 B11R1.172 CC(C)OCCn1cccn1 0ee9b02b4e9d97cd3287fcf0c1cb0894 [0,1,0,0,1,0|2,0,0]=4 6390 B11R1.172 CC(F)COCc1ccco1 d0f129770505d2aafab7a0041834f6ad [0,1,0,0,1,0|2,0,0]=4 6391 B11R1.172 CC(F)COCc1cccs1 9035fc746e51d6905252026e3e6a2ce5 [0,1,0,0,1,0|2,0,0]=4 6392 B11R1.172 CC(F)COCc1ccon1 3ab3f56453e35c9854fe8acda5d40da6 [0,1,0,0,1,0|2,0,0]=4 6393 B11R1.172 CC(F)COCc1ccsc1 5179ea0463970cefa06fb626c4d223d4 [0,1,0,0,1,0|2,0,0]=4 6394 B11R1.172 CC(F)COCc1cocn1 64c54ee5cce38304612997e386318807 [0,1,0,0,1,0|2,0,0]=4 6395 B11R1.172 CC(F)COCc1cscn1 0996bd2d99c6ba4cac3165e5d8081d60 [0,1,0,0,1,0|2,0,0]=4 6396 B11R1.172 CC(F)COCc1ncc[nH]1 3def0e097918c80698007d7f0a7af090 [0,1,0,0,1,0|2,0,0]=4 6397 B11R1.172 CC(F)COCc1ncco1 1cc8ad32765f9ff8b40b65ece9c952d3 [0,1,0,0,1,0|2,0,0]=4 6398 B11R1.172 CC(F)COCc1nccs1 2c095f622a9554bd39c436dee218f265 [0,1,0,0,1,0|2,0,0]=4 6399 B11R1.172 CC(O)CCNc1c[nH]cn1 420677d5e03666f5f5886d01fd8d5405 [0,1,0,0,1,0|2,0,0]=4 6400 B11R1.172 CC(O)CCNc1cc[nH]n1 d7a9f1d2c3aeaf296b417bf6f54e1675 [0,1,0,0,1,0|2,0,0]=4 6401 B11R1.172 CC(O)CCNc1cccs1 2be6abdeb25e1a613e3824969dae5a95 [0,1,0,0,1,0|2,0,0]=4 6402 B11R1.172 CC(O)CCNc1ccoc1 0d5aace06c195fae7236613b1f15760c [0,1,0,0,1,0|2,0,0]=4 6403 B11R1.172 CC(O)CCNc1ccon1 06fc7f4ccf11150481b9f30e5beca1e6 [0,1,0,0,1,0|2,0,0]=4 6404 B11R1.172 CC(O)CCNc1ccsc1 b48c5909989be673f586a9eaa1eb5314 [0,1,0,0,1,0|2,0,0]=4 6405 B11R1.172 CC(O)CCNc1cocn1 4811f2222d89ffc6f30ac3d23f242013 [0,1,0,0,1,0|2,0,0]=4 6406 B11R1.172 CC(O)CCNc1cscn1 32a553a374a6fff602fb49a2c61b5179 [0,1,0,0,1,0|2,0,0]=4 6407 B11R1.172 CC(O)CCNc1ncc[nH]1 f2a0f5a03c64b7e72688aa5b64efdc18 [0,1,0,0,1,0|2,0,0]=4 6408 B11R1.172 CC(O)CCNc1ncco1 75c6c0c1bbfd1b91cfc8b463b8b7c775 [0,1,0,0,1,0|2,0,0]=4 6409 B11R1.172 CC(O)CCNc1nccs1 91ad6d1f169b3276d89137abe6c743ee [0,1,0,0,1,0|2,0,0]=4 6410 B11R1.172 CC(O)CNCc1cc[nH]c1 9f9b0963ff0e2429adb0240f34bc16dd [0,1,0,0,1,0|2,0,0]=4 6411 B11R1.172 CC(O)CNCc1ccc[nH]1 65c95582f301464d7f62eb60cd967e76 [0,1,0,0,1,0|1,0,1]=4 6412 B11R1.172 CC(O)CNCc1ccco1 dba85ac96ca60610e6077e0d05d62bcd [0,1,0,0,1,0|2,0,0]=4 6413 B11R1.172 CC(O)CNCc1cccs1 18715149f7e8e0c045513c4ae4cdb762 [0,1,0,0,1,0|2,0,0]=4 6414 B11R1.172 CC(O)CNCc1ccoc1 c05e4a8d2cf400a602ecf2a2d20445f6 [0,1,0,0,1,0|2,0,0]=4 6415 B11R1.172 CC(O)CNCc1ccon1 f160c71ed0f06c6e9149fe34c85b425e [0,1,0,0,1,0|2,0,0]=4 6416 B11R1.172 CC(O)CNCc1ccsc1 578d60fe25eabb7af2d41b2ed5be0bda [0,1,0,0,1,0|2,0,0]=4 6417 B11R1.172 CC(O)CNCc1ccsn1 e3ce28242e3095f5b318fb93b71ce7fb [0,1,0,0,1,0|2,0,0]=4 6418 B11R1.172 CC(O)CNCc1cocn1 540d218358fee8bbb7f5b5ad84d4bbb9 [0,1,0,0,1,0|2,0,0]=4 6419 B11R1.172 CC(O)CNCc1cscn1 983fb73c856436dc88022f74b701410d [0,1,0,0,1,0|2,0,0]=4 6420 B11R1.172 CC(O)CNCc1ncc[nH]1 34ba7e9b973cac09823c7c66b2f448cf [0,1,0,0,1,0|2,0,0]=4 6421 B11R1.172 CC(O)CNCc1ncco1 0562076b9ae6905bdb5dfa09c4b727bb [0,1,0,0,1,0|2,0,0]=4 6422 B11R1.172 CC(O)CNCc1nccs1 45366f99c01d0a6bb3edcc30762434ae [0,1,0,0,1,0|2,0,0]=4 6423 B11R1.172 CC(S)COCc1ccco1 64d0adfb42f5538807c786da49eb2388 [0,1,0,0,1,0|2,0,0]=4 6424 B11R1.172 CC(S)COCc1cccs1 d767ed87ab446f6cba115b5caffd9073 [0,1,0,0,1,0|2,0,0]=4 6425 B11R1.172 CC(S)COCc1ccon1 0eda5ac6affd7e5a032332e23382d7eb [0,1,0,0,1,0|2,0,0]=4 6426 B11R1.172 CC(S)COCc1ccsc1 444ab4c19c1694f40c00ba1d864d6f21 [0,1,0,0,1,0|2,0,0]=4 6427 B11R1.172 CC(S)COCc1cocn1 b0fc9522c59c6db7b135f2b6d32edcd3 [0,1,0,0,1,0|2,0,0]=4 6428 B11R1.172 CC(S)COCc1cscn1 4f3d95e08fe08aeffa2046102a149d60 [0,1,0,0,1,0|2,0,0]=4 6429 B11R1.172 CC(S)COCc1ncc[nH]1 e3b5dd71f9adf4166ce4cac38e197017 [0,1,0,0,1,0|2,0,0]=4 6430 B11R1.172 CC(S)COCc1ncco1 9fb9d360e3ff34cc641550b20da5e1b5 [0,1,0,0,1,0|2,0,0]=4 6431 B11R1.172 CC(S)COCc1nccs1 8b8201deb33831516989bb55c1a7ef39 [0,1,0,0,1,0|2,0,0]=4 6432 B11R1.172 C[C@@H](F)COCc1ccco1 d6b942e64f19e537e65fb887839c99a6 [0,1,0,0,1,0|2,0,0]=4 6433 B11R1.172 C[C@@H](F)COCc1cccs1 39fbb95f05fba443250a39ac0e069ade [0,1,0,0,1,0|2,0,0]=4 6434 B11R1.172 C[C@@H](F)COCc1ccon1 2d291c0d3ffe17bbe795594dc011496c [0,1,0,0,1,0|2,0,0]=4 6435 B11R1.172 C[C@@H](F)COCc1ccsc1 9f150012771be753bab76edc1000ed18 [0,1,0,0,1,0|2,0,0]=4 6436 B11R1.172 C[C@@H](F)COCc1cocn1 583c337a06bbc808dd52ef92804d706a [0,1,0,0,1,0|2,0,0]=4 6437 B11R1.172 C[C@@H](F)COCc1cscn1 3d9db329e95758e1d76f0cde9d32f85a [0,1,0,0,1,0|2,0,0]=4 6438 B11R1.172 C[C@@H](F)COCc1ncc[nH]1 cf50fd57f9bc317792cbee4b12222031 [0,1,0,0,1,0|2,0,0]=4 6439 B11R1.172 C[C@@H](F)COCc1ncco1 02e16fa5daad205df453af1bc3af671e [0,1,0,0,1,0|2,0,0]=4 6440 B11R1.172 C[C@@H](F)COCc1nccs1 381b58d3561f3a26894cbfdd376ec117 [0,1,0,0,1,0|2,0,0]=4 6441 B11R1.172 C[C@@H](O)CCNc1c[nH]cn1 aa5a03ac4bbb4ba849f275222810d984 [0,1,0,0,1,0|2,0,0]=4 6442 B11R1.172 C[C@@H](O)CCNc1cccs1 4f802c737665298fc909b0e83238e6ea [0,1,0,0,1,0|2,0,0]=4 6443 B11R1.172 C[C@@H](O)CCNc1ccoc1 f528c33cfde9ed2040e1fc72eaabddad [0,1,0,0,1,0|2,0,0]=4 6444 B11R1.172 C[C@@H](O)CCNc1ccsc1 6dc915693327cd94d5daa62ba1536867 [0,1,0,0,1,0|2,0,0]=4 6445 B11R1.172 C[C@@H](O)CCNc1ncco1 526ef39734d38458711916f690fcc4eb [0,1,0,0,1,0|2,0,0]=4 6446 B11R1.172 C[C@@H](O)CCNc1nccs1 96789c3b6524b43845f75250fa74517f [0,1,0,0,1,0|2,0,0]=4 6447 B11R1.172 C[C@@H](O)CNCc1cc[nH]c1 0e203e4cf1ed106d736b7c5367ffc968 [0,1,0,0,1,0|2,0,0]=4 6448 B11R1.172 C[C@@H](O)CNCc1ccc[nH]1 66008730529aa8d24f63c6ffa76df555 [0,1,0,0,1,0|1,0,1]=4 6449 B11R1.172 C[C@@H](O)CNCc1ccco1 63796111ed16563c371374fd22b9d739 [0,1,0,0,1,0|2,0,0]=4 6450 B11R1.172 C[C@@H](O)CNCc1cccs1 8182a9769f3affdaa5bb920d0c744883 [0,1,0,0,1,0|2,0,0]=4 6451 B11R1.172 C[C@@H](O)CNCc1ccon1 de0770c6e395e48ec49015f6c2faefa5 [0,1,0,0,1,0|2,0,0]=4 6452 B11R1.172 C[C@@H](O)CNCc1ccsc1 8364c0a011f7ef78e915fb7db6b3ce9a [0,1,0,0,1,0|2,0,0]=4 6453 B11R1.172 C[C@@H](O)CNCc1ccsn1 564b3dbb339bd2343e35fffd3dc287eb [0,1,0,0,1,0|2,0,0]=4 6454 B11R1.172 C[C@@H](O)CNCc1cocn1 ff71dd68cfd9a9552261ea8cc0a9bac1 [0,1,0,0,1,0|2,0,0]=4 6455 B11R1.172 C[C@@H](O)CNCc1cscn1 a11fbdc0d638a611d7546fc3884fea8d [0,1,0,0,1,0|2,0,0]=4 6456 B11R1.172 C[C@@H](O)CNCc1ncc[nH]1 278deaaec15ac3c629be2d2fb48c3111 [0,1,0,0,1,0|2,0,0]=4 6457 B11R1.172 C[C@@H](O)CNCc1ncco1 ea80babeca0e0c2328d044882241967c [0,1,0,0,1,0|2,0,0]=4 6458 B11R1.172 C[C@@H](O)CNCc1nccs1 f6fe197cea0fb8f8e6829de2246e827b [0,1,0,0,1,0|2,0,0]=4 6459 B11R1.172 C[C@H](F)COCc1ccco1 fbf7bd3431d8f8c5f513c23259a8679a [0,1,0,0,1,0|2,0,0]=4 6460 B11R1.172 C[C@H](F)COCc1cccs1 a5ac52ecaa06dd8381bf8a23ee830366 [0,1,0,0,1,0|2,0,0]=4 6461 B11R1.172 C[C@H](F)COCc1ccon1 5cee93b2c3091dabd6bb1d30c8eb7470 [0,1,0,0,1,0|2,0,0]=4 6462 B11R1.172 C[C@H](F)COCc1ccsc1 78c5bfeb085bc53c291a77ec64a5637c [0,1,0,0,1,0|2,0,0]=4 6463 B11R1.172 C[C@H](F)COCc1cocn1 d2a87f04b31dc0cd71b5c4b44f381f76 [0,1,0,0,1,0|2,0,0]=4 6464 B11R1.172 C[C@H](F)COCc1cscn1 f81d0b3c085a717166260b1b07c8aaab [0,1,0,0,1,0|2,0,0]=4 6465 B11R1.172 C[C@H](F)COCc1ncc[nH]1 c1c38a6fd87aebc1d9874c4776f58e62 [0,1,0,0,1,0|2,0,0]=4 6466 B11R1.172 C[C@H](F)COCc1ncco1 fab287dfcf2bff821b220f823828cdba [0,1,0,0,1,0|2,0,0]=4 6467 B11R1.172 C[C@H](F)COCc1nccs1 d44653db091fbb3c3452f2bbba4de085 [0,1,0,0,1,0|2,0,0]=4 6468 B11R1.172 C[C@H](O)CCNc1c[nH]cn1 4b2cf3b78b6c5abfe10eb6cc1cd44283 [0,1,0,0,1,0|2,0,0]=4 6469 B11R1.172 C[C@H](O)CCNc1cccs1 3016d239b47ebdea25cc9af11da7d6d7 [0,1,0,0,1,0|2,0,0]=4 6470 B11R1.172 C[C@H](O)CCNc1ccoc1 a8dc0afe0ca1e4ba9281aaecb84be944 [0,1,0,0,1,0|2,0,0]=4 6471 B11R1.172 C[C@H](O)CCNc1ccsc1 c012236e140f600d6a72c1c916e439a7 [0,1,0,0,1,0|2,0,0]=4 6472 B11R1.172 C[C@H](O)CCNc1ncco1 709c6b7cefae01bfa99646d96c43c28e [0,1,0,0,1,0|2,0,0]=4 6473 B11R1.172 C[C@H](O)CCNc1nccs1 1d017e8a98a57b9569affdc1e78de7b6 [0,1,0,0,1,0|2,0,0]=4 6474 B11R1.172 C[C@H](O)CNCc1cc[nH]c1 ef1e595646e0c92a9a0a3d806106769d [0,1,0,0,1,0|2,0,0]=4 6475 B11R1.172 C[C@H](O)CNCc1ccc[nH]1 616d8946b697237869f21f091970eb52 [0,1,0,0,1,0|1,0,1]=4 6476 B11R1.172 C[C@H](O)CNCc1ccco1 14b70b5b444307109cbe8cf07983b605 [0,1,0,0,1,0|2,0,0]=4 6477 B11R1.172 C[C@H](O)CNCc1cccs1 e5211f0f37be1102ed21362e3ecf1a4a [0,1,0,0,1,0|2,0,0]=4 6478 B11R1.172 C[C@H](O)CNCc1ccoc1 0067a311d9970e551754a6d67d461fe2 [0,1,0,0,1,0|2,0,0]=4 6479 B11R1.172 C[C@H](O)CNCc1ccon1 465cb70d021593e2c3bb9e5ad10d5022 [0,1,0,0,1,0|2,0,0]=4 6480 B11R1.172 C[C@H](O)CNCc1ccsc1 e805f7552cfc98b120bc98413fb119ef [0,1,0,0,1,0|2,0,0]=4 6481 B11R1.172 C[C@H](O)CNCc1ccsn1 3cdea06940c7aee6550f289c42f245ab [0,1,0,0,1,0|2,0,0]=4 6482 B11R1.172 C[C@H](O)CNCc1cocn1 7fbe50fa95887426e3b98286485eae3e [0,1,0,0,1,0|2,0,0]=4 6483 B11R1.172 C[C@H](O)CNCc1cscn1 b22d1deab7bf852cc79666a4562bcce1 [0,1,0,0,1,0|2,0,0]=4 6484 B11R1.172 C[C@H](O)CNCc1ncc[nH]1 ecf8c318c48ac227f15317df965f66ff [0,1,0,0,1,0|2,0,0]=4 6485 B11R1.172 C[C@H](O)CNCc1ncco1 fbb74fa32e6d68573209d9115a2dda3c [0,1,0,0,1,0|2,0,0]=4 6486 B11R1.172 C[C@H](O)CNCc1nccs1 ef57830e1bffdb68139221eea5006002 [0,1,0,0,1,0|2,0,0]=4 6487 B11R1.180 CCCCNc1cccn1C 832204d8dcb1af64b9a1e1bacf002b6c [0,1,0,0,1,0|1,0,1]=4 6488 B11R1.180 CCCCNc1ccsc1C 4b33baa6cbbf646d868e98b53b0470a5 [0,1,0,0,1,0|2,0,0]=4 6489 B11R1.180 CCCCNc1cscc1Br ec7f629755af23129396169843dd531f [0,1,0,0,1,0|2,0,0]=4 6490 B11R1.180 CCCCNc1cscc1C 5c336951b5fdc8b35a2bf4f94bff34c9 [0,1,0,0,1,0|2,0,0]=4 6491 B11R1.180 CCCCNc1n[nH]cc1Br 8e1d83e00bcbbb803fa61598ed322504 [0,1,0,0,1,0|2,0,0]=4 6492 B11R1.180 CCCCNc1n[nH]cc1C 576addfcace468a227274697942402b6 [0,1,0,0,1,0|2,0,0]=4 6493 B11R1.180 CCCCNc1n[nH]cc1Cl 409e93c97ffa229d9cc1f8db9162396b [0,1,0,0,1,0|2,0,0]=4 6494 B11R1.180 CCCCNc1n[nH]cc1I ef38ed2588e51a02f8c8fdd6df70466d [0,1,0,0,1,0|2,0,0]=4 6495 B11R1.180 CCCCNc1n[nH]cc1N 05fe434bc868a1dfdbff1351bab6318b [0,1,0,0,1,0|2,0,0]=4 6496 B11R1.180 CCCCNc1nc[nH]c1C e43fb204ee6be9b704d66c54c6556238 [0,1,0,0,1,0|2,0,0]=4 6497 B11R1.180 CCCCNc1nccn1C 9aad54ba403509b00b3692db48a392e1 [0,1,0,0,1,0|2,0,0]=4 6498 B11R1.180 CCCCNc1ncsc1Br 7f405bcdbaf8c3b8dcf52eea4c31c571 [0,1,0,0,1,0|2,0,0]=4 6499 B11R1.180 CCCCNc1nocc1Br f297a964f4121c3e3fac2d5524bc3c5b [0,1,0,0,1,0|2,0,0]=4 6500 B11R1.180 CCCCNc1nocc1C 065ab1e17090326b3c85284219b76705 [0,1,0,0,1,0|2,0,0]=4 6501 B11R1.180 CCCCNc1nocc1Cl 44ee7ec2e6485e04ba51ae487f687011 [0,1,0,0,1,0|2,0,0]=4 6502 B11R1.180 CCCCNc1sccc1C b5489a4a5937f782ef16c288eda79112 [0,1,0,0,1,0|2,0,0]=4 6503 B11R1.180 CCCCOc1cccn1C 3d38f62a78a4cbc2c835f47b4346f2ef [0,1,0,0,1,0|1,0,1]=4 6504 B11R1.180 CCCCOc1n[nH]cc1C d551e90f05828ee4d91f21c89b6873b8 [0,1,0,0,1,0|2,0,0]=4 6505 B11R1.180 CCCCOc1nocc1Br cbadb420499f590ec85174555cc5232e [0,1,0,0,1,0|2,0,0]=4 6506 B11R1.180 CCCNCc1cccn1C 03b7e0880aeb897b9c2d7fe9e6746740 [0,1,0,0,1,0|1,0,1]=4 6507 B11R1.180 CCCNCc1ccoc1C 9b7aca05722c487e12991f3dd96e11a5 [0,1,0,0,1,0|2,0,0]=4 6508 B11R1.180 CCCNCc1ccsc1Br d092f3e072c3bd8ab8f486594492dbe0 [0,1,0,0,1,0|2,0,0]=4 6509 B11R1.180 CCCNCc1ccsc1Cl c8e070f7ec2a3db227d0b6fffeb2259d [0,1,0,0,1,0|2,0,0]=4 6510 B11R1.180 CCCNCc1cscc1Br 4cf8c2a9a4ae8c4f4d053b97947a6837 [0,1,0,0,1,0|2,0,0]=4 6511 B11R1.180 CCCNCc1nc[nH]c1C b4ee81087d6d861bb39eaf8e0b9fec16 [0,1,0,0,1,0|2,0,0]=4 6512 B11R1.180 CCCNCc1nccn1C 4479098bc245238d7dc7535061a654ad [0,1,0,0,1,0|2,0,0]=4 6513 B11R1.180 CCCNCc1ncoc1C 6d29ef65f19496e8aed372eb2d4a8834 [0,1,0,0,1,0|2,0,0]=4 6514 B11R1.180 CCCNCc1nocc1Br 742b4fc167536d1faf64f3cf06e68473 [0,1,0,0,1,0|2,0,0]=4 6515 B11R1.180 CCCNCc1nocc1C c7015796bee0a1e2a0234421490ebf3e [0,1,0,0,1,0|2,0,0]=4 6516 B11R1.180 CCCNCc1occc1C 297d9026c2421572c3fef990f3888ecd [0,1,0,0,1,0|2,0,0]=4 6517 B11R1.180 CCCNCc1sccc1Cl 52290cafa348a35fa89f82103244f875 [0,1,0,0,1,0|2,0,0]=4 6518 B11R1.180 CCCNCc1sccc1F 76b49f5e835c9d92fa7b1908f5dfcb84 [0,1,0,0,1,0|2,0,0]=4 6519 B11R1.180 CCCOCc1cccn1C 3f039c6ca2029fab4442f6776b28e5ad [0,1,0,0,1,0|1,0,1]=4 6520 B11R1.180 CCCOCc1ccoc1C b1737bdc651811f3eec4c295512263cc [0,1,0,0,1,0|2,0,0]=4 6521 B11R1.180 CCCOCc1ccsc1Br 985f21b203d9feec00e11ab57362f21f [0,1,0,0,1,0|2,0,0]=4 6522 B11R1.180 CCCOCc1ccsc1Cl 9dca3ad0cb6ff71b2def9c016a36a893 [0,1,0,0,1,0|2,0,0]=4 6523 B11R1.180 CCCOCc1cscc1Br 87be15136ba1e6d5f2715e4b3aa7a154 [0,1,0,0,1,0|2,0,0]=4 6524 B11R1.180 CCCOCc1cscc1C 0f70923c664481648ce69b60291255fb [0,1,0,0,1,0|2,0,0]=4 6525 B11R1.180 CCCOCc1n[nH]cc1C 469c820b236225663207dbaa02fe3824 [0,1,0,0,1,0|2,0,0]=4 6526 B11R1.180 CCCOCc1nc[nH]c1C 85b1c42f98bee0f5c3b0b32c335c2ac6 [0,1,0,0,1,0|2,0,0]=4 6527 B11R1.180 CCCOCc1nccn1C 831aca6c043a8623af8ff182c95ad1bb [0,1,0,0,1,0|2,0,0]=4 6528 B11R1.180 CCCOCc1ncoc1C 8aa4d87f3069c06b031eec5ba6b30f14 [0,1,0,0,1,0|2,0,0]=4 6529 B11R1.180 CCCOCc1ncsc1C acc9fcff4d686116621f10969b0f707e [0,1,0,0,1,0|2,0,0]=4 6530 B11R1.180 CCCOCc1nocc1Br 76393566b6bdb7223e459730ab01dfec [0,1,0,0,1,0|2,0,0]=4 6531 B11R1.180 CCCOCc1occc1Br 1779a7ddf8d77a2508c40f71cd8fc904 [0,1,0,0,1,0|2,0,0]=4 6532 B11R1.180 CCCOCc1occc1C 41560230818bf69c71c16c988d078fb0 [0,1,0,0,1,0|2,0,0]=4 6533 B11R1.180 CCCOCc1sccc1C f1db515b4bc7ba1569929001c68c4beb [0,1,0,0,1,0|2,0,0]=4 6534 B11R1.180 CCCOCc1sccc1Cl 9369e937fdfc0c62e125fe9845877ec8 [0,1,0,0,1,0|2,0,0]=4 6535 B11R1.180 CCCOCc1sccc1F 934b573ad8d684c5de9c7979cee21a04 [0,1,0,0,1,0|2,0,0]=4 6536 B11R1.180 CCNCCc1cccn1C d1e7ad57dcb275b0808266493147da16 [0,1,0,0,1,0|1,0,1]=4 6537 B11R1.180 CCNCCc1nccn1C 4b537936d3c0d5eff5e6e8155e19dea8 [0,1,0,0,1,0|2,0,0]=4 6538 B11R1.180 CCNCCc1sccc1C e5d25d38d1fd0f601f4e275056cd9808 [0,1,0,0,1,0|2,0,0]=4 6539 B11R1.180 CCOCCc1cccn1C dda7e85aa0dab40e84f600f0563a4e9a [0,1,0,0,1,0|1,0,1]=4 6540 B11R1.180 CCOCCc1nccn1C 02b9637cbe3cd1b39c70cc9a39f6793e [0,1,0,0,1,0|2,0,0]=4 6541 B11R1.180 CCOCCc1ncsc1C 7967d2d240fa0f0a1e9238e41e3edf4f [0,1,0,0,1,0|2,0,0]=4 6542 B13R1.34 CCCCNc1cccccc1=O c3d0162233aff8b5143be9918d7b08f4 [0,1,0,0,0,1|2,0,0]=4 6543 B13R1.34 CCCCOc1cccccc1=O d3e8b081ca78939a2f4372df527ca28b [0,1,0,0,0,1|2,0,0]=4 6544 B13R1.9 BrCCNCCc1ccc(cc1)Br dc1f79b73091dda0edf2e0ff27e551aa [0,2,0,0,0,0|2,0,0]=4 6545 B13R1.9 BrCCNCCc1ccc(cc1)I 3e1ad6c64363cd4946369220385f861d [0,2,0,0,0,0|2,0,0]=4 6546 B13R1.9 Brc1ccc(cc1)CCNCCI 0c7664e9db61a285d538084c540d9f07 [0,2,0,0,0,0|2,0,0]=4 6547 B13R1.9 C#CCCCNc1ccc(cn1)Br 11a41535b30f5a377342d69514aae3d9 [0,2,0,0,0,0|0,0,2]=4 6548 B13R1.9 C#CCCCNc1ccc(cn1)C c341f30a8edd014ecf7cd6d2000f912d [0,2,0,0,0,0|0,0,2]=4 6549 B13R1.9 C#CCCCNc1ccc(cn1)Cl 267f9ef5cb3229964b863053a63c126c [0,2,0,0,0,0|0,0,2]=4 6550 B13R1.9 C#CCCCNc1ccc(cn1)F ed9a86876a77be0a32d099f47e123232 [0,2,0,0,0,0|0,0,2]=4 6551 B13R1.9 C#CCCCNc1ccc(cn1)I 5c1a47623e4dd8f22aeb12983e762e09 [0,2,0,0,0,0|0,0,2]=4 6552 B13R1.9 C#CCCCOc1ccc(cn1)C 17b371ed1fb405c6500c772004bd1516 [0,2,0,0,0,0|0,0,2]=4 6553 B13R1.9 C#CCCCOc1ccc(cn1)Cl 902ac6a3d467c6c92a8758cb73371421 [0,2,0,0,0,0|0,0,2]=4 6554 B13R1.9 C#CCCCOc1ccc(cn1)F 79571b4ab1cb228c01219c67bc8e49bd [0,2,0,0,0,0|0,0,2]=4 6555 B13R1.9 C#CCCCOc1ccc(cn1)I 5fc4c946073151973293e2dbd717ea82 [0,2,0,0,0,0|0,0,2]=4 6556 B13R1.9 C#CCCNCc1ccc(cn1)Br 901b6d66ac0980d70a9a53b6e2ac823c [0,2,0,0,0,0|0,0,2]=4 6557 B13R1.9 C#CCCNCc1ccc(cn1)C 1c7dd5b22611630d74bd82c560c4260e [0,2,0,0,0,0|0,0,2]=4 6558 B13R1.9 C#CCCNCc1ccc(cn1)Cl 3dda7dc635bcd3748f45c6dffdef731f [0,2,0,0,0,0|0,0,2]=4 6559 B13R1.9 C#CCCNCc1ccc(cn1)F 27c313efce525c4f5cb289b0ce2dfe67 [0,2,0,0,0,0|0,0,2]=4 6560 B13R1.9 C#CCCOCc1ccc(cn1)Br d1d484f8e0dd21e34dd90767d2e5e26b [0,2,0,0,0,0|0,0,2]=4 6561 B13R1.9 C#CCCOCc1ccc(cn1)C cbf0785cb03697239666281c3576a3da [0,2,0,0,0,0|0,0,2]=4 6562 B13R1.9 C#CCCOCc1ccc(cn1)Cl 67d6583558be549029e2f85be98a0c4d [0,2,0,0,0,0|0,0,2]=4 6563 B13R1.9 C#CCCOCc1ccc(cn1)F 97dd72eace0f88a4ae13782629bbf901 [0,2,0,0,0,0|0,0,2]=4 6564 B13R1.9 C#CCCOCc1ccc(cn1)I 29b5d076df65365d5e44fe2d7f3da23f [0,2,0,0,0,0|0,0,2]=4 6565 B13R1.9 C#CCNCCc1ccc(cn1)Br 9db79d5390810f01f7722d64e3f29126 [0,2,0,0,0,0|0,0,2]=4 6566 B13R1.9 C#CCOCCc1ccc(cn1)Br 2836a9fad8ade26487ce5f1cd778f167 [0,2,0,0,0,0|0,0,2]=4 6567 B13R1.9 C#CCOCCc1ccc(cn1)C 9fdfda693b599fe48ba90a8b8452fddf [0,2,0,0,0,0|0,0,2]=4 6568 B13R1.9 C#CCOCCc1ccc(cn1)F 489660e8fa9ed0bab4cfe1399f240384 [0,2,0,0,0,0|0,0,2]=4 6569 B13R1.9 C/C=C/CNCc1ccc(cn1)Br 4ca1fe7237afafca5c9db7a04940637e [0,2,0,0,0,0|0,0,2]=4 6570 B13R1.9 C/C=C/CNCc1ccc(cn1)C 4cbc1df2c176526ce5483d29c661667b [0,2,0,0,0,0|0,0,2]=4 6571 B13R1.9 C/C=C/CNCc1ccc(cn1)Cl 1c78cb66f63c5af9842a2c5a7fc8f2f4 [0,2,0,0,0,0|0,0,2]=4 6572 B13R1.9 C/C=C/CNCc1ccc(cn1)F 1054f5dbf7449c90eb761fc0959a7368 [0,2,0,0,0,0|0,0,2]=4 6573 B13R1.9 C/C=C/COCc1ccc(cn1)Br 1af671213624017ca70659719725f177 [0,2,0,0,0,0|0,0,2]=4 6574 B13R1.9 C/C=C/COCc1ccc(cn1)C 47ba726a7434bf5d15bac6c424710a2d [0,2,0,0,0,0|0,0,2]=4 6575 B13R1.9 C/C=C/COCc1ccc(cn1)Cl 5ead3fe5248beb0129aa9b17467d60ab [0,2,0,0,0,0|0,0,2]=4 6576 B13R1.9 C/C=C/COCc1ccc(cn1)F 57991857c64f22d3ad2f990e5412d0a9 [0,2,0,0,0,0|0,0,2]=4 6577 B13R1.9 C/C=C/COCc1ccc(cn1)I 0726dd2aeb1800c4236217641382826b [0,2,0,0,0,0|0,0,2]=4 6578 B13R1.9 C/C=C\CNCc1ccc(cn1)Br 4ec66575d96b528f3ff10e22e35a21db [0,2,0,0,0,0|0,0,2]=4 6579 B13R1.9 C/C=C\CNCc1ccc(cn1)C 05153eac704679524b4312f488029a1d [0,2,0,0,0,0|0,0,2]=4 6580 B13R1.9 C/C=C\CNCc1ccc(cn1)Cl 22abec2e8597d9444cf0de74f0d04033 [0,2,0,0,0,0|0,0,2]=4 6581 B13R1.9 C/C=C\CNCc1ccc(cn1)F 1b1543e6bf7bf22a8c76bafcfcbc3955 [0,2,0,0,0,0|0,0,2]=4 6582 B13R1.9 C/C=C\COCc1ccc(cn1)Br 4546c5ae93981e2d0c4b0ab9661c9fa2 [0,2,0,0,0,0|0,0,2]=4 6583 B13R1.9 C/C=C\COCc1ccc(cn1)C bd1b4d0f667c842e396cffc17a1001ce [0,2,0,0,0,0|0,0,2]=4 6584 B13R1.9 C/C=C\COCc1ccc(cn1)Cl f8ce96f05042844e48f0546bc376279c [0,2,0,0,0,0|0,0,2]=4 6585 B13R1.9 C/C=C\COCc1ccc(cn1)F 3ccbcf09e996278480879a72555f885c [0,2,0,0,0,0|0,0,2]=4 6586 B13R1.9 C/C=C\COCc1ccc(cn1)I 07207a004485ed7e4e822ac566b6fa1f [0,2,0,0,0,0|0,0,2]=4 6587 B13R1.9 C=CCCCNc1ccc(cn1)Br 8ab2d082113490245f6e885bf94e8d44 [0,2,0,0,0,0|0,0,2]=4 6588 B13R1.9 C=CCCCNc1ccc(cn1)C 5a6c65f3744dace4b5cdc08257ff11d0 [0,2,0,0,0,0|0,0,2]=4 6589 B13R1.9 C=CCCCNc1ccc(cn1)Cl b04ec6363e7a21dc3ad38119bc4e53c9 [0,2,0,0,0,0|0,0,2]=4 6590 B13R1.9 C=CCCCNc1ccc(cn1)F 402b8e2eb6cbd041f961659cfd0ac9d9 [0,2,0,0,0,0|0,0,2]=4 6591 B13R1.9 C=CCCCNc1ccc(cn1)I c543622b3da6a83e21ef08678e0f1667 [0,2,0,0,0,0|0,0,2]=4 6592 B13R1.9 C=CCCCNc1ccc(cn1)O 5122f587dec82c095fa934c376785f8d [0,2,0,0,0,0|0,0,2]=4 6593 B13R1.9 C=CCCCNc1ccc(cn1)S 5640eb29913673d94ed2694bb0f7e826 [0,2,0,0,0,0|0,0,2]=4 6594 B13R1.9 C=CCCCOc1ccc(cn1)C 88c4e00ddcb18c8ac84308cfb54b811f [0,2,0,0,0,0|0,0,2]=4 6595 B13R1.9 C=CCCCOc1ccc(cn1)Cl c04601a1d9cae501e0c0da8cfcb2dea0 [0,2,0,0,0,0|0,0,2]=4 6596 B13R1.9 C=CCCCOc1ccc(cn1)F 0971bce5f83b7d1bed381a4388ac7149 [0,2,0,0,0,0|0,0,2]=4 6597 B13R1.9 C=CCCCOc1ccc(cn1)I f8827e9c1115d2591097d6ff0f5ec9e7 [0,2,0,0,0,0|0,0,2]=4 6598 B13R1.9 C=CCCNCc1ccc(cn1)Br 2ac649762730cb79e51eabd120fd9ea2 [0,2,0,0,0,0|0,0,2]=4 6599 B13R1.9 C=CCCNCc1ccc(cn1)C be6e818724c3328980976a341315c92c [0,2,0,0,0,0|0,0,2]=4 6600 B13R1.9 C=CCCNCc1ccc(cn1)Cl 33e0bbde1361faa909038bfd4aaa3a02 [0,2,0,0,0,0|0,0,2]=4 6601 B13R1.9 C=CCCNCc1ccc(cn1)F 0f33e3124e5d83f9271bb8c91ebe41f3 [0,2,0,0,0,0|0,0,2]=4 6602 B13R1.9 C=CCCOCc1ccc(cn1)Br 1a447dbc349e81e6fd013c17eddab416 [0,2,0,0,0,0|0,0,2]=4 6603 B13R1.9 C=CCCOCc1ccc(cn1)C fdd0b901fe25496cf6ac443fad2d01b4 [0,2,0,0,0,0|0,0,2]=4 6604 B13R1.9 C=CCCOCc1ccc(cn1)Cl 16e4c35e2f1dcb31f675dbb41c8c7a51 [0,2,0,0,0,0|0,0,2]=4 6605 B13R1.9 C=CCCOCc1ccc(cn1)F 9d71c12fa80f243adae7496166c4f7d5 [0,2,0,0,0,0|0,0,2]=4 6606 B13R1.9 C=CCCOCc1ccc(cn1)I b65addd2ae5558ac1f5da58b3c5dbade [0,2,0,0,0,0|0,0,2]=4 6607 B13R1.9 C=CCNCCc1ccc(cn1)Br 0933c4720d0c29b5b72b791405a36e33 [0,2,0,0,0,0|0,0,2]=4 6608 B13R1.9 C=CCOCCc1ccc(cn1)Br c25a2c5040dbca8ea1da6a8caf53aa09 [0,2,0,0,0,0|0,0,2]=4 6609 B13R1.9 C=CCOCCc1ccc(cn1)C a8de36021bedce0f8c39440026d1a1b9 [0,2,0,0,0,0|0,0,2]=4 6610 B13R1.9 C=CCOCCc1ccc(cn1)F ec51b2e20eb0ec4d77ec6b69ce055d09 [0,2,0,0,0,0|0,0,2]=4 6611 B13R1.9 CC#CCNCc1ccc(cn1)Cl 324d01514358d955dfe7437624f7ec05 [0,2,0,0,0,0|0,0,2]=4 6612 B13R1.9 CC#CCNCc1ccc(cn1)F b93356f4cf617e351a72526d013b8b75 [0,2,0,0,0,0|0,0,2]=4 6613 B13R1.9 CC#CCOCc1ccc(cn1)C 63e4985ba021f472376443ff3931d18a [0,2,0,0,0,0|0,0,2]=4 6614 B13R1.9 CC#CCOCc1ccc(cn1)Cl ccd0dfe291ef5e9c5a0cff347f3480d1 [0,2,0,0,0,0|0,0,2]=4 6615 B13R1.9 CC#CCOCc1ccc(cn1)F 0251723688fe1d7921a3f29107ea8c97 [0,2,0,0,0,0|0,0,2]=4 6616 B13R1.9 CC/C=C/CNc1ccc(cn1)Br b50d0c13fe9a67037437a04960e3b23b [0,2,0,0,0,0|0,0,2]=4 6617 B13R1.9 CC/C=C/CNc1ccc(cn1)C c3659bab3729ce3a4c812d4d936098b9 [0,2,0,0,0,0|0,0,2]=4 6618 B13R1.9 CC/C=C/CNc1ccc(cn1)Cl 4c25fd12f816993e533e071d304df6d5 [0,2,0,0,0,0|0,0,2]=4 6619 B13R1.9 CC/C=C/CNc1ccc(cn1)F 724cfaf10c1b79ac60ed164a4521817d [0,2,0,0,0,0|0,0,2]=4 6620 B13R1.9 CC/C=C/CNc1ccc(cn1)I 51defa6d271bd15a7b764d2ef81674e2 [0,2,0,0,0,0|0,0,2]=4 6621 B13R1.9 CC/C=C/COc1ccc(cn1)C dcc035309d34a36f181760678a976442 [0,2,0,0,0,0|0,0,2]=4 6622 B13R1.9 CC/C=C/COc1ccc(cn1)Cl 6e07bdf9cb606a2d45faed466090694c [0,2,0,0,0,0|0,0,2]=4 6623 B13R1.9 CC/C=C/COc1ccc(cn1)F fdd560dc37217f08341cfbf4021069da [0,2,0,0,0,0|0,0,2]=4 6624 B13R1.9 CC/C=C/COc1ccc(cn1)I 7557d89ecc47c952c5935e39f6059973 [0,2,0,0,0,0|0,0,2]=4 6625 B13R1.9 CC=CCNCc1ccc(cn1)Br 856a679773846fdf8b81f1141ae61bf6 [0,2,0,0,0,0|0,0,2]=4 6626 B13R1.9 CC=CCNCc1ccc(cn1)C b346074640bf006314b1af25e0cd5b19 [0,2,0,0,0,0|0,0,2]=4 6627 B13R1.9 CC=CCNCc1ccc(cn1)Cl a20f39bbe3b6473c896a74a27b5ed14c [0,2,0,0,0,0|0,0,2]=4 6628 B13R1.9 CC=CCNCc1ccc(cn1)F 000a7ed8ea15cde2737f8266e0531a53 [0,2,0,0,0,0|0,0,2]=4 6629 B13R1.9 CC=CCOCc1ccc(cn1)Br c748f3503b4a37aa5fca137ce90bcaaf [0,2,0,0,0,0|0,0,2]=4 6630 B13R1.9 CC=CCOCc1ccc(cn1)C 083ecee28b8b04bc30f150c4b39fa4ee [0,2,0,0,0,0|0,0,2]=4 6631 B13R1.9 CC=CCOCc1ccc(cn1)Cl b642f882ea9ba911d01ede23cb61b8c9 [0,2,0,0,0,0|0,0,2]=4 6632 B13R1.9 CC=CCOCc1ccc(cn1)F c9dec793f41b03404eaef252984d1ea4 [0,2,0,0,0,0|0,0,2]=4 6633 B13R1.9 CCC#CCNc1ccc(cn1)C a2b6423cefa83f2e9306c1118c1257b0 [0,2,0,0,0,0|0,0,2]=4 6634 B13R1.9 CCCCCNc1c[nH]c(=S)cn1 12782eea5b2a687b7667c514d3ff80e1 [0,2,0,0,0,0|1,0,0]=3 6635 B13R1.9 CCCCCNc1ccc(=O)[nH]c1 3081ffed58e5fa8f287d7f0217fa2f41 [0,2,0,0,0,0|2,0,0]=4 6636 B13R1.9 CCCCCNc1ccc(=O)[nH]n1 6cdbf5e6e8992a8a51b505be1c51e075 [0,2,0,0,0,0|1,0,0]=3 6637 B13R1.9 CCCCCNc1ccc(=O)oc1 f21a24503753d556853d7949ad2707fa [0,2,0,0,0,0|2,0,0]=4 6638 B13R1.9 CCCCCNc1ccc(cc1)Br 399b0f12784e8ff727bb98cdf988d048 [0,2,0,0,0,0|1,0,0]=3 6639 B13R1.9 CCCCCNc1ccc(cc1)C c622af99ca34ba4e41e61a6b93c4c307 [0,2,0,0,0,0|1,0,0]=3 6640 B13R1.9 CCCCCNc1ccc(cc1)Cl db2701f3eddf0ed4d7ba9133e6da10ff [0,2,0,0,0,0|1,0,0]=3 6641 B13R1.9 CCCCCNc1ccc(cc1)F 580f8bb5934a0a51217dc0ae3e85a1ac [0,2,0,0,0,0|1,0,0]=3 6642 B13R1.9 CCCCCNc1ccc(cc1)I ab59d873e6fbc39e64d1a325bde97e68 [0,2,0,0,0,0|1,0,0]=3 6643 B13R1.9 CCCCCNc1ccc(cc1)S 0a65ff485ece4fef685f5a0d88dd465b [0,2,0,0,0,0|1,0,0]=3 6644 B13R1.9 CCCCCNc1ccc(cn1)Br ca00e79073f5812f64fa485e00bb6929 [0,2,0,0,0,0|0,0,0]=2 6645 B13R1.9 CCCCCNc1ccc(cn1)C 9ff7d7b1eb16d3b1908bb1c1250ba318 [0,2,0,0,0,0|0,0,0]=2 6646 B13R1.9 CCCCCNc1ccc(cn1)Cl 820cd6fb18f8963a3d4c8a75e542ebdb [0,2,0,0,0,0|0,0,0]=2 6647 B13R1.9 CCCCCNc1ccc(cn1)F e0dd66a531613300972a4cb104aa53ee [0,2,0,0,0,0|0,0,0]=2 6648 B13R1.9 CCCCCNc1ccc(cn1)I 73649e720a8c571b3e8824b552f6fc04 [0,2,0,0,0,0|0,0,0]=2 6649 B13R1.9 CCCCCNc1ccc(nc1)Br 7ae40037d35b7e6a221644d46583219f [0,2,0,0,0,0|2,0,0]=4 6650 B13R1.9 CCCCCNc1ccc(nc1)C 975f64ba0203d07e4f6d9bf77d97f65b [0,2,0,0,0,0|2,0,0]=4 6651 B13R1.9 CCCCCNc1ccc(nc1)Cl 5273f8a1d57829412dc545eae85bdb1f [0,2,0,0,0,0|2,0,0]=4 6652 B13R1.9 CCCCCNc1ccc(nc1)F 4f6b82e158dc1e37660180121544b7ff [0,2,0,0,0,0|2,0,0]=4 6653 B13R1.9 CCCCCNc1ccc(nc1)I dfec896adb8bf3ec0e246314a101beb4 [0,2,0,0,0,0|2,0,0]=4 6654 B13R1.9 CCCCCNc1ccc(nn1)Br d89a7a9265714c4938fc965128444be9 [0,2,0,0,0,0|1,0,0]=3 6655 B13R1.9 CCCCCNc1ccc(nn1)C d7375583f1068c93d73391d8cf94a9da [0,2,0,0,0,0|1,0,0]=3 6656 B13R1.9 CCCCCNc1ccc(nn1)Cl 67db9b89f4a3fbe77c5009c8b3e74587 [0,2,0,0,0,0|1,0,0]=3 6657 B13R1.9 CCCCCNc1ccc(nn1)F fb4c30f6b2dfb4240e1cbf1e219b772f [0,2,0,0,0,0|1,0,0]=3 6658 B13R1.9 CCCCCNc1ccc(nn1)I c67a40bc2b5572532b3f39d83da03e03 [0,2,0,0,0,0|1,0,0]=3 6659 B13R1.9 CCCCCNc1cnc(cn1)Br 10db0adc3a06ac1cc8af57911169d75e [0,2,0,0,0,0|1,0,0]=3 6660 B13R1.9 CCCCCNc1cnc(cn1)C 699dc4ffcca085f9cb762ba45de7c780 [0,2,0,0,0,0|1,0,0]=3 6661 B13R1.9 CCCCCNc1cnc(cn1)Cl f07834f9d1c52a306d183baa1b861b8c [0,2,0,0,0,0|1,0,0]=3 6662 B13R1.9 CCCCCNc1cnc(cn1)I 09ca2cbecf8157183babc64ae8ee3407 [0,2,0,0,0,0|1,0,0]=3 6663 B13R1.9 CCCCCNc1ncc(cn1)Br 88389c785c3088937f618c05f9b5a0ab [0,2,0,0,0,0|1,0,0]=3 6664 B13R1.9 CCCCCNc1ncc(cn1)C 6dad1551fae7a2e59f5a62ad1d302cdd [0,2,0,0,0,0|1,0,0]=3 6665 B13R1.9 CCCCCNc1ncc(cn1)Cl 61cb78de11809b2f0661e61dc82d73f4 [0,2,0,0,0,0|1,0,0]=3 6666 B13R1.9 CCCCCNc1ncc(cn1)F 9a24104f841132121c6387b6d85488c8 [0,2,0,0,0,0|1,0,0]=3 6667 B13R1.9 CCCCCNc1ncc(cn1)I 3056e50bdcc50f80c7f9bf9d37eb9aac [0,2,0,0,0,0|1,0,0]=3 6668 B13R1.9 CCCCCNc1ncc(nn1)Br 09be090d96eadf827cacc9478f5feba3 [0,2,0,0,0,0|2,0,0]=4 6669 B13R1.9 CCCCCOc1ccc(cc1)Br 029cd0cc79a1ab8ad9fa2c31d08758e6 [0,2,0,0,0,0|1,0,0]=3 6670 B13R1.9 CCCCCOc1ccc(cc1)C b8d8eb65ed8e49868e6f5572f0279b89 [0,2,0,0,0,0|1,0,0]=3 6671 B13R1.9 CCCCCOc1ccc(cc1)Cl 74195c4ec29889be299aa552247700eb [0,2,0,0,0,0|1,0,0]=3 6672 B13R1.9 CCCCCOc1ccc(cc1)F 603ee5ed5ce4e8a76e547a9cdf21fae2 [0,2,0,0,0,0|1,0,0]=3 6673 B13R1.9 CCCCCOc1ccc(cc1)I 457ce6ee24951885a241a6716715e0e5 [0,2,0,0,0,0|1,0,0]=3 6674 B13R1.9 CCCCCOc1ccc(cc1)S b2a1fec7d3eac64f721c19664d4dafee [0,2,0,0,0,0|1,0,0]=3 6675 B13R1.9 CCCCCOc1ccc(cn1)C 28b26552b3eff7270aee573b707fb0d6 [0,2,0,0,0,0|0,0,0]=2 6676 B13R1.9 CCCCCOc1ccc(cn1)Cl 09f5c81fba5bd06524c41f0d678ebdf4 [0,2,0,0,0,0|0,0,0]=2 6677 B13R1.9 CCCCCOc1ccc(cn1)F 7fc79397821740d441fdf6b0cd75d7dc [0,2,0,0,0,0|0,0,0]=2 6678 B13R1.9 CCCCCOc1ccc(cn1)I 328a1d281a53e68fc02c97f841380255 [0,2,0,0,0,0|0,0,0]=2 6679 B13R1.9 CCCCCOc1ccc(nc1)Br 4e7298b4918411165ea3c3e321da35bf [0,2,0,0,0,0|2,0,0]=4 6680 B13R1.9 CCCCCOc1ccc(nc1)C b15c5deff7c7c5c811754be6b62ef0fc [0,2,0,0,0,0|2,0,0]=4 6681 B13R1.9 CCCCCOc1ccc(nc1)Cl 586c175fe0e57c057f0715c573c7002c [0,2,0,0,0,0|2,0,0]=4 6682 B13R1.9 CCCCCOc1ccc(nc1)F 3b193c1281c0c7a6cac003790209cb86 [0,2,0,0,0,0|2,0,0]=4 6683 B13R1.9 CCCCCOc1ccc(nc1)I a2f798208101424112f3eeaaefe2763b [0,2,0,0,0,0|2,0,0]=4 6684 B13R1.9 CCCCCOc1ccc(nn1)Br 46277397138a6e1add4f95385f0b2022 [0,2,0,0,0,0|1,0,0]=3 6685 B13R1.9 CCCCCOc1ccc(nn1)C dc9170ba4956809a13c4a1259f0d5a87 [0,2,0,0,0,0|1,0,0]=3 6686 B13R1.9 CCCCCOc1ccc(nn1)Cl f0f8dc36cf434e4e6c513159cf6207fc [0,2,0,0,0,0|1,0,0]=3 6687 B13R1.9 CCCCCOc1cnc(cn1)Br a551a7262adbcf6899428355d549eb93 [0,2,0,0,0,0|1,0,0]=3 6688 B13R1.9 CCCCCOc1cnc(cn1)C 448f431ca3eebbff7112e8c365493b4f [0,2,0,0,0,0|1,0,0]=3 6689 B13R1.9 CCCCCOc1cnc(cn1)Cl 4999f72fdf098e27d0270c2d9428832d [0,2,0,0,0,0|1,0,0]=3 6690 B13R1.9 CCCCCOc1cnc(cn1)I 6df7f8192df547bf9dfb3b9c2f867128 [0,2,0,0,0,0|1,0,0]=3 6691 B13R1.9 CCCCCOc1ncc(cn1)Br 12986782b56d2721c1f9cbec5da82678 [0,2,0,0,0,0|1,0,0]=3 6692 B13R1.9 CCCCCOc1ncc(cn1)C f74e3a94cda19f51e063bf6726802702 [0,2,0,0,0,0|1,0,0]=3 6693 B13R1.9 CCCCCOc1ncc(cn1)F a517f741baba0d758250969218b9c17d [0,2,0,0,0,0|1,0,0]=3 6694 B13R1.9 CCCCCOc1ncc(cn1)I 8d66da7b8ecd3af5183abdfce9fbeb05 [0,2,0,0,0,0|1,0,0]=3 6695 B13R1.9 CCCCNCc1ccc(=O)[nH]c1 412d655003ea71ad4c39730048d40131 [0,2,0,0,0,0|2,0,0]=4 6696 B13R1.9 CCCCNCc1ccc(cc1)Br 6be3ff65bd78e011c4697fdb55b3d3bc [0,2,0,0,0,0|1,0,0]=3 6697 B13R1.9 CCCCNCc1ccc(cc1)C 61d2f2df358fe5c87708cf31eef18999 [0,2,0,0,0,0|1,0,0]=3 6698 B13R1.9 CCCCNCc1ccc(cc1)Cl 532ed9771f230554e3940963ba542481 [0,2,0,0,0,0|1,0,0]=3 6699 B13R1.9 CCCCNCc1ccc(cc1)F 72d8d34d1589f04d6b6eb7fc7d4991a3 [0,2,0,0,0,0|1,0,0]=3 6700 B13R1.9 CCCCNCc1ccc(cc1)I f9a5a5ef97ac92e50da6e08610790175 [0,2,0,0,0,0|1,0,0]=3 6701 B13R1.9 CCCCNCc1ccc(cn1)Br 015dd44af612256026ac0dfea0939c42 [0,2,0,0,0,0|0,0,0]=2 6702 B13R1.9 CCCCNCc1ccc(cn1)C d154b14d7b7492b90118ae47abd21fa2 [0,2,0,0,0,0|0,0,0]=2 6703 B13R1.9 CCCCNCc1ccc(cn1)Cl 83ad535a28fe27a88e1a5f66ba204b40 [0,2,0,0,0,0|0,0,0]=2 6704 B13R1.9 CCCCNCc1ccc(cn1)F ab077402c1ba9c6e4308915bdbc4d1e6 [0,2,0,0,0,0|0,0,0]=2 6705 B13R1.9 CCCCNCc1ccc(nc1)Br 858a89caec7beb049ca5dfd2bd89ee15 [0,2,0,0,0,0|2,0,0]=4 6706 B13R1.9 CCCCNCc1ccc(nc1)C af34e2fd15d4b88559ab89c3303b966b [0,2,0,0,0,0|2,0,0]=4 6707 B13R1.9 CCCCNCc1ccc(nc1)Cl 100d36c7205b7c1499f82b2d5e376368 [0,2,0,0,0,0|2,0,0]=4 6708 B13R1.9 CCCCNCc1ccc(nc1)F aabed12f7874fc96b8f855d4b5d39ecb [0,2,0,0,0,0|2,0,0]=4 6709 B13R1.9 CCCCNCc1ccc(nn1)C 4f2ecfe628e84863785483a8dc500960 [0,2,0,0,0,0|1,0,0]=3 6710 B13R1.9 CCCCNCc1ccc(nn1)Cl c0ac5648679278bf36e396e7d1c00ae2 [0,2,0,0,0,0|1,0,0]=3 6711 B13R1.9 CCCCNCc1cnc(cn1)Br f59d5585b3fa1cf9e244655ad8375d40 [0,2,0,0,0,0|1,0,0]=3 6712 B13R1.9 CCCCNCc1cnc(cn1)C 91987eaf14416450916e9eea25847057 [0,2,0,0,0,0|1,0,0]=3 6713 B13R1.9 CCCCNCc1cnc(cn1)Cl f097a9b8cef969350a46279d91865444 [0,2,0,0,0,0|1,0,0]=3 6714 B13R1.9 CCCCNCc1ncc(cn1)Br 6e012239fc6093d82be73779ed8d3be8 [0,2,0,0,0,0|1,0,0]=3 6715 B13R1.9 CCCCNCc1ncc(cn1)C 8c51f91e4e10fea970ea584fde1dea38 [0,2,0,0,0,0|1,0,0]=3 6716 B13R1.9 CCCCNCc1ncc(cn1)Cl d1d1a615f42087bb51f069b220e9ccc5 [0,2,0,0,0,0|1,0,0]=3 6717 B13R1.9 CCCCNCc1ncc(cn1)F 863f44e7a2765249e2f2b0941eb789d3 [0,2,0,0,0,0|1,0,0]=3 6718 B13R1.9 CCCCOCc1cc[n+](cc1)[O-] 20a27f737a039828fb2c33e7139feeda [0,2,0,0,0,0|2,0,0]=4 6719 B13R1.9 CCCCOCc1ccc(cc1)Br 5da142724a48757229343a61d0e28c22 [0,2,0,0,0,0|1,0,0]=3 6720 B13R1.9 CCCCOCc1ccc(cc1)C 9d972268dbc6c9e7b5bab39c177f6884 [0,2,0,0,0,0|1,0,0]=3 6721 B13R1.9 CCCCOCc1ccc(cc1)Cl ee21c1e5711d042d515cb881885cd27a [0,2,0,0,0,0|1,0,0]=3 6722 B13R1.9 CCCCOCc1ccc(cc1)F 4014fce777d4fdaefec42789af28511e [0,2,0,0,0,0|1,0,0]=3 6723 B13R1.9 CCCCOCc1ccc(cc1)I b9752eaa0d07c9b76ec6622632ae04e5 [0,2,0,0,0,0|1,0,0]=3 6724 B13R1.9 CCCCOCc1ccc(cc1)S 97deb168cdab1682087031d4597564bb [0,2,0,0,0,0|1,0,0]=3 6725 B13R1.9 CCCCOCc1ccc(cn1)Br 6cd9965454a286129f1ca47d554491eb [0,2,0,0,0,0|0,0,0]=2 6726 B13R1.9 CCCCOCc1ccc(cn1)C 7d43ee4a6453e32e9698c33f3da2f91e [0,2,0,0,0,0|0,0,0]=2 6727 B13R1.9 CCCCOCc1ccc(cn1)Cl bc19c3f41f9b1b521a71e337d8fcd52c [0,2,0,0,0,0|0,0,0]=2 6728 B13R1.9 CCCCOCc1ccc(cn1)F 50b90e8c4bdeeec9ebb470f7246a1aa0 [0,2,0,0,0,0|0,0,0]=2 6729 B13R1.9 CCCCOCc1ccc(cn1)I 458e9dea1b0fb0d4811d2a4adccef1e4 [0,2,0,0,0,0|0,0,0]=2 6730 B13R1.9 CCCCOCc1ccc(nc1)Br 537e007a2b4b92b9bb18683608dc3c7a [0,2,0,0,0,0|2,0,0]=4 6731 B13R1.9 CCCCOCc1ccc(nc1)C e3d50101525964788a51aec1d89ecdf7 [0,2,0,0,0,0|2,0,0]=4 6732 B13R1.9 CCCCOCc1ccc(nc1)Cl daa5450cd5e183549abca311a8f929ed [0,2,0,0,0,0|2,0,0]=4 6733 B13R1.9 CCCCOCc1ccc(nc1)F 73ec647fa6ab1a6b74228143ca688688 [0,2,0,0,0,0|2,0,0]=4 6734 B13R1.9 CCCCOCc1ccc(nn1)C 62a530a2f31b90fcbe512f9403a89150 [0,2,0,0,0,0|1,0,0]=3 6735 B13R1.9 CCCCOCc1ccc(nn1)Cl 29055cecda15fae079e4be5d5cb0dd8f [0,2,0,0,0,0|1,0,0]=3 6736 B13R1.9 CCCCOCc1cnc(cn1)Br e65745b801695eb5c7b830fc4f03e123 [0,2,0,0,0,0|1,0,0]=3 6737 B13R1.9 CCCCOCc1cnc(cn1)C af0c93b832ce1769885296aa5e7cd17e [0,2,0,0,0,0|1,0,0]=3 6738 B13R1.9 CCCCOCc1cnc(cn1)Cl 9fe4c377f994eebb321a186ef3eaed8b [0,2,0,0,0,0|1,0,0]=3 6739 B13R1.9 CCCCOCc1ncc(cn1)Br e0d3beacf82facbe5a0189859629e426 [0,2,0,0,0,0|1,0,0]=3 6740 B13R1.9 CCCCOCc1ncc(cn1)C 15c510bc673a5b4e4905c06bfc347316 [0,2,0,0,0,0|1,0,0]=3 6741 B13R1.9 CCCCOCc1ncc(cn1)Cl 3e79a58f05c880d73d675ec1d3741d7d [0,2,0,0,0,0|1,0,0]=3 6742 B13R1.9 CCCCOCc1ncc(cn1)F 3f681aec9fb4576c72174a5ea12d8f78 [0,2,0,0,0,0|1,0,0]=3 6743 B13R1.9 CCCNCCc1ccc(cc1)Br 3ed458e64dace58c0843403ea5a6680e [0,2,0,0,0,0|1,0,0]=3 6744 B13R1.9 CCCNCCc1ccc(cc1)C b11ec02550907f75df9a9da26de696e4 [0,2,0,0,0,0|1,0,0]=3 6745 B13R1.9 CCCNCCc1ccc(cc1)Cl a6065b37b44ad7d32a010e66c1cffb78 [0,2,0,0,0,0|1,0,0]=3 6746 B13R1.9 CCCNCCc1ccc(cc1)F 0971a593a144446fba2793714c32c21d [0,2,0,0,0,0|1,0,0]=3 6747 B13R1.9 CCCNCCc1ccc(cc1)I 39f63bbd6714703c6d32d4f8d9662ba9 [0,2,0,0,0,0|1,0,0]=3 6748 B13R1.9 CCCNCCc1ccc(cn1)Br a199c254429e70c9628f93851809cf86 [0,2,0,0,0,0|0,0,0]=2 6749 B13R1.9 CCCNCCc1ccc(nc1)Br 0acaa3a6788596ce537cd04c8a091e23 [0,2,0,0,0,0|2,0,0]=4 6750 B13R1.9 CCCNCCc1ccc(nc1)C a73f14e2082e97f13c99a704b18c9f9d [0,2,0,0,0,0|2,0,0]=4 6751 B13R1.9 CCCNCCc1ccc(nc1)Cl a2f6f6e88a550c8670722691f953b18b [0,2,0,0,0,0|2,0,0]=4 6752 B13R1.9 CCCNCSc1ccc(cc1)C 5f652e4a5e906db945c744820fa45f79 [0,2,0,0,0,0|2,0,0]=4 6753 B13R1.9 CCCNCSc1ccc(cc1)Cl 934d34b9f74607acde0cf04bd5e1f46e [0,2,0,0,0,0|2,0,0]=4 6754 B13R1.9 CCCOCCc1ccc(cc1)Br 71039672b78f8e8eee818f6dbd22c81d [0,2,0,0,0,0|1,0,0]=3 6755 B13R1.9 CCCOCCc1ccc(cc1)C b52b4ea49ccb764f28c79424db6a1a35 [0,2,0,0,0,0|1,0,0]=3 6756 B13R1.9 CCCOCCc1ccc(cc1)Cl d8c5fc05403e01504a875f2a38ffbd42 [0,2,0,0,0,0|1,0,0]=3 6757 B13R1.9 CCCOCCc1ccc(cc1)F 64995a6273f4823df22902e3631c71f3 [0,2,0,0,0,0|1,0,0]=3 6758 B13R1.9 CCCOCCc1ccc(cc1)I c347b694f040406c12df32eb2bbd0843 [0,2,0,0,0,0|1,0,0]=3 6759 B13R1.9 CCCOCCc1ccc(cn1)Br ed5abf8a5d102b75e1b59336bcca479c [0,2,0,0,0,0|0,0,0]=2 6760 B13R1.9 CCCOCCc1ccc(cn1)C dd9848dd2af9e4b9fe155435b2b71145 [0,2,0,0,0,0|0,0,0]=2 6761 B13R1.9 CCCOCCc1ccc(cn1)F 68f66371401b4aa5afea55d614c623a9 [0,2,0,0,0,0|0,0,0]=2 6762 B13R1.9 CCCOCCc1ccc(nc1)Br 7024af2d50a5892a041dbc5dc3031529 [0,2,0,0,0,0|2,0,0]=4 6763 B13R1.9 CCCOCCc1ccc(nc1)C ff487016f87b937710c4e17bc8b33416 [0,2,0,0,0,0|2,0,0]=4 6764 B13R1.9 CCCOCCc1ccc(nc1)Cl f673e373bafa7d5c75834886264a51f8 [0,2,0,0,0,0|2,0,0]=4 6765 B13R1.9 CCCOCCc1ccc(nc1)F e75c1c9c057d4b1a735bb35e7b77a3bc [0,2,0,0,0,0|2,0,0]=4 6766 B13R1.9 CCCOCCc1ncc(cn1)Br 2562a1d46d2d4456396eb2794989bd8f [0,2,0,0,0,0|1,0,0]=3 6767 B13R1.9 CCNCCCc1ccc(cc1)Br b2538e078528e7a991f230f2ef9be40e [0,2,0,0,0,0|1,0,0]=3 6768 B13R1.9 CCNCCCc1ccc(cc1)C 9d419320837ff4845b086ea38fe917b2 [0,2,0,0,0,0|1,0,0]=3 6769 B13R1.9 CCNCCCc1ccc(cc1)Cl ed4e9b0e62104a0f56cd18ca5fa4ab1d [0,2,0,0,0,0|1,0,0]=3 6770 B13R1.9 CCNCCCc1ccc(cc1)F 5d49bc24a3068a0ecf5741111c07eb61 [0,2,0,0,0,0|1,0,0]=3 6771 B13R1.9 CCNCCCc1ccc(nc1)C 8698087cc831e48c77cc0615ea03c7ba [0,2,0,0,0,0|2,0,0]=4 6772 B13R1.9 CCNCCOc1ccc(cc1)Br d237d7fd8ef8c6ad429116c73a6937a0 [0,2,0,0,0,0|2,0,0]=4 6773 B13R1.9 CCNCCOc1ccc(cc1)C 2613ffd63fd644937ca6766470fe8746 [0,2,0,0,0,0|2,0,0]=4 6774 B13R1.9 CCNCCOc1ccc(cc1)Cl ace8727646accd2d2ae1803297d2d63f [0,2,0,0,0,0|2,0,0]=4 6775 B13R1.9 CCNCCOc1ccc(cc1)F ecdbb83db0ad6f8f8c751eeda6a29ac8 [0,2,0,0,0,0|2,0,0]=4 6776 B13R1.9 CCNCCOc1ccc(cc1)I 2564795c701b3d0551253b3c5a1a71ad [0,2,0,0,0,0|2,0,0]=4 6777 B13R1.9 CCNCCOc1ccc(cn1)C 8b7c048f512d7dbef72b361ee885ada5 [0,2,0,0,0,0|1,0,0]=3 6778 B13R1.9 CCNCCSc1ccc(cc1)C ded207d323536b9ae5c103e0b245d884 [0,2,0,0,0,0|2,0,0]=4 6779 B13R1.9 CCNCCSc1ccc(cc1)Cl 36725975b5e1b09add7ee03a86a9f8b0 [0,2,0,0,0,0|2,0,0]=4 6780 B13R1.9 CCOCC#Cc1ccc(cn1)Br 7a8a16836ca92ed8e59b88f27d61636e [0,2,0,0,0,0|0,0,2]=4 6781 B13R1.9 CCOCCCc1cc[n+](cc1)[O-] 9252d1adde4c129bfd8d4f4a050722a5 [0,2,0,0,0,0|2,0,0]=4 6782 B13R1.9 CCOCCCc1ccc(cc1)Br 6618b83f240bcaaadd04967909ccc495 [0,2,0,0,0,0|1,0,0]=3 6783 B13R1.9 CCOCCCc1ccc(cc1)C fb6f8467226673699f4ea3c6ca3b4db0 [0,2,0,0,0,0|1,0,0]=3 6784 B13R1.9 CCOCCCc1ccc(cc1)Cl 2a1e91b904686b46764abf9239fbf4b6 [0,2,0,0,0,0|1,0,0]=3 6785 B13R1.9 CCOCCCc1ccc(cc1)F f0451a6ead50026cb49c3c7f50cc0c8e [0,2,0,0,0,0|1,0,0]=3 6786 B13R1.9 CCOCCCc1ccc(nc1)Br 56b2cda947b6194b3171d9ba373104ee [0,2,0,0,0,0|2,0,0]=4 6787 B13R1.9 CCOCCNc1c[nH]c(=S)cn1 f00dfc6450eed60400838e7db3f28c9e [0,2,0,0,0,0|2,0,0]=4 6788 B13R1.9 CCOCCNc1ccc(cc1)Br 3d72a80569197b4528594a6ded031854 [0,2,0,0,0,0|2,0,0]=4 6789 B13R1.9 CCOCCNc1ccc(cc1)C b67cff33f99b52e0e1ce5a47e774b2bc [0,2,0,0,0,0|2,0,0]=4 6790 B13R1.9 CCOCCNc1ccc(cc1)Cl 7368d4dad541952b1ee8181225f9b6a7 [0,2,0,0,0,0|2,0,0]=4 6791 B13R1.9 CCOCCNc1ccc(cc1)F b036962e9397dd0a452119cd5ef1fd5d [0,2,0,0,0,0|2,0,0]=4 6792 B13R1.9 CCOCCNc1ccc(cc1)I e99ee950a944d31c4109e51e1aa8ffca [0,2,0,0,0,0|2,0,0]=4 6793 B13R1.9 CCOCCNc1ccc(cc1)O 759a70d15994d423692088dc7b612467 [0,2,0,0,0,0|2,0,0]=4 6794 B13R1.9 CCOCCNc1ccc(cc1)S 700f3998d14dd1377037c268a5e80676 [0,2,0,0,0,0|2,0,0]=4 6795 B13R1.9 CCOCCNc1ccc(cn1)Br 28f3edb3d3259c13c5b91d4a31c5e069 [0,2,0,0,0,0|1,0,0]=3 6796 B13R1.9 CCOCCNc1ccc(cn1)C 23209ac49700ac47f1949781926fab21 [0,2,0,0,0,0|1,0,0]=3 6797 B13R1.9 CCOCCNc1ccc(cn1)Cl d3374f50ace1e903f71075c85fd6dd41 [0,2,0,0,0,0|1,0,0]=3 6798 B13R1.9 CCOCCNc1ccc(cn1)F 98d9af1caedb264acc88a10d15683f8b [0,2,0,0,0,0|1,0,0]=3 6799 B13R1.9 CCOCCNc1ccc(cn1)I 6c24340070130d9fb085e33ca59e4719 [0,2,0,0,0,0|1,0,0]=3 6800 B13R1.9 CCOCCNc1ccc(cn1)O aa6d7bda96f5988485b230d44c57b5ff [0,2,0,0,0,0|1,0,0]=3 6801 B13R1.9 CCOCCNc1ccc(cn1)S 8eb90ef43a91a923366b0f478dfdd19d [0,2,0,0,0,0|1,0,0]=3 6802 B13R1.9 CCOCCNc1ccc(nn1)Br a1df54df9dc07d95eeb72a532eea2fe2 [0,2,0,0,0,0|2,0,0]=4 6803 B13R1.9 CCOCCNc1ccc(nn1)C 13deef2d331f7262d3e77a8661bb6a6c [0,2,0,0,0,0|2,0,0]=4 6804 B13R1.9 CCOCCNc1ccc(nn1)Cl 6b364b32ce6767c14dc80d349df8e511 [0,2,0,0,0,0|2,0,0]=4 6805 B13R1.9 CCOCCNc1ccc(nn1)F b8565b77edc7c6cb77e9c6870d616c12 [0,2,0,0,0,0|2,0,0]=4 6806 B13R1.9 CCOCCNc1ccc(nn1)I 1290dc94262df48bfd6dd7cb354c07b5 [0,2,0,0,0,0|2,0,0]=4 6807 B13R1.9 CCOCCNc1ccc(nn1)O 05185e8479aa6f3797be997a79e1b97b [0,2,0,0,0,0|2,0,0]=4 6808 B13R1.9 CCOCCNc1ccc(nn1)S 16fd72abe2b5bc80bd328b99e87fa165 [0,2,0,0,0,0|2,0,0]=4 6809 B13R1.9 CCOCCNc1cnc(cn1)Br 665f8cb76ed68c62f49c11b29b081a9f [0,2,0,0,0,0|2,0,0]=4 6810 B13R1.9 CCOCCNc1cnc(cn1)C 2e28a8674d91592967eb489f75f360b8 [0,2,0,0,0,0|2,0,0]=4 6811 B13R1.9 CCOCCNc1cnc(cn1)Cl d506b234e5c30d737b15cd9a01c5e461 [0,2,0,0,0,0|2,0,0]=4 6812 B13R1.9 CCOCCNc1cnc(cn1)F 078c8a0387882d61c10cd29cca58ba24 [0,2,0,0,0,0|2,0,0]=4 6813 B13R1.9 CCOCCNc1cnc(cn1)I b08c9eb3d9328d86c9c6fa6033f3fc16 [0,2,0,0,0,0|2,0,0]=4 6814 B13R1.9 CCOCCNc1cnc(cn1)O 0ed831e32bef91f089ba0e151fe4a745 [0,2,0,0,0,0|2,0,0]=4 6815 B13R1.9 CCOCCNc1ncc(cn1)Br 02ae4ccb0d98f68deb6422861aff809d [0,2,0,0,0,0|2,0,0]=4 6816 B13R1.9 CCOCCNc1ncc(cn1)C 1549fb8002dcef56354ea8446893cd72 [0,2,0,0,0,0|2,0,0]=4 6817 B13R1.9 CCOCCNc1ncc(cn1)Cl 274a17f21b79c513da912ec249e8ce05 [0,2,0,0,0,0|2,0,0]=4 6818 B13R1.9 CCOCCNc1ncc(cn1)F 6a111e49ec4b511bbd627bcdd8a2617f [0,2,0,0,0,0|2,0,0]=4 6819 B13R1.9 CCOCCNc1ncc(cn1)I 142261b7e518eeed46c0c917dd4ea9b8 [0,2,0,0,0,0|2,0,0]=4 6820 B13R1.9 CCOCCNc1ncc(cn1)O 32c7aefd395ec1eca27f2ec313829e6c [0,2,0,0,0,0|2,0,0]=4 6821 B13R1.9 CCOCCOc1ccc(cc1)Br 3a7cde3720161d9b290f5eff7a28b370 [0,2,0,0,0,0|2,0,0]=4 6822 B13R1.9 CCOCCOc1ccc(cc1)C ab75d5b78f8689ad68098b58a9b182cf [0,2,0,0,0,0|2,0,0]=4 6823 B13R1.9 CCOCCOc1ccc(cc1)Cl fa92984925f94b7d5dbdccb77c822638 [0,2,0,0,0,0|2,0,0]=4 6824 B13R1.9 CCOCCOc1ccc(cc1)F 5c5e89cf5dee0c06d83959a3a27ee3fc [0,2,0,0,0,0|2,0,0]=4 6825 B13R1.9 CCOCCOc1ccc(cc1)I 69a67f264dad447709f280035482a73a [0,2,0,0,0,0|2,0,0]=4 6826 B13R1.9 CCOCCOc1ccc(cc1)S 4a6baf6700a2c66d7cf8582195a5d724 [0,2,0,0,0,0|2,0,0]=4 6827 B13R1.9 CCOCCOc1ccc(cn1)Br 859e9412593545c28c25f693e7d6640a [0,2,0,0,0,0|1,0,0]=3 6828 B13R1.9 CCOCCOc1ccc(cn1)C c42ba82b322550f30371f02486d544af [0,2,0,0,0,0|1,0,0]=3 6829 B13R1.9 CCOCCOc1ccc(cn1)Cl 293ca602b79b20655fd9874ef0cff07a [0,2,0,0,0,0|1,0,0]=3 6830 B13R1.9 CCOCCOc1ccc(cn1)F 3bd9a08eee447e5b35fb21d7ccf04027 [0,2,0,0,0,0|1,0,0]=3 6831 B13R1.9 CCOCCOc1ccc(cn1)I ca000633d3901350409eaf58cba5eec1 [0,2,0,0,0,0|1,0,0]=3 6832 B13R1.9 CCOCCOc1ccc(nn1)Br 7d5090927c8025d44c99bc12c0ada818 [0,2,0,0,0,0|2,0,0]=4 6833 B13R1.9 CCOCCOc1ccc(nn1)C aa27f4cdc915e5cc72b6899b005b55c3 [0,2,0,0,0,0|2,0,0]=4 6834 B13R1.9 CCOCCOc1ccc(nn1)Cl 571f8cdb34a95e0d170cfef2ffe29f49 [0,2,0,0,0,0|2,0,0]=4 6835 B13R1.9 CCOCCOc1cnc(cn1)Br 205056a5b2a716e514c473df7e8e809d [0,2,0,0,0,0|2,0,0]=4 6836 B13R1.9 CCOCCOc1cnc(cn1)C f520590d5064ae00ebc2b9697d183916 [0,2,0,0,0,0|2,0,0]=4 6837 B13R1.9 CCOCCOc1cnc(cn1)Cl 294b267ece78ada71f9db045fcf3c406 [0,2,0,0,0,0|2,0,0]=4 6838 B13R1.9 CCOCCOc1cnc(cn1)I 2345a1feda7afa95c6d0afef368364ba [0,2,0,0,0,0|2,0,0]=4 6839 B13R1.9 CCOCCOc1ncc(cn1)Br cd5979d988b55c3f44a87215fb40911a [0,2,0,0,0,0|2,0,0]=4 6840 B13R1.9 CCOCCOc1ncc(cn1)C 88587c2a7b00736526458256360b5de0 [0,2,0,0,0,0|2,0,0]=4 6841 B13R1.9 CCOCCOc1ncc(cn1)F a6a3ede99391f2918066a6830c82e4e4 [0,2,0,0,0,0|2,0,0]=4 6842 B13R1.9 CCOCCOc1ncc(cn1)I 471de0f760b81a93fdde2a37c829e596 [0,2,0,0,0,0|2,0,0]=4 6843 B13R1.9 CCOCCSc1ccc(cc1)C ce0019d78032a5510fb562ec90d32378 [0,2,0,0,0,0|2,0,0]=4 6844 B13R1.9 CCOCCSc1ccc(cc1)Cl 9f600d09becd0dcf255319d098fe04db [0,2,0,0,0,0|2,0,0]=4 6845 B13R1.9 CCOCCSc1ccc(cc1)F 938abc26296383d249748341c3a3cb4a [0,2,0,0,0,0|2,0,0]=4 6846 B13R1.9 CCOCCSc1ccc(cn1)Cl 6286f67bc7d966b77b9dcccb639c91ea [0,2,0,0,0,0|1,0,0]=3 6847 B13R1.9 CCOCCSc1ccc(nn1)Cl 460b677d7e4289a5d4e7eaeb6a5f2a47 [0,2,0,0,0,0|2,0,0]=4 6848 B13R1.9 CCOCNCc1ccc(cc1)Br ed44cfee78b317b459b4b6dcd51606f5 [0,2,0,0,0,0|2,0,0]=4 6849 B13R1.9 CCOCNCc1ccc(cc1)C 462758657b2d300f9552112387c3b78b [0,2,0,0,0,0|2,0,0]=4 6850 B13R1.9 CCOCNCc1ccc(cc1)Cl 84cf12fefa9ef00d07ed9e88b92c2e2c [0,2,0,0,0,0|2,0,0]=4 6851 B13R1.9 CCOCNCc1ccc(cc1)F 857750b09814fd3edaff367e17155c62 [0,2,0,0,0,0|2,0,0]=4 6852 B13R1.9 CCOCNCc1ccc(cc1)I 1d3e062e7cb9d0495cc2274da891bb42 [0,2,0,0,0,0|2,0,0]=4 6853 B13R1.9 CCOCNCc1ccc(cn1)C 7e2fca02eea714adda2fd83649d6915c [0,2,0,0,0,0|1,0,0]=3 6854 B13R1.9 CCOCNCc1ccc(cn1)F 8fedf4f5035d71e79922863b6ea34856 [0,2,0,0,0,0|1,0,0]=3 6855 B13R1.9 CCOCNCc1ccc(nn1)C 1fa401b585851bb88be1e61053fa7346 [0,2,0,0,0,0|2,0,0]=4 6856 B13R1.9 CCOCNCc1ccc(nn1)Cl 0f5fa5563942dc935d86dfed4a6d6eb1 [0,2,0,0,0,0|2,0,0]=4 6857 B13R1.9 CCOCNCc1ncc(cn1)Br 95a41ef86a75439abf6a5c6cdb390c5d [0,2,0,0,0,0|2,0,0]=4 6858 B13R1.9 CCOCNCc1ncc(cn1)Cl c7844e7c82037937b18beeefdb26c015 [0,2,0,0,0,0|2,0,0]=4 6859 B13R1.9 CCOCNCc1ncc(cn1)F 7b9f80d5516e7917df43387d0186025a [0,2,0,0,0,0|2,0,0]=4 6860 B13R1.9 CCSCCNc1ccc(cc1)Br 318d69a438a52b9a88529b16ad03c4d2 [0,2,0,0,0,0|2,0,0]=4 6861 B13R1.9 CCSCCNc1ccc(cc1)C 65133a43b2b301ad6c2ffec98c939676 [0,2,0,0,0,0|2,0,0]=4 6862 B13R1.9 CCSCCNc1ccc(cc1)Cl 8d398e77c90a1fa2b288d458169fa3be [0,2,0,0,0,0|2,0,0]=4 6863 B13R1.9 CCSCCNc1ccc(cc1)F 5195b1aad762f839b7e7876fd57d6836 [0,2,0,0,0,0|2,0,0]=4 6864 B13R1.9 CCSCCNc1ccc(cc1)I c588974fcb2db7987c8983b169826a5e [0,2,0,0,0,0|2,0,0]=4 6865 B13R1.9 CCSCCNc1ccc(cc1)S 87f68a0065accafbfa24190c770d4952 [0,2,0,0,0,0|2,0,0]=4 6866 B13R1.9 CCSCCNc1ccc(cn1)Br a806712d97cad7eba19803777875748d [0,2,0,0,0,0|1,0,0]=3 6867 B13R1.9 CCSCCNc1ccc(cn1)C 63eb6767b8eca63cdd25a22c4698f648 [0,2,0,0,0,0|1,0,0]=3 6868 B13R1.9 CCSCCNc1ccc(cn1)Cl acf631f62496c0779a24cd2f3e5c0af2 [0,2,0,0,0,0|1,0,0]=3 6869 B13R1.9 CCSCCNc1ccc(cn1)F e304a5942bec845f093b7d0f97e2906f [0,2,0,0,0,0|1,0,0]=3 6870 B13R1.9 CCSCCNc1ccc(cn1)I 1b9d170ee8383a0dd1c87b55a9b2c43f [0,2,0,0,0,0|1,0,0]=3 6871 B13R1.9 CCSCCNc1ccc(nn1)Br 610cf318e4fdcf7fb95c7c05d9db52f8 [0,2,0,0,0,0|2,0,0]=4 6872 B13R1.9 CCSCCNc1ccc(nn1)C c605c4719041b7b49e6ad2089c8099b5 [0,2,0,0,0,0|2,0,0]=4 6873 B13R1.9 CCSCCNc1ccc(nn1)Cl 8ab0f6935e4a22bb55dec926654de78d [0,2,0,0,0,0|2,0,0]=4 6874 B13R1.9 CCSCCNc1ccc(nn1)F 1f03d23cf63d98d69b3473c991851b39 [0,2,0,0,0,0|2,0,0]=4 6875 B13R1.9 CCSCCNc1ccc(nn1)I 67891f533c0f83f864008ffd7696379b [0,2,0,0,0,0|2,0,0]=4 6876 B13R1.9 CCSCCNc1cnc(cn1)Br a8fbb199ccd38bd08d630a19b2d03522 [0,2,0,0,0,0|2,0,0]=4 6877 B13R1.9 CCSCCNc1cnc(cn1)C 4ec52f884cfbd9ae866729cfd5e332a2 [0,2,0,0,0,0|2,0,0]=4 6878 B13R1.9 CCSCCNc1cnc(cn1)Cl 6567585c59e1a24f45245133dfe92e25 [0,2,0,0,0,0|2,0,0]=4 6879 B13R1.9 CCSCCNc1cnc(cn1)I 916cbc211ddf52e19fcb10f4a1f3dc87 [0,2,0,0,0,0|2,0,0]=4 6880 B13R1.9 CCSCCNc1ncc(cn1)Br 8e4c8407be78f0cbf2251a6a19435edb [0,2,0,0,0,0|2,0,0]=4 6881 B13R1.9 CCSCCNc1ncc(cn1)C cc5a68d636dc35691fc5c4bfc5f9f8ab [0,2,0,0,0,0|2,0,0]=4 6882 B13R1.9 CCSCCNc1ncc(cn1)Cl 74944a02d1dc49748e5260262dd0faa6 [0,2,0,0,0,0|2,0,0]=4 6883 B13R1.9 CCSCCNc1ncc(cn1)F 4bf1a65a2f7fcb58a27f2ac54c22f547 [0,2,0,0,0,0|2,0,0]=4 6884 B13R1.9 CCSCCNc1ncc(cn1)I 6ab083ba94917159d9c6a9959fba6c64 [0,2,0,0,0,0|2,0,0]=4 6885 B13R1.9 CCSCCOc1ccc(cc1)Br 9b2165105702482b33a26938b572247c [0,2,0,0,0,0|2,0,0]=4 6886 B13R1.9 CCSCCOc1ccc(cc1)C a3ac0331dcac29b19873c56255ca7cc6 [0,2,0,0,0,0|2,0,0]=4 6887 B13R1.9 CCSCCOc1ccc(cc1)Cl 2a8789f4f18cfc6d4b7c02ed814acfc1 [0,2,0,0,0,0|2,0,0]=4 6888 B13R1.9 CCSCCOc1ccc(cc1)F d35af0c2d7a0e0bbbbe0f7228700c983 [0,2,0,0,0,0|2,0,0]=4 6889 B13R1.9 CCSCCOc1ccc(cc1)I 500669edadc386838d997f5c7a930e1e [0,2,0,0,0,0|2,0,0]=4 6890 B13R1.9 CCSCCOc1ccc(cc1)S efb98c87de11d73fceea5bc537a1cc17 [0,2,0,0,0,0|2,0,0]=4 6891 B13R1.9 CCSCCOc1ccc(cn1)C 2d6778fec83e3116ff79381d84a3837b [0,2,0,0,0,0|1,0,0]=3 6892 B13R1.9 CCSCCOc1ccc(cn1)Cl 3abc916f934d2183b235309a98647419 [0,2,0,0,0,0|1,0,0]=3 6893 B13R1.9 CCSCCOc1ccc(cn1)F 1558aeec41b8f7d9a30aec7b7dd51f9f [0,2,0,0,0,0|1,0,0]=3 6894 B13R1.9 CCSCCOc1ccc(cn1)I f3bbfa5e2af4dc8d171c0a96b90e481f [0,2,0,0,0,0|1,0,0]=3 6895 B13R1.9 CCSCCOc1ccc(nn1)Br 17f62e48ca93f5d66d87b78beb2fd4f0 [0,2,0,0,0,0|2,0,0]=4 6896 B13R1.9 CCSCCOc1ccc(nn1)C 2523cb6b78ab7fcf2b4cb686640408b6 [0,2,0,0,0,0|2,0,0]=4 6897 B13R1.9 CCSCCOc1ccc(nn1)Cl 2cf445a71178d6986d0d052fbebc6f4f [0,2,0,0,0,0|2,0,0]=4 6898 B13R1.9 CCSCCOc1cnc(cn1)Br ddda1914b0acfa0bffde4e62683ced15 [0,2,0,0,0,0|2,0,0]=4 6899 B13R1.9 CCSCCOc1cnc(cn1)C bc832b4113d73fd6f5e935ab19e6f20a [0,2,0,0,0,0|2,0,0]=4 6900 B13R1.9 CCSCCOc1cnc(cn1)Cl 68f3d9d0b73e0600bbcc157571e6b053 [0,2,0,0,0,0|2,0,0]=4 6901 B13R1.9 CCSCCOc1cnc(cn1)I 6ef1b789e7ef7df4491e84743f6a2a78 [0,2,0,0,0,0|2,0,0]=4 6902 B13R1.9 CCSCCOc1ncc(cn1)Br 00ed9b4a842df399d7a9939a525b3b5c [0,2,0,0,0,0|2,0,0]=4 6903 B13R1.9 CCSCCOc1ncc(cn1)C 5d17b3433a37a56509ec21c779929f17 [0,2,0,0,0,0|2,0,0]=4 6904 B13R1.9 CCSCCOc1ncc(cn1)F 7478c4c92e369f3306238b1a7b164d55 [0,2,0,0,0,0|2,0,0]=4 6905 B13R1.9 CCSCCOc1ncc(cn1)I 45a06a341fc6b690d6b79edcd1173c26 [0,2,0,0,0,0|2,0,0]=4 6906 B13R1.9 COCCCNc1c[nH]c(=S)cn1 b341ccc759afb95351f6e21f2586644e [0,2,0,0,0,0|2,0,0]=4 6907 B13R1.9 COCCCNc1ccc(cc1)Br 90e74c13cbf20d16683b1ae10fcd7732 [0,2,0,0,0,0|2,0,0]=4 6908 B13R1.9 COCCCNc1ccc(cc1)C 8b80d29ba90d14f766a0c246e1a00b5a [0,2,0,0,0,0|2,0,0]=4 6909 B13R1.9 COCCCNc1ccc(cc1)Cl e9541b41004c985ef4d633757c721c94 [0,2,0,0,0,0|2,0,0]=4 6910 B13R1.9 COCCCNc1ccc(cc1)F 25e733317b37a99d6eb3ead5ae63d7af [0,2,0,0,0,0|2,0,0]=4 6911 B13R1.9 COCCCNc1ccc(cc1)I f312ef13a64afe4adc2816fc1b7469de [0,2,0,0,0,0|2,0,0]=4 6912 B13R1.9 COCCCNc1ccc(cc1)S 4e21f67a58533d6f9be474b01efb7b57 [0,2,0,0,0,0|2,0,0]=4 6913 B13R1.9 COCCCNc1ccc(cn1)Br b403345aa3d49f296c3e41d618b04a24 [0,2,0,0,0,0|1,0,0]=3 6914 B13R1.9 COCCCNc1ccc(cn1)C e308c8c4673dbbafb0804236ad3e1bb4 [0,2,0,0,0,0|1,0,0]=3 6915 B13R1.9 COCCCNc1ccc(cn1)Cl 1f491efa5056495a15b7befa8b13253f [0,2,0,0,0,0|1,0,0]=3 6916 B13R1.9 COCCCNc1ccc(cn1)F dcce210e7a6aa7fe72f8365b58063ea1 [0,2,0,0,0,0|1,0,0]=3 6917 B13R1.9 COCCCNc1ccc(cn1)I 980b1e19c048805281500d0484e4c9ac [0,2,0,0,0,0|1,0,0]=3 6918 B13R1.9 COCCCNc1ccc(nn1)Br 097100380ce92927a2bca8d5668d3f6b [0,2,0,0,0,0|2,0,0]=4 6919 B13R1.9 COCCCNc1ccc(nn1)C a77a8582bf7e542bfbe1472517da503b [0,2,0,0,0,0|2,0,0]=4 6920 B13R1.9 COCCCNc1ccc(nn1)Cl 443457d364e261da5ed0024b9535dabf [0,2,0,0,0,0|2,0,0]=4 6921 B13R1.9 COCCCNc1ccc(nn1)F 81349cbdaaaee362d22e1a462f43c70c [0,2,0,0,0,0|2,0,0]=4 6922 B13R1.9 COCCCNc1ccc(nn1)I bb6f7c01f5855ea246694817489fbcc9 [0,2,0,0,0,0|2,0,0]=4 6923 B13R1.9 COCCCNc1ccc(nn1)O 4ec877aab2422f50df91962d882f4995 [0,2,0,0,0,0|2,0,0]=4 6924 B13R1.9 COCCCNc1cnc(cn1)Br 33adec297539d094b30ea8788b102ef1 [0,2,0,0,0,0|2,0,0]=4 6925 B13R1.9 COCCCNc1cnc(cn1)C c7701619beea7d1756fdb840d0072097 [0,2,0,0,0,0|2,0,0]=4 6926 B13R1.9 COCCCNc1cnc(cn1)Cl 74a4cadb871dd63603968145c07a5458 [0,2,0,0,0,0|2,0,0]=4 6927 B13R1.9 COCCCNc1cnc(cn1)I 18831880d56ef006eb5171dadd82b4f5 [0,2,0,0,0,0|2,0,0]=4 6928 B13R1.9 COCCCNc1ncc(cn1)Br b26c8007a743c0a085a71d90fd1f0801 [0,2,0,0,0,0|2,0,0]=4 6929 B13R1.9 COCCCNc1ncc(cn1)C bb8522850892914d5cf83c3459e0f723 [0,2,0,0,0,0|2,0,0]=4 6930 B13R1.9 COCCCNc1ncc(cn1)Cl b930883397dc63841d51ebd7aef205b9 [0,2,0,0,0,0|2,0,0]=4 6931 B13R1.9 COCCCNc1ncc(cn1)F c6dfad40044648c158e1717badbba2db [0,2,0,0,0,0|2,0,0]=4 6932 B13R1.9 COCCCNc1ncc(cn1)I 42283ddf5fb49c670c2bffce32454404 [0,2,0,0,0,0|2,0,0]=4 6933 B13R1.9 COCCCOc1ccc(cc1)Br 3de3d38cb5e3c1ad1a0ed19f55525a36 [0,2,0,0,0,0|2,0,0]=4 6934 B13R1.9 COCCCOc1ccc(cc1)C 71d67739728bbc218c23d264be5351f1 [0,2,0,0,0,0|2,0,0]=4 6935 B13R1.9 COCCCOc1ccc(cc1)Cl d4f8536a5c19734b6f38174b3e04115e [0,2,0,0,0,0|2,0,0]=4 6936 B13R1.9 COCCCOc1ccc(cc1)F 110d20edce6cf6557939c2c9dd4d9b49 [0,2,0,0,0,0|2,0,0]=4 6937 B13R1.9 COCCCOc1ccc(cc1)I 908255f106acb70a416607e982152a55 [0,2,0,0,0,0|2,0,0]=4 6938 B13R1.9 COCCCOc1ccc(cc1)S 6dd2053ef2760437a6216d8bd61e16db [0,2,0,0,0,0|2,0,0]=4 6939 B13R1.9 COCCCOc1ccc(cn1)C 5596fd528b2d61ae5f98770fd36cfc1f [0,2,0,0,0,0|1,0,0]=3 6940 B13R1.9 COCCCOc1ccc(cn1)Cl 1c57a5c6a5f7745b0391356d773b200d [0,2,0,0,0,0|1,0,0]=3 6941 B13R1.9 COCCCOc1ccc(cn1)F 8a5ce47ddbfa36191a16451513260211 [0,2,0,0,0,0|1,0,0]=3 6942 B13R1.9 COCCCOc1ccc(cn1)I fbcd354e59d6f388891c0cfa9e87ba60 [0,2,0,0,0,0|1,0,0]=3 6943 B13R1.9 COCCCOc1ccc(nn1)Br e1d31085c0ca207d3d9c6d28526cb0e0 [0,2,0,0,0,0|2,0,0]=4 6944 B13R1.9 COCCCOc1ccc(nn1)C 663a86ceb775d6f909277bdaa113ac7c [0,2,0,0,0,0|2,0,0]=4 6945 B13R1.9 COCCCOc1ccc(nn1)Cl 8d1fb12d4f04ff7bb9677aea9dcd0dd3 [0,2,0,0,0,0|2,0,0]=4 6946 B13R1.9 COCCCOc1cnc(cn1)Br a870826a96f2e3e76b7d128002f2312b [0,2,0,0,0,0|2,0,0]=4 6947 B13R1.9 COCCCOc1cnc(cn1)C 318267ff27aa35282c131e9eb6513f25 [0,2,0,0,0,0|2,0,0]=4 6948 B13R1.9 COCCCOc1cnc(cn1)Cl a8de4cb790005e3716cdb0e719c89151 [0,2,0,0,0,0|2,0,0]=4 6949 B13R1.9 COCCCOc1cnc(cn1)I cc546b8ad4da92ba4f5b8d871dd76e93 [0,2,0,0,0,0|2,0,0]=4 6950 B13R1.9 COCCCOc1ncc(cn1)Br 3214eed75774e1083f8f8b1043d73aa9 [0,2,0,0,0,0|2,0,0]=4 6951 B13R1.9 COCCCOc1ncc(cn1)C b97a6c454ed10a91569b843f38655d3a [0,2,0,0,0,0|2,0,0]=4 6952 B13R1.9 COCCCOc1ncc(cn1)F 4dea9800d20d2ec9616f64630949a389 [0,2,0,0,0,0|2,0,0]=4 6953 B13R1.9 COCCCOc1ncc(cn1)I cc610fb7dafed5cb4551fb515d4cbc0e [0,2,0,0,0,0|2,0,0]=4 6954 B13R1.9 COCCNCc1ccc(cc1)Br 95156eeebe2538bf88ed726c08cd8391 [0,2,0,0,0,0|2,0,0]=4 6955 B13R1.9 COCCNCc1ccc(cc1)C 8017e4a215819f798e7a4f298b37efd8 [0,2,0,0,0,0|2,0,0]=4 6956 B13R1.9 COCCNCc1ccc(cc1)Cl b121689d228abf46f84b45b9d521c26c [0,2,0,0,0,0|2,0,0]=4 6957 B13R1.9 COCCNCc1ccc(cc1)F 2eacaddbcea98eb8131eaf2fad078647 [0,2,0,0,0,0|2,0,0]=4 6958 B13R1.9 COCCNCc1ccc(cc1)I e2c9d419dd84f5087aaffc784f895af8 [0,2,0,0,0,0|2,0,0]=4 6959 B13R1.9 COCCNCc1ccc(cn1)Br 1d4d37927cef58ef9fb7741894328a3b [0,2,0,0,0,0|1,0,0]=3 6960 B13R1.9 COCCNCc1ccc(cn1)C 2cbc46be863e28372dab3522e815648b [0,2,0,0,0,0|1,0,0]=3 6961 B13R1.9 COCCNCc1ccc(cn1)Cl 78911cd5d0e73a2433ddd166f5840a0d [0,2,0,0,0,0|1,0,0]=3 6962 B13R1.9 COCCNCc1ccc(cn1)F dca3f1f1dde935c39937025d79d791e5 [0,2,0,0,0,0|1,0,0]=3 6963 B13R1.9 COCCNCc1ccc(nn1)C 9fb32d1d4f735e4b4a385246681893e7 [0,2,0,0,0,0|2,0,0]=4 6964 B13R1.9 COCCNCc1ccc(nn1)Cl bbe7973d82a80cd30523dba19d5f73f3 [0,2,0,0,0,0|2,0,0]=4 6965 B13R1.9 COCCNCc1cnc(cn1)Br d137403924bbb4952aaed1dc731ac0af [0,2,0,0,0,0|2,0,0]=4 6966 B13R1.9 COCCNCc1cnc(cn1)C a9ee65d5bd2c9c60c71a3f3b72bb7838 [0,2,0,0,0,0|2,0,0]=4 6967 B13R1.9 COCCNCc1cnc(cn1)Cl 099e93a9bafe776e4b1f837e58f8034f [0,2,0,0,0,0|2,0,0]=4 6968 B13R1.9 COCCNCc1ncc(cn1)Br a0e34cfc305eed7b3dddf46b42228737 [0,2,0,0,0,0|2,0,0]=4 6969 B13R1.9 COCCNCc1ncc(cn1)C 51ae259cccdda121636b7bd3453e2b62 [0,2,0,0,0,0|2,0,0]=4 6970 B13R1.9 COCCNCc1ncc(cn1)Cl 641b34b940ab4ea827b6a14a983570e8 [0,2,0,0,0,0|2,0,0]=4 6971 B13R1.9 COCCNCc1ncc(cn1)F 20862ca64a3705a311e9a2d08a42b2e5 [0,2,0,0,0,0|2,0,0]=4 6972 B13R1.9 COCCOCc1ccc(cc1)Br 6152594648a80b00b399c71eb35ff719 [0,2,0,0,0,0|2,0,0]=4 6973 B13R1.9 COCCOCc1ccc(cc1)C 3fea3951fbb96fd1bce82beae6af0de5 [0,2,0,0,0,0|2,0,0]=4 6974 B13R1.9 COCCOCc1ccc(cc1)Cl bff0458d6c8137d66d74aed667d86190 [0,2,0,0,0,0|2,0,0]=4 6975 B13R1.9 COCCOCc1ccc(cc1)F a7456b6185d34fec227c493fb9ec6d7a [0,2,0,0,0,0|2,0,0]=4 6976 B13R1.9 COCCOCc1ccc(cc1)I d1c3966af9c7d9a4d21e3c2dc8ca9712 [0,2,0,0,0,0|2,0,0]=4 6977 B13R1.9 COCCOCc1ccc(cc1)S 29f9e7069803452153d6c363d47c9618 [0,2,0,0,0,0|2,0,0]=4 6978 B13R1.9 COCCOCc1ccc(cn1)Br b6dd20be1d153657afcf8177627d2ec0 [0,2,0,0,0,0|1,0,0]=3 6979 B13R1.9 COCCOCc1ccc(cn1)C 6318b4c7308f1aab349fa5976d99308b [0,2,0,0,0,0|1,0,0]=3 6980 B13R1.9 COCCOCc1ccc(cn1)Cl 7ce74889c364707b997cfb9c8d7811ab [0,2,0,0,0,0|1,0,0]=3 6981 B13R1.9 COCCOCc1ccc(cn1)F 14452f7066d18b687abceb1940578dad [0,2,0,0,0,0|1,0,0]=3 6982 B13R1.9 COCCOCc1ccc(cn1)I 26a27c9eea89d7371ab5299684adeadf [0,2,0,0,0,0|1,0,0]=3 6983 B13R1.9 COCCOCc1ccc(nn1)C 7c4074d3969e79b24fe3bd12814c3c17 [0,2,0,0,0,0|2,0,0]=4 6984 B13R1.9 COCCOCc1ccc(nn1)Cl b2376bad52fb8455db0f0add2a6db204 [0,2,0,0,0,0|2,0,0]=4 6985 B13R1.9 COCCOCc1cnc(cn1)Br 62b4404b17d8e3e69b0a9803c0b333ae [0,2,0,0,0,0|2,0,0]=4 6986 B13R1.9 COCCOCc1cnc(cn1)C 72e9a18a48511a5123a079680c65432f [0,2,0,0,0,0|2,0,0]=4 6987 B13R1.9 COCCOCc1cnc(cn1)Cl f906e870411c0008ae406d5072e3b8ff [0,2,0,0,0,0|2,0,0]=4 6988 B13R1.9 COCCOCc1ncc(cn1)Br d8b4f12cc25881fb37780436452db5be [0,2,0,0,0,0|2,0,0]=4 6989 B13R1.9 COCCOCc1ncc(cn1)C b442cf41c8bff20abe1260efcaa511b0 [0,2,0,0,0,0|2,0,0]=4 6990 B13R1.9 COCCOCc1ncc(cn1)Cl 4803b828735f3f9416056728e2d907ca [0,2,0,0,0,0|2,0,0]=4 6991 B13R1.9 COCCOCc1ncc(cn1)F 8c10a80b3f76af499e019f87d5822be7 [0,2,0,0,0,0|2,0,0]=4 6992 B13R1.9 COCNCCc1ccc(cc1)Br 7e321aefdfc7160177866446a54faf99 [0,2,0,0,0,0|2,0,0]=4 6993 B13R1.9 COCNCCc1ccc(cc1)C e88930433d90091aaff8c3218865bcae [0,2,0,0,0,0|2,0,0]=4 6994 B13R1.9 COCNCCc1ccc(cc1)Cl cbb063235721800dfd775bd55f3872a5 [0,2,0,0,0,0|2,0,0]=4 6995 B13R1.9 COCNCCc1ccc(cc1)F dbe5e10dd3439e0ddbc50539b0633008 [0,2,0,0,0,0|2,0,0]=4 6996 B13R1.9 COCNCCc1ccc(cc1)I 506e0273246e34a99474466c91a0b77c [0,2,0,0,0,0|2,0,0]=4 6997 B13R1.9 COCNCCc1ccc(cn1)Br 0336b1f45944598d00cb29a7e4e15a57 [0,2,0,0,0,0|1,0,0]=3 6998 B13R1.9 COCNCCc1cnc(cn1)C 14c7fda28c2be98f50ab88d10d91decd [0,2,0,0,0,0|2,0,0]=4 6999 B13R1.9 COCOCCc1ccc(cc1)Br 2265eac1820959c7cd04ee495858000c [0,2,0,0,0,0|2,0,0]=4 7000 B13R1.9 COCOCCc1ccc(cc1)C 4dcf32fd45f8457cf3518de0f5c63e02 [0,2,0,0,0,0|2,0,0]=4 7001 B13R1.9 COCOCCc1ccc(cc1)Cl 3506e92e7759ca06b9427d02850fd9d1 [0,2,0,0,0,0|2,0,0]=4 7002 B13R1.9 COCOCCc1ccc(cc1)F 05df7c3351ef3ba9091dda4a3af9b16d [0,2,0,0,0,0|2,0,0]=4 7003 B13R1.9 COCOCCc1ccc(cc1)I 32fc5442c0eeabe8b35a3078debfc664 [0,2,0,0,0,0|2,0,0]=4 7004 B13R1.9 COCOCCc1ccc(cn1)Br 77a917aa7c8ea0e636b68a99ce192fe9 [0,2,0,0,0,0|1,0,0]=3 7005 B13R1.9 COCOCCc1ccc(cn1)C ef869d01de28d984c55ccec1d07b3557 [0,2,0,0,0,0|1,0,0]=3 7006 B13R1.9 COCOCCc1ccc(cn1)F 019995c019ee0888ce7ccb2e4105dcd1 [0,2,0,0,0,0|1,0,0]=3 7007 B13R1.9 COCOCCc1ncc(cn1)Br 0df100df953cd681d07b7ccd3b7cf642 [0,2,0,0,0,0|2,0,0]=4 7008 B13R1.9 CSCCCNc1c[nH]c(=S)cn1 233ef6971e9464a512965de78b182d19 [0,2,0,0,0,0|2,0,0]=4 7009 B13R1.9 CSCCCNc1ccc(cc1)Br 53a053f1f839284095b63e4ec24d342b [0,2,0,0,0,0|2,0,0]=4 7010 B13R1.9 CSCCCNc1ccc(cc1)C 818bce3ecf83a9d2e6d9df75be9c42e2 [0,2,0,0,0,0|2,0,0]=4 7011 B13R1.9 CSCCCNc1ccc(cc1)Cl 4156b5c78774ca715eb439efa23e35d9 [0,2,0,0,0,0|2,0,0]=4 7012 B13R1.9 CSCCCNc1ccc(cc1)F 414b76c60518f3e624cae644507766de [0,2,0,0,0,0|2,0,0]=4 7013 B13R1.9 CSCCCNc1ccc(cc1)I 958c99b852f19c79b04eaf6c6c99a47a [0,2,0,0,0,0|2,0,0]=4 7014 B13R1.9 CSCCCNc1ccc(cc1)S 9e59da46d70ec12c6cb995c19889940b [0,2,0,0,0,0|2,0,0]=4 7015 B13R1.9 CSCCCNc1ccc(cn1)Br 3b54092d92471daca62ec3ecd9151a3b [0,2,0,0,0,0|1,0,0]=3 7016 B13R1.9 CSCCCNc1ccc(cn1)C 4d2ae80424e671c2b6a8a3918bc19ffd [0,2,0,0,0,0|1,0,0]=3 7017 B13R1.9 CSCCCNc1ccc(cn1)Cl 224ffb3cae1d2560be0c07de0bb4784d [0,2,0,0,0,0|1,0,0]=3 7018 B13R1.9 CSCCCNc1ccc(cn1)F f2120f428d674d96bf35cc0fdf448511 [0,2,0,0,0,0|1,0,0]=3 7019 B13R1.9 CSCCCNc1ccc(cn1)I c6d7206869422b3a7db125c04459f5d6 [0,2,0,0,0,0|1,0,0]=3 7020 B13R1.9 CSCCCNc1ccc(nn1)Br 59ace2cc036085e595e68c5391510032 [0,2,0,0,0,0|2,0,0]=4 7021 B13R1.9 CSCCCNc1ccc(nn1)C 5719b9cfb3a1e52ebd43856fa05ac029 [0,2,0,0,0,0|2,0,0]=4 7022 B13R1.9 CSCCCNc1ccc(nn1)Cl b80fa1a4d4e9eb1c60ebd0cbea8ee70d [0,2,0,0,0,0|2,0,0]=4 7023 B13R1.9 CSCCCNc1ccc(nn1)F 1338fe6d6f7a37dbe2e9caf8f8ad30ce [0,2,0,0,0,0|2,0,0]=4 7024 B13R1.9 CSCCCNc1ccc(nn1)I 020ea7cb8b5506b3f14a18302b7acd07 [0,2,0,0,0,0|2,0,0]=4 7025 B13R1.9 CSCCCNc1cnc(cn1)Br 3db9a2a0f5ebced5346e23e681a24f9c [0,2,0,0,0,0|2,0,0]=4 7026 B13R1.9 CSCCCNc1cnc(cn1)C 7ac529bb7da59caca4caddc240b59d4d [0,2,0,0,0,0|2,0,0]=4 7027 B13R1.9 CSCCCNc1cnc(cn1)Cl 443e4f1ab745024b0b71d349b6958c67 [0,2,0,0,0,0|2,0,0]=4 7028 B13R1.9 CSCCCNc1cnc(cn1)I b3e41a8408ecf9dda6a1ba401c9b5325 [0,2,0,0,0,0|2,0,0]=4 7029 B13R1.9 CSCCCNc1ncc(cn1)Br 03725a8540e0e44c86ac9859c0e730e6 [0,2,0,0,0,0|2,0,0]=4 7030 B13R1.9 CSCCCNc1ncc(cn1)C abd357b46e97d35f7d1f351dd1da744b [0,2,0,0,0,0|2,0,0]=4 7031 B13R1.9 CSCCCNc1ncc(cn1)Cl 2cd08396c7882aa3f7fc4800ecbcd450 [0,2,0,0,0,0|2,0,0]=4 7032 B13R1.9 CSCCCNc1ncc(cn1)F 61f0b57929f4e1a726266b14564a3098 [0,2,0,0,0,0|2,0,0]=4 7033 B13R1.9 CSCCCNc1ncc(cn1)I 8b8e8791dc4c5f3ba626ebc13ab1cb9b [0,2,0,0,0,0|2,0,0]=4 7034 B13R1.9 CSCCCOc1ccc(cc1)Br 5d5114669c986cf111fae7881e67effc [0,2,0,0,0,0|2,0,0]=4 7035 B13R1.9 CSCCCOc1ccc(cc1)C c1ab26eaf47553a06f83aa52c3d9a2a0 [0,2,0,0,0,0|2,0,0]=4 7036 B13R1.9 CSCCCOc1ccc(cc1)Cl 03e4d08ef92c3e4c2c97caff0a7965d7 [0,2,0,0,0,0|2,0,0]=4 7037 B13R1.9 CSCCCOc1ccc(cc1)F be5fa90a236162121ee735ffdf0ad26c [0,2,0,0,0,0|2,0,0]=4 7038 B13R1.9 CSCCCOc1ccc(cc1)I c0fd7754058d1f9706eec8ae5c94a027 [0,2,0,0,0,0|2,0,0]=4 7039 B13R1.9 CSCCCOc1ccc(cc1)S 85216204cd5c9f3166752866b5fd35c8 [0,2,0,0,0,0|2,0,0]=4 7040 B13R1.9 CSCCCOc1ccc(cn1)C 89176de3a07e3327a7888cb0372705f3 [0,2,0,0,0,0|1,0,0]=3 7041 B13R1.9 CSCCCOc1ccc(cn1)Cl ac96647e050dabdb3b7b2bb6a385996f [0,2,0,0,0,0|1,0,0]=3 7042 B13R1.9 CSCCCOc1ccc(cn1)F 688a8f404a5641f51302137a5279ef51 [0,2,0,0,0,0|1,0,0]=3 7043 B13R1.9 CSCCCOc1ccc(cn1)I 14ba823450ab03eedd603fb5a36a157d [0,2,0,0,0,0|1,0,0]=3 7044 B13R1.9 CSCCCOc1ccc(nn1)Br 0fbe720b61da5cfb380f48fd95949b8e [0,2,0,0,0,0|2,0,0]=4 7045 B13R1.9 CSCCCOc1ccc(nn1)C b913656291700647c1b77935fe211790 [0,2,0,0,0,0|2,0,0]=4 7046 B13R1.9 CSCCCOc1ccc(nn1)Cl 9de2318ebfc26a149259eee314458972 [0,2,0,0,0,0|2,0,0]=4 7047 B13R1.9 CSCCCOc1cnc(cn1)Br 5f025c1ae6f6544845d0c08221816026 [0,2,0,0,0,0|2,0,0]=4 7048 B13R1.9 CSCCCOc1cnc(cn1)C 891fed039ad7c61c3f4464a187925b7e [0,2,0,0,0,0|2,0,0]=4 7049 B13R1.9 CSCCCOc1cnc(cn1)Cl b1bbfd7b3793727fe36b11e8181eebfc [0,2,0,0,0,0|2,0,0]=4 7050 B13R1.9 CSCCCOc1cnc(cn1)I e43f6b47ccf3d1833bff827fd0e77300 [0,2,0,0,0,0|2,0,0]=4 7051 B13R1.9 CSCCCOc1ncc(cn1)Br 432af83e3ebafedfd99855d7ebe538e6 [0,2,0,0,0,0|2,0,0]=4 7052 B13R1.9 CSCCCOc1ncc(cn1)C ef6e5c72c8a47f99ec439292737dc251 [0,2,0,0,0,0|2,0,0]=4 7053 B13R1.9 CSCCCOc1ncc(cn1)F 031f5d4fa51b14f739f8911aa85b3a68 [0,2,0,0,0,0|2,0,0]=4 7054 B13R1.9 CSCCCOc1ncc(cn1)I 492955a31a4de02d005fa9bbf5a2e4ac [0,2,0,0,0,0|2,0,0]=4 7055 B13R1.9 CSCCNCc1ccc(cc1)Br 0961f7c51fb23fa6af988f89fbf15da0 [0,2,0,0,0,0|2,0,0]=4 7056 B13R1.9 CSCCNCc1ccc(cc1)C 89bd057821a4a10963d5cdda53297ae0 [0,2,0,0,0,0|2,0,0]=4 7057 B13R1.9 CSCCNCc1ccc(cc1)Cl 17a751b24bd732f9e31e1b8578d78a55 [0,2,0,0,0,0|2,0,0]=4 7058 B13R1.9 CSCCNCc1ccc(cc1)F 5cba57da0244744ffaad5c95683d0342 [0,2,0,0,0,0|2,0,0]=4 7059 B13R1.9 CSCCNCc1ccc(cc1)I 38cd074e0f785ecbd9095ade89525b06 [0,2,0,0,0,0|2,0,0]=4 7060 B13R1.9 CSCCNCc1ccc(cn1)Br 3d83a6d00639a398c4f471a797c11315 [0,2,0,0,0,0|1,0,0]=3 7061 B13R1.9 CSCCNCc1ccc(cn1)C 825a4ebeaf94bef8d1b4521cb74ed04c [0,2,0,0,0,0|1,0,0]=3 7062 B13R1.9 CSCCNCc1ccc(cn1)Cl cd824adb3f92fc03afe8cad3c739bd28 [0,2,0,0,0,0|1,0,0]=3 7063 B13R1.9 CSCCNCc1ccc(cn1)F 0456c3778dd387c72d59266054828898 [0,2,0,0,0,0|1,0,0]=3 7064 B13R1.9 CSCCNCc1ccc(nn1)C f1f42501cfca698bf56db5d47705be68 [0,2,0,0,0,0|2,0,0]=4 7065 B13R1.9 CSCCNCc1ccc(nn1)Cl bfa075a4bc619c64f8442a5d1b12d7a7 [0,2,0,0,0,0|2,0,0]=4 7066 B13R1.9 CSCCNCc1cnc(cn1)Br 0c50940c6b6b046cae58f3f2b345c21c [0,2,0,0,0,0|2,0,0]=4 7067 B13R1.9 CSCCNCc1cnc(cn1)C 3eb1fa109cd3e86eb7e55cb6f5c85515 [0,2,0,0,0,0|2,0,0]=4 7068 B13R1.9 CSCCNCc1cnc(cn1)Cl f3b179130505ddfe9e435bbbdd201df8 [0,2,0,0,0,0|2,0,0]=4 7069 B13R1.9 CSCCNCc1ncc(cn1)Br 3dd4c5e0e50af4e2fd3e5e26d8a76905 [0,2,0,0,0,0|2,0,0]=4 7070 B13R1.9 CSCCNCc1ncc(cn1)C 352c4e992bf1ef75d352018e77bd1199 [0,2,0,0,0,0|2,0,0]=4 7071 B13R1.9 CSCCNCc1ncc(cn1)Cl c1ae42d7a29d85249560611eab4fd291 [0,2,0,0,0,0|2,0,0]=4 7072 B13R1.9 CSCCNCc1ncc(cn1)F 72a777104cfad280092c24925dbadb03 [0,2,0,0,0,0|2,0,0]=4 7073 B13R1.9 CSCCOCc1ccc(cc1)Br b022264913fae9f802a14bcdb348bd65 [0,2,0,0,0,0|2,0,0]=4 7074 B13R1.9 CSCCOCc1ccc(cc1)C ab1c2e27a478c3d093c253eed69e24c1 [0,2,0,0,0,0|2,0,0]=4 7075 B13R1.9 CSCCOCc1ccc(cc1)Cl 9117210280365863609e792b5041aacd [0,2,0,0,0,0|2,0,0]=4 7076 B13R1.9 CSCCOCc1ccc(cc1)F 1fa4503cb415128f8661cfa915323da1 [0,2,0,0,0,0|2,0,0]=4 7077 B13R1.9 CSCCOCc1ccc(cc1)I 3cc8d529c68115cecd18c00529555ee6 [0,2,0,0,0,0|2,0,0]=4 7078 B13R1.9 CSCCOCc1ccc(cc1)S 376c6909068b193bef7116b9071cb6bf [0,2,0,0,0,0|2,0,0]=4 7079 B13R1.9 CSCCOCc1ccc(cn1)Br 34dab86cb1f1074f2351f19bb569f8cb [0,2,0,0,0,0|1,0,0]=3 7080 B13R1.9 CSCCOCc1ccc(cn1)C 68938f87e0095c6e598a2aab3abfe957 [0,2,0,0,0,0|1,0,0]=3 7081 B13R1.9 CSCCOCc1ccc(cn1)Cl ccfc75c8877f3a49c7bad8d299eb1ca5 [0,2,0,0,0,0|1,0,0]=3 7082 B13R1.9 CSCCOCc1ccc(cn1)F afba9fc7ea239c06e54b4bd7aff565fd [0,2,0,0,0,0|1,0,0]=3 7083 B13R1.9 CSCCOCc1ccc(cn1)I e9ae07c2d64cfcecbaebb3aea6d2943f [0,2,0,0,0,0|1,0,0]=3 7084 B13R1.9 CSCCOCc1ccc(nn1)C 1287c0fcbec1268dd6f1aaab231b575e [0,2,0,0,0,0|2,0,0]=4 7085 B13R1.9 CSCCOCc1ccc(nn1)Cl 292748ad51898bd8dcc95fcfcc6babd3 [0,2,0,0,0,0|2,0,0]=4 7086 B13R1.9 CSCCOCc1cnc(cn1)Br 1a8d8681cb04837b25550f3dc028de54 [0,2,0,0,0,0|2,0,0]=4 7087 B13R1.9 CSCCOCc1cnc(cn1)C 6eb77d3907cab1ccfca11cfc4b1757af [0,2,0,0,0,0|2,0,0]=4 7088 B13R1.9 CSCCOCc1cnc(cn1)Cl 1a395659d31bc442cf42e6b5b16f7d20 [0,2,0,0,0,0|2,0,0]=4 7089 B13R1.9 CSCCOCc1ncc(cn1)Br c53a3c75d682cb198992e0c8c3da543d [0,2,0,0,0,0|2,0,0]=4 7090 B13R1.9 CSCCOCc1ncc(cn1)C c1ac295889c4599d249ec5d81daee660 [0,2,0,0,0,0|2,0,0]=4 7091 B13R1.9 CSCCOCc1ncc(cn1)Cl 45f6197f25111e2dd0ce3da1388fbb91 [0,2,0,0,0,0|2,0,0]=4 7092 B13R1.9 CSCCOCc1ncc(cn1)F 55abf18e673a636af6fcf32463e44997 [0,2,0,0,0,0|2,0,0]=4 7093 B13R1.9 CSCNCCc1ccc(cc1)Br 4a5b52113a1c27e117abb93fc05bca10 [0,2,0,0,0,0|2,0,0]=4 7094 B13R1.9 CSCNCCc1ccc(cc1)C a4b7eab0511afd204a508f16f846fd6a [0,2,0,0,0,0|2,0,0]=4 7095 B13R1.9 CSCNCCc1ccc(cc1)Cl 48aa1bb1632fd7f2838378ec88e9ee2b [0,2,0,0,0,0|2,0,0]=4 7096 B13R1.9 CSCNCCc1ccc(cc1)F 28feaab14cfb707a36d13694182f0977 [0,2,0,0,0,0|2,0,0]=4 7097 B13R1.9 CSCNCCc1ccc(cc1)I ccc18ed766d4f80b37380a589f354a94 [0,2,0,0,0,0|2,0,0]=4 7098 B13R1.9 CSCOCCc1ccc(cc1)Br a2f1446888b8c4993834c4e5cd48f9f7 [0,2,0,0,0,0|2,0,0]=4 7099 B13R1.9 CSCOCCc1ccc(cc1)C 4e85c76a8358ce1d31e7668830f3b0d9 [0,2,0,0,0,0|2,0,0]=4 7100 B13R1.9 CSCOCCc1ccc(cc1)Cl e2670b2cf7b7f1764b3a591009e0f7fd [0,2,0,0,0,0|2,0,0]=4 7101 B13R1.9 CSCOCCc1ccc(cc1)F 271aaa618fbc269c251148c54dafa187 [0,2,0,0,0,0|2,0,0]=4 7102 B13R1.9 CSCOCCc1ccc(cc1)I 7bfaf5b65edd162e4a06878c708e83de [0,2,0,0,0,0|2,0,0]=4 7103 B13R1.9 CSCOCCc1ccc(cn1)C 0e642a583f63900f1171c74e4a715719 [0,2,0,0,0,0|1,0,0]=3 7104 B13R1.9 CSCOCCc1ccc(cn1)F 62bb0902f74e87caa59634589e2b0ee2 [0,2,0,0,0,0|1,0,0]=3 7105 B13R1.9 CSCOCCc1ncc(cn1)Br fe29e11ef89d2b062ee3365257abb2f6 [0,2,0,0,0,0|2,0,0]=4 7106 B13R1.9 Cc1ccc(cc1)CCCNCF e75b247fad16aad5fce80a390d2f8810 [0,2,0,0,0,0|2,0,0]=4 7107 B13R1.9 Cc1ccc(cc1)CCCNCO 3a48c14e2b859d2be7f00066e808249a [0,2,0,0,0,0|2,0,0]=4 7108 B13R1.9 Cc1ccc(cc1)CCCOCF 85ef398c611f7e3027b8a0f8691c366b [0,2,0,0,0,0|2,0,0]=4 7109 B13R1.9 Cc1ccc(cc1)CCNCCBr 338562700ae19311e6c24785462e6fba [0,2,0,0,0,0|2,0,0]=4 7110 B13R1.9 Cc1ccc(cc1)CCNCCF 07aa2c860ad7ae4bbb0198fb3b118d03 [0,2,0,0,0,0|2,0,0]=4 7111 B13R1.9 Cc1ccc(cc1)CCNCCI 3a28f414aebb57c00cae8b768764b6ae [0,2,0,0,0,0|2,0,0]=4 7112 B13R1.9 Cc1ccc(cc1)CCNCCO 894989ea5c4a18599f896cb6a975a805 [0,2,0,0,0,0|2,0,0]=4 7113 B13R1.9 Cc1ccc(cc1)CCNCCS 19eaf48e6052f9de21267f9f8499716f [0,2,0,0,0,0|2,0,0]=4 7114 B13R1.9 Cc1ccc(cc1)CCOCCF 31af5220a7fe0de079584030a0df697d [0,2,0,0,0,0|2,0,0]=4 7115 B13R1.9 Cc1ccc(cc1)CCOCCS 74363b0cdab774026006b8d8a967048e [0,2,0,0,0,0|2,0,0]=4 7116 B13R1.9 Cc1ccc(cc1)CNCCCCl d9b3e369c6b160130bc6251baf00004b [0,2,0,0,0,0|2,0,0]=4 7117 B13R1.9 Cc1ccc(cc1)CNCCCF 254fb57dd6cbe2c2034c182bf58e7a88 [0,2,0,0,0,0|2,0,0]=4 7118 B13R1.9 Cc1ccc(cc1)CNCCCO e4ba06769a76df6bdd4b03578c4fbf61 [0,2,0,0,0,0|2,0,0]=4 7119 B13R1.9 Cc1ccc(cc1)CNCCCS 61ffeea0b651397883e2574c63f8aa3e [0,2,0,0,0,0|2,0,0]=4 7120 B13R1.9 Cc1ccc(cc1)COCCCF ad98c9817786ef8e748d051aa2eb8828 [0,2,0,0,0,0|2,0,0]=4 7121 B13R1.9 Cc1ccc(cc1)COCCCS 1300f9015cebcad4921ada09846b156c [0,2,0,0,0,0|2,0,0]=4 7122 B13R1.9 Cc1ccc(cc1)NCCCCCl 42b65dc645ea9e87cf9d48b4eaea8e59 [0,2,0,0,0,0|2,0,0]=4 7123 B13R1.9 Cc1ccc(cc1)NCCCCF 78c5b175ed7a885a3a988682b39b96de [0,2,0,0,0,0|2,0,0]=4 7124 B13R1.9 Cc1ccc(cc1)NCCCCO 2305b58a0250ff4d1bcf680d9eb6973a [0,2,0,0,0,0|2,0,0]=4 7125 B13R1.9 Cc1ccc(cc1)NCCCCS b290387257d5cc5695cbabfc58b592f3 [0,2,0,0,0,0|2,0,0]=4 7126 B13R1.9 Cc1ccc(cc1)OCCCCF 9c62878c1df3b2855e95b988b5831a64 [0,2,0,0,0,0|2,0,0]=4 7127 B13R1.9 Cc1ccc(nc1)CCOCC#N a572b4858473c62c52a6715fc15869e9 [0,2,0,0,0,0|1,0,1]=4 7128 B13R1.9 Cc1ccc(nc1)CCOCC=O deda8bb9050636e99fbc662de3ece2a1 [0,2,0,0,0,0|1,0,1]=4 7129 B13R1.9 Cc1ccc(nc1)CCOCCF fc556d8068d219fd7dec6899b68e0d5f [0,2,0,0,0,0|1,0,0]=3 7130 B13R1.9 Cc1ccc(nc1)CCOCCS d7e2d83180278825313531a227058c5c [0,2,0,0,0,0|1,0,0]=3 7131 B13R1.9 Cc1ccc(nc1)CNCCC#N b9253c73ad5388dc7aeb7e18d38a013b [0,2,0,0,0,0|1,0,1]=4 7132 B13R1.9 Cc1ccc(nc1)CNCCC=O e1c9329e57ef4ca77a2a6b44e14a5678 [0,2,0,0,0,0|1,0,1]=4 7133 B13R1.9 Cc1ccc(nc1)CNCCCCl 236c9f246ef50f21139e89ad226630b9 [0,2,0,0,0,0|1,0,0]=3 7134 B13R1.9 Cc1ccc(nc1)CNCCCF af41f31071ea006d5a91404008798ab0 [0,2,0,0,0,0|1,0,0]=3 7135 B13R1.9 Cc1ccc(nc1)CNCCCO a45ae8c1eddd2567886b854e1ca7fc91 [0,2,0,0,0,0|1,0,0]=3 7136 B13R1.9 Cc1ccc(nc1)CNCCCS 99f4d66c4063386cdc6836baaa908239 [0,2,0,0,0,0|1,0,0]=3 7137 B13R1.9 Cc1ccc(nc1)CNCCON b5f0515f3c95c646774fb5f466ad3625 [0,2,0,0,0,0|2,0,0]=4 7138 B13R1.9 Cc1ccc(nc1)COCCC#N 85d28ed64794b5c542f3bfff93419c57 [0,2,0,0,0,0|1,0,1]=4 7139 B13R1.9 Cc1ccc(nc1)COCCC=O 3e617e0e1c3956bd0f2d40b8f4272f97 [0,2,0,0,0,0|1,0,1]=4 7140 B13R1.9 Cc1ccc(nc1)COCCCF 203375ae99344f1fac69dbb2381a3f2b [0,2,0,0,0,0|1,0,0]=3 7141 B13R1.9 Cc1ccc(nc1)COCCCS 93d2cdf0fa54f3af031d399f434ebc8e [0,2,0,0,0,0|1,0,0]=3 7142 B13R1.9 Cc1ccc(nc1)NCCCC#N 66bbd16e2fbef369f95ef851ecc3d331 [0,2,0,0,0,0|1,0,1]=4 7143 B13R1.9 Cc1ccc(nc1)NCCCC=O 20daa9153f4b19eaeb942ef7cc3d326a [0,2,0,0,0,0|1,0,1]=4 7144 B13R1.9 Cc1ccc(nc1)NCCCCCl 9b51384668917aa4d84ad0708d605bec [0,2,0,0,0,0|1,0,0]=3 7145 B13R1.9 Cc1ccc(nc1)NCCCCF eb4fda75897789b02e3564f39556d514 [0,2,0,0,0,0|1,0,0]=3 7146 B13R1.9 Cc1ccc(nc1)NCCCCO 472cc28069a5685beb8f50886485a192 [0,2,0,0,0,0|1,0,0]=3 7147 B13R1.9 Cc1ccc(nc1)OCCCC#N d1ef14d213013c9af6983f0cd44a2479 [0,2,0,0,0,0|1,0,1]=4 7148 B13R1.9 Cc1ccc(nc1)OCCCC=O 2d767016406b8eb863be8539be0615f7 [0,2,0,0,0,0|1,0,1]=4 7149 B13R1.9 Cc1ccc(nc1)OCCCCF baff54a141201c7ce8a9afd87c52e996 [0,2,0,0,0,0|1,0,0]=3 7150 B13R1.9 Cc1ccc(nc1)OCCNCF 55c724b5c5e9c60d3f466f118ed19d1c [0,2,0,0,0,0|2,0,0]=4 7151 B13R1.9 Cc1ccc(nc1)OCCNCO fd4f01838fd5c6e8b06e9c1f15060d11 [0,2,0,0,0,0|2,0,0]=4 7152 B13R1.9 Cc1ccc(nn1)CNCCCF 8e3b464f33e6fd83ded5d7b18a587c4c [0,2,0,0,0,0|2,0,0]=4 7153 B13R1.9 Cc1ccc(nn1)CNCCCO 812c4717bb1e9944ad0fd28756f09dec [0,2,0,0,0,0|2,0,0]=4 7154 B13R1.9 Cc1ccc(nn1)CNCCCS 6232350a418e03cde65c124e2e9b47bd [0,2,0,0,0,0|2,0,0]=4 7155 B13R1.9 Cc1ccc(nn1)COCCCF eff3225baa8e75023433626a5f9da65a [0,2,0,0,0,0|2,0,0]=4 7156 B13R1.9 Cc1ccc(nn1)COCCCS 3565bb7174b57797d53d5cd15301e9e2 [0,2,0,0,0,0|2,0,0]=4 7157 B13R1.9 Cc1ccc(nn1)NCCCCCl 89ea903b188fbd0c1fd46af154a55d87 [0,2,0,0,0,0|2,0,0]=4 7158 B13R1.9 Cc1ccc(nn1)NCCCCF afe81512aa98ef031d39a939557f0d41 [0,2,0,0,0,0|2,0,0]=4 7159 B13R1.9 Cc1ccc(nn1)NCCCCO 42469115987b1bd22cdde2f0822afac9 [0,2,0,0,0,0|2,0,0]=4 7160 B13R1.9 Cc1ccc(nn1)OCCCCF 2edfd9183a4b60f9ef47cfca92cd17df [0,2,0,0,0,0|2,0,0]=4 7161 B13R1.9 Cc1cnc(cn1)CCNCCO 65c29c45325aa3d2c529ec5bfefc78c2 [0,2,0,0,0,0|2,0,0]=4 7162 B13R1.9 Cc1cnc(cn1)CCNCCS d994d039c1205797ca2c96ec5e6f3257 [0,2,0,0,0,0|2,0,0]=4 7163 B13R1.9 Cc1cnc(cn1)CNCCCF 458737458f9c57d19e2fa3bd075bfec0 [0,2,0,0,0,0|2,0,0]=4 7164 B13R1.9 Cc1cnc(cn1)CNCCCO 880d302b4e96645290c9cc5dba0a521b [0,2,0,0,0,0|2,0,0]=4 7165 B13R1.9 Cc1cnc(cn1)CNCCCS ed1fe38a2b76f422b1d2bdb39bf5a475 [0,2,0,0,0,0|2,0,0]=4 7166 B13R1.9 Cc1cnc(cn1)COCCCF 76ca3d9e393d582523c1c9dffca0a610 [0,2,0,0,0,0|2,0,0]=4 7167 B13R1.9 Cc1cnc(cn1)COCCCS 1bc12e539c321b465497e2091b634049 [0,2,0,0,0,0|2,0,0]=4 7168 B13R1.9 Cc1cnc(cn1)NCCCCCl f7730a999ddad226b7f520fc2985eeab [0,2,0,0,0,0|2,0,0]=4 7169 B13R1.9 Cc1cnc(cn1)NCCCCF 0814d836b99f20d1c4068fdf7cf5f8ec [0,2,0,0,0,0|2,0,0]=4 7170 B13R1.9 Cc1cnc(cn1)NCCCCO 6bb2e97c5ba9e5a4b8f88729601d8b34 [0,2,0,0,0,0|2,0,0]=4 7171 B13R1.9 Cc1cnc(cn1)OCCCCF 81bdb6e09dbda55b916c5469e8e955b7 [0,2,0,0,0,0|2,0,0]=4 7172 B13R1.9 Cc1cnc(nc1)CNCCCCl d4a9dcc3a64c359865c3b1f48cf654de [0,2,0,0,0,0|2,0,0]=4 7173 B13R1.9 Cc1cnc(nc1)CNCCCF fdfa1ffe56e9b17c65fb7f7355e2626f [0,2,0,0,0,0|2,0,0]=4 7174 B13R1.9 Cc1cnc(nc1)CNCCCO 6e21de1dfe5309a4250d8c773b01bc20 [0,2,0,0,0,0|2,0,0]=4 7175 B13R1.9 Cc1cnc(nc1)CNCCCS ca01d967c5ce674216849192deaff422 [0,2,0,0,0,0|2,0,0]=4 7176 B13R1.9 Cc1cnc(nc1)COCCCF 258470413aa4a1f84cd57c7d575c90df [0,2,0,0,0,0|2,0,0]=4 7177 B13R1.9 Cc1cnc(nc1)COCCCS ec03dd80d34f14213d93832f3fdd8cfb [0,2,0,0,0,0|2,0,0]=4 7178 B13R1.9 Cc1cnc(nc1)NCCCCF cbf72bce86a8dfeeadcda7e25ecb70a8 [0,2,0,0,0,0|2,0,0]=4 7179 B13R1.9 Cc1cnc(nc1)NCCCCO 38c848178824991c994a19d8831d6c0f [0,2,0,0,0,0|2,0,0]=4 7180 B13R1.9 Cc1cnc(nc1)OCCCCF 4039ac6f1049eb9ece8e9ad77e5b4a41 [0,2,0,0,0,0|2,0,0]=4 7181 B13R1.9 ClCCCNCc1ccc(cc1)Br 6a592120134699609f7e82fa6c91b7db [0,2,0,0,0,0|2,0,0]=4 7182 B13R1.9 ClCCCNCc1ccc(cc1)Cl ca686e586f19dd80111636ba259b995a [0,2,0,0,0,0|2,0,0]=4 7183 B13R1.9 ClCCCNCc1ccc(cc1)I 42fd39e6c1414425a4bd683ba1dbb8d0 [0,2,0,0,0,0|2,0,0]=4 7184 B13R1.9 ClCCCNCc1ccc(cn1)Br 2a846ac2dae6b8818dc72f1284f9ef00 [0,2,0,0,0,0|1,0,0]=3 7185 B13R1.9 ClCCCNCc1ccc(cn1)Cl 5b11458a868501742ae10b301c4260e7 [0,2,0,0,0,0|1,0,0]=3 7186 B13R1.9 ClCCCNCc1cnc(cn1)Br 26f80a20e06c739851bee0159995570f [0,2,0,0,0,0|2,0,0]=4 7187 B13R1.9 ClCCCNCc1ncc(cn1)Br c6cc7ffff6ceb566078c3b0c8472552a [0,2,0,0,0,0|2,0,0]=4 7188 B13R1.9 ClCCCNCc1ncc(cn1)Cl 63b5b09f6724c02c84ea16b43b0937e8 [0,2,0,0,0,0|2,0,0]=4 7189 B13R1.9 Clc1ccc(cc1)CCNCCBr 681f82ecc0cdfb6b4b0bf02113db9e2f [0,2,0,0,0,0|2,0,0]=4 7190 B13R1.9 Clc1ccc(cc1)CCNCCI 7af93975fe96705e81fff0cc510ba7da [0,2,0,0,0,0|2,0,0]=4 7191 B13R1.9 FCCCCNc1ccc(cc1)Br 42d0636ce63bc7695c205fec823892bb [0,2,0,0,0,0|2,0,0]=4 7192 B13R1.9 FCCCCNc1ccc(cc1)Cl 9a791b031ff445a75664c5328a1afa75 [0,2,0,0,0,0|2,0,0]=4 7193 B13R1.9 FCCCCNc1ccc(cc1)F 21f4ae4fe3ec14015ab60414da543913 [0,2,0,0,0,0|2,0,0]=4 7194 B13R1.9 FCCCCNc1ccc(cc1)I e92c96b3f2d0725f5541a39e7785f03a [0,2,0,0,0,0|2,0,0]=4 7195 B13R1.9 FCCCCNc1ccc(cc1)S 871baced57dd4ff1706ba860cbf5d5b5 [0,2,0,0,0,0|2,0,0]=4 7196 B13R1.9 FCCCCNc1ccc(cn1)Br 1fe8bbfa94e808e55a213510b668585b [0,2,0,0,0,0|1,0,0]=3 7197 B13R1.9 FCCCCNc1ccc(cn1)Cl 1045db9fe6296ea8a7201ea6a222d174 [0,2,0,0,0,0|1,0,0]=3 7198 B13R1.9 FCCCCNc1ccc(cn1)F 70ce1b3fffe4b96b589139ca2a718247 [0,2,0,0,0,0|1,0,0]=3 7199 B13R1.9 FCCCCNc1ccc(cn1)I d14541d41760ea4ecf708626836159d5 [0,2,0,0,0,0|1,0,0]=3 7200 B13R1.9 FCCCCNc1ccc(nn1)Br 7c7ee58d60424689de87b842ba4b0e5b [0,2,0,0,0,0|2,0,0]=4 7201 B13R1.9 FCCCCNc1ccc(nn1)Cl 39e8a1849cb8f1e307d08db90057d380 [0,2,0,0,0,0|2,0,0]=4 7202 B13R1.9 FCCCCNc1ccc(nn1)F 4fa8a4852e24ae4f4cdac246d90fcf5d [0,2,0,0,0,0|2,0,0]=4 7203 B13R1.9 FCCCCNc1ccc(nn1)I 58236dd8cd8c80ae9b02057f7ad9287d [0,2,0,0,0,0|2,0,0]=4 7204 B13R1.9 FCCCCNc1cnc(cn1)Br cd2459072dc57a7f8244f62cd39de01f [0,2,0,0,0,0|2,0,0]=4 7205 B13R1.9 FCCCCNc1cnc(cn1)Cl 8401c5d99b71f22beeece0a83e735f1e [0,2,0,0,0,0|2,0,0]=4 7206 B13R1.9 FCCCCNc1cnc(cn1)I 1d06a457583602a3615d8236d3cd3d34 [0,2,0,0,0,0|2,0,0]=4 7207 B13R1.9 FCCCCNc1ncc(cn1)Br 141ca590daaf0fbe21656c13f7e9bb8d [0,2,0,0,0,0|2,0,0]=4 7208 B13R1.9 FCCCCNc1ncc(cn1)Cl e7fb0242e184692791864b9ff5d4d31e [0,2,0,0,0,0|2,0,0]=4 7209 B13R1.9 FCCCCNc1ncc(cn1)F 1b12cc80c972f1e97e60eaf61293be58 [0,2,0,0,0,0|2,0,0]=4 7210 B13R1.9 FCCCCNc1ncc(cn1)I e28da60e90121e81e8848db7f8758781 [0,2,0,0,0,0|2,0,0]=4 7211 B13R1.9 FCCCCOc1ccc(cc1)Br a02f913eb498e4202980b289e6e26140 [0,2,0,0,0,0|2,0,0]=4 7212 B13R1.9 FCCCCOc1ccc(cc1)Cl d124c9e5488696c793f0e4955f9777fd [0,2,0,0,0,0|2,0,0]=4 7213 B13R1.9 FCCCCOc1ccc(cc1)F add9b66f7c81a415b1c3ca6acd5ae351 [0,2,0,0,0,0|2,0,0]=4 7214 B13R1.9 FCCCCOc1ccc(cc1)I 53f0744781edfb92bef55080b7211b4b [0,2,0,0,0,0|2,0,0]=4 7215 B13R1.9 FCCCCOc1ccc(cc1)S 69e9a22f682bbf459d8fb46213ce17dc [0,2,0,0,0,0|2,0,0]=4 7216 B13R1.9 FCCCCOc1ccc(cn1)Cl 3b9df3a8e5b1a2a686cce709153eab1e [0,2,0,0,0,0|1,0,0]=3 7217 B13R1.9 FCCCCOc1ccc(cn1)F b6619a0df1dc6d5c2972b03014126bf0 [0,2,0,0,0,0|1,0,0]=3 7218 B13R1.9 FCCCCOc1ccc(cn1)I 7c923557f6fbbff5b73d4fce59b8b78e [0,2,0,0,0,0|1,0,0]=3 7219 B13R1.9 FCCCCOc1ccc(nn1)Br 78aeb20aaca8bb298ecf14d23c7374ea [0,2,0,0,0,0|2,0,0]=4 7220 B13R1.9 FCCCCOc1ccc(nn1)Cl 96a97ec7df18ee9a10b28ff34abee721 [0,2,0,0,0,0|2,0,0]=4 7221 B13R1.9 FCCCCOc1cnc(cn1)Br 5e1a2c85127f69a63675833b208e8776 [0,2,0,0,0,0|2,0,0]=4 7222 B13R1.9 FCCCCOc1cnc(cn1)Cl 878b8a861582460b87c585230856b0bf [0,2,0,0,0,0|2,0,0]=4 7223 B13R1.9 FCCCCOc1cnc(cn1)I 92d0a179675c8fb9a3d2be6e1f9e8c62 [0,2,0,0,0,0|2,0,0]=4 7224 B13R1.9 FCCCCOc1ncc(cn1)Br a7f7018da5e51c6b5f498817ec0523b8 [0,2,0,0,0,0|2,0,0]=4 7225 B13R1.9 FCCCCOc1ncc(cn1)F 8297ea66cd07e4f3c2b041ae694b1f22 [0,2,0,0,0,0|2,0,0]=4 7226 B13R1.9 FCCCCOc1ncc(cn1)I 25a39754bfb3ce88204aecf716d0f6d2 [0,2,0,0,0,0|2,0,0]=4 7227 B13R1.9 FCCCNCc1ccc(cc1)Br f1e3e8a9777f465e9412d99f6c491450 [0,2,0,0,0,0|2,0,0]=4 7228 B13R1.9 FCCCNCc1ccc(cc1)Cl a1573a39cb33e88a05809c2eb24a9253 [0,2,0,0,0,0|2,0,0]=4 7229 B13R1.9 FCCCNCc1ccc(cc1)F e9b08357b182f0c1024d8133a88ba966 [0,2,0,0,0,0|2,0,0]=4 7230 B13R1.9 FCCCNCc1ccc(cc1)I 84bfd1a8b0730755415031aa0d78711e [0,2,0,0,0,0|2,0,0]=4 7231 B13R1.9 FCCCNCc1ccc(cn1)Br 4679005f01b2896fae9480c0ffb35a90 [0,2,0,0,0,0|1,0,0]=3 7232 B13R1.9 FCCCNCc1ccc(cn1)Cl 2de06299839b08f31c77b88f99be67ec [0,2,0,0,0,0|1,0,0]=3 7233 B13R1.9 FCCCNCc1ccc(cn1)F 0b28edfa4c62f08b3b09f2078e4c6839 [0,2,0,0,0,0|1,0,0]=3 7234 B13R1.9 FCCCNCc1ccc(nn1)Cl 2e62cc736d5519310ed5395beadaaa2c [0,2,0,0,0,0|2,0,0]=4 7235 B13R1.9 FCCCNCc1cnc(cn1)Br 22e6ef1b79a26135a89c09b0e4e90d8e [0,2,0,0,0,0|2,0,0]=4 7236 B13R1.9 FCCCNCc1cnc(cn1)Cl 7bd887eb632bca1ec5c1b4a452731334 [0,2,0,0,0,0|2,0,0]=4 7237 B13R1.9 FCCCNCc1ncc(cn1)Br 7aaf25cc574fa00dbce0da77c535d78d [0,2,0,0,0,0|2,0,0]=4 7238 B13R1.9 FCCCNCc1ncc(cn1)Cl 1b9cee92933e72aa97e02b12c7a8b65b [0,2,0,0,0,0|2,0,0]=4 7239 B13R1.9 FCCCNCc1ncc(cn1)F b62175318219c7527ec202c538f68b40 [0,2,0,0,0,0|2,0,0]=4 7240 B13R1.9 FCCCOCc1ccc(cc1)Br 3487dad162839ab6a8f65efaca12212b [0,2,0,0,0,0|2,0,0]=4 7241 B13R1.9 FCCCOCc1ccc(cc1)Cl 01ac1830dd0655045679f4787580c5b9 [0,2,0,0,0,0|2,0,0]=4 7242 B13R1.9 FCCCOCc1ccc(cc1)F 6f2aac3f001e32c461aed5a596516f3e [0,2,0,0,0,0|2,0,0]=4 7243 B13R1.9 FCCCOCc1ccc(cc1)I 2e18197588d8474de8e53049cfacb05f [0,2,0,0,0,0|2,0,0]=4 7244 B13R1.9 FCCCOCc1ccc(cc1)S 1338430e636876981dced038dd9cebcb [0,2,0,0,0,0|2,0,0]=4 7245 B13R1.9 FCCCOCc1ccc(cn1)Br 860ff2160a2744dc1e1430d045de600f [0,2,0,0,0,0|1,0,0]=3 7246 B13R1.9 FCCCOCc1ccc(cn1)Cl 09c09d8be5de48a0d986b9d958ccd9d9 [0,2,0,0,0,0|1,0,0]=3 7247 B13R1.9 FCCCOCc1ccc(cn1)F efd82ba4bc98dd95672085c225656fc5 [0,2,0,0,0,0|1,0,0]=3 7248 B13R1.9 FCCCOCc1ccc(cn1)I f9f585d4ee3d5ea2f80ff4abaa435a53 [0,2,0,0,0,0|1,0,0]=3 7249 B13R1.9 FCCCOCc1ccc(nn1)Cl 49eb717f37f2e83f7c31dd3c3481123e [0,2,0,0,0,0|2,0,0]=4 7250 B13R1.9 FCCCOCc1cnc(cn1)Br a80313e55cca63dd3db8ae3698d4d727 [0,2,0,0,0,0|2,0,0]=4 7251 B13R1.9 FCCCOCc1cnc(cn1)Cl bccb7c29bc3f9d346ff5ac7a6d92fb00 [0,2,0,0,0,0|2,0,0]=4 7252 B13R1.9 FCCCOCc1ncc(cn1)Br 57a3301d304fa575137cabee3d1b2873 [0,2,0,0,0,0|2,0,0]=4 7253 B13R1.9 FCCCOCc1ncc(cn1)Cl eee9c5c653cf2a6cc41d3dcb569b445b [0,2,0,0,0,0|2,0,0]=4 7254 B13R1.9 FCCCOCc1ncc(cn1)F ac50d9ca9f5f0b7a33b33f945c840211 [0,2,0,0,0,0|2,0,0]=4 7255 B13R1.9 FCCNCCc1ccc(cc1)Br 48d58bdfcd03373b9e21211adca3bded [0,2,0,0,0,0|2,0,0]=4 7256 B13R1.9 FCCNCCc1ccc(cc1)Cl 4dc495a6543aaba973c0a080b1b0ec32 [0,2,0,0,0,0|2,0,0]=4 7257 B13R1.9 FCCNCCc1ccc(cc1)F 0792d4ddb11a68f486516e584f621bb2 [0,2,0,0,0,0|2,0,0]=4 7258 B13R1.9 FCCNCCc1ccc(cc1)I 54965804c6b9a028e9cca0af74e28854 [0,2,0,0,0,0|2,0,0]=4 7259 B13R1.9 FCCNCCc1ccc(cn1)Br aa32d30220dcba9aa8e30ac0a3e98c96 [0,2,0,0,0,0|1,0,0]=3 7260 B13R1.9 FCCOCCc1ccc(cc1)Br a9c20330ba625b530575e45bf9a80faa [0,2,0,0,0,0|2,0,0]=4 7261 B13R1.9 FCCOCCc1ccc(cc1)Cl 75eab43b44f2240365d659b439dd708c [0,2,0,0,0,0|2,0,0]=4 7262 B13R1.9 FCCOCCc1ccc(cc1)F 31e7e6dcd7dcdb8039e1d409d5442f09 [0,2,0,0,0,0|2,0,0]=4 7263 B13R1.9 FCCOCCc1ccc(cc1)I 7606588fdf32989e50c66f721669960b [0,2,0,0,0,0|2,0,0]=4 7264 B13R1.9 FCCOCCc1ccc(cn1)Br 2804daf157fb463723be6f37232f39d8 [0,2,0,0,0,0|1,0,0]=3 7265 B13R1.9 FCCOCCc1ccc(cn1)F 70e6d03d8c9778f4f124c54db1f11428 [0,2,0,0,0,0|1,0,0]=3 7266 B13R1.9 FCCOCCc1ncc(cn1)Br 16b52ade3e813d3c6c64160d8cddfb45 [0,2,0,0,0,0|2,0,0]=4 7267 B13R1.9 FCNCCCc1ccc(cc1)Br ed6b7125055fed6bfd4d639cd17bfcf7 [0,2,0,0,0,0|2,0,0]=4 7268 B13R1.9 FCNCCCc1ccc(cc1)Cl eeb145ea005489849e6c491e5dd439a6 [0,2,0,0,0,0|2,0,0]=4 7269 B13R1.9 FCNCCCc1ccc(cc1)F 7c9fbab4d1a0b03f36fc869f1a5fd700 [0,2,0,0,0,0|2,0,0]=4 7270 B13R1.9 FCOCCCc1ccc(cc1)Br d054e1020b29788c0143d1e9b0f90ca2 [0,2,0,0,0,0|2,0,0]=4 7271 B13R1.9 FCOCCCc1ccc(cc1)Cl 5894eb66f9c0f0808ada9ae1863945c1 [0,2,0,0,0,0|2,0,0]=4 7272 B13R1.9 FCOCCCc1ccc(cc1)F 40bf756b307f683b48c3bc66794a8556 [0,2,0,0,0,0|2,0,0]=4 7273 B13R1.9 FCOCCOc1ccc(cn1)Br 21c860fdd1786490eef846882c40bf20 [0,2,0,0,0,0|2,0,0]=4 7274 B13R1.9 FCOCCSc1ccc(cn1)Cl 0dafb0444a934ab81cf8206d98a391eb [0,2,0,0,0,0|2,0,0]=4 7275 B13R1.9 Fc1ccc(cc1)CCNCCBr cac4627432b1ef2810afae9de46b8571 [0,2,0,0,0,0|2,0,0]=4 7276 B13R1.9 Fc1ccc(cc1)CCNCCI 5fa66d8b4a585e27bd812bd4f5985e66 [0,2,0,0,0,0|2,0,0]=4 7277 B13R1.9 Fc1ccc(cc1)CCNCCS e5de0903cac3a47ea9ea865880228ae3 [0,2,0,0,0,0|2,0,0]=4 7278 B13R1.9 Fc1ccc(cc1)CCOCCS c3db509dd064f9261aaad31cb139b44c [0,2,0,0,0,0|2,0,0]=4 7279 B13R1.9 Fc1ccc(cc1)CNCCCCl 91e7df02fb50f31ccbd2f620f8c3bd29 [0,2,0,0,0,0|2,0,0]=4 7280 B13R1.9 Fc1ccc(cc1)CNCCCS c67b826185b357c657c1df2bf07faa65 [0,2,0,0,0,0|2,0,0]=4 7281 B13R1.9 Fc1ccc(cc1)COCCCS 211f7b16847e33bf74fba5de40b6d4fc [0,2,0,0,0,0|2,0,0]=4 7282 B13R1.9 Fc1ccc(cc1)NCCCCCl 12e95f0fbf75d6fcd3d8b02ea7478d9c [0,2,0,0,0,0|2,0,0]=4 7283 B13R1.9 Fc1ccc(cc1)NCCCCS c0131bb8565a07e83eb5c580c281045a [0,2,0,0,0,0|2,0,0]=4 7284 B13R1.9 Fc1ccc(nc1)CCOCCS a5233e48cf04d29c6d4e00d3fe01cae1 [0,2,0,0,0,0|1,0,0]=3 7285 B13R1.9 Fc1ccc(nc1)CNCCCCl 2ae7804167880c39ca5a7022cc7116a6 [0,2,0,0,0,0|1,0,0]=3 7286 B13R1.9 Fc1ccc(nc1)CNCCCS 329ce6f7940e091e2bf9751f61fe7d62 [0,2,0,0,0,0|1,0,0]=3 7287 B13R1.9 Fc1ccc(nc1)COCCCS 548ae7365ba2d854cebcd7aa70d40d9e [0,2,0,0,0,0|1,0,0]=3 7288 B13R1.9 Fc1ccc(nc1)NCCCCCl 3c56872021eac1254a9b9b058ed7e235 [0,2,0,0,0,0|1,0,0]=3 7289 B13R1.9 Fc1ccc(nn1)NCCCCCl fe8b7c31f7ebd258b86a04b2ebfb1710 [0,2,0,0,0,0|2,0,0]=4 7290 B13R1.9 Fc1ccc(nn1)NCCCCS 9eb58694efa1f170a582607bd05562cc [0,2,0,0,0,0|2,0,0]=4 7291 B13R1.9 Fc1cnc(nc1)CNCCCCl 1683f398d88c7cafdcf66094af74e7e1 [0,2,0,0,0,0|2,0,0]=4 7292 B13R1.9 Fc1cnc(nc1)CNCCCS d29eee40173a2d36e9271721f49e6b76 [0,2,0,0,0,0|2,0,0]=4 7293 B13R1.9 Fc1cnc(nc1)COCCCS 65de2b54323ae5bb8e625226c9377830 [0,2,0,0,0,0|2,0,0]=4 7294 B13R1.9 Fc1cnc(nc1)NCCCCCl c5f3e9886a6785f0927dc030501dfd09 [0,2,0,0,0,0|2,0,0]=4 7295 B13R1.9 ICCNCCc1ccc(cc1)I dadec2876e223f404c206d0d9bc117ba [0,2,0,0,0,0|2,0,0]=4 7296 B13R1.9 N#CCCCNc1ccc(cn1)Br 89c2a4a26049da7650f183f6e7d8a7d3 [0,2,0,0,0,0|1,0,1]=4 7297 B13R1.9 N#CCCCNc1ccc(cn1)Cl e2f4f1bbc6c386733ccad769013008b4 [0,2,0,0,0,0|1,0,1]=4 7298 B13R1.9 N#CCCCNc1ccc(cn1)F 5a055458062dfd5b6cff4b81a185b744 [0,2,0,0,0,0|1,0,1]=4 7299 B13R1.9 N#CCCCNc1ccc(cn1)I a26142df903c250f1b2aeac583dd9c10 [0,2,0,0,0,0|1,0,1]=4 7300 B13R1.9 N#CCCCOc1ccc(cn1)Cl d0bd22e35fba9c2e3fe310c292f8961a [0,2,0,0,0,0|1,0,1]=4 7301 B13R1.9 N#CCCCOc1ccc(cn1)F 5ca119014565bd08b449bd661b697167 [0,2,0,0,0,0|1,0,1]=4 7302 B13R1.9 N#CCCCOc1ccc(cn1)I 36d2a32aa810aa850398993947d7f96c [0,2,0,0,0,0|1,0,1]=4 7303 B13R1.9 N#CCCNCc1ccc(cn1)Br c354a132ed2609cf38ecec56259c83ba [0,2,0,0,0,0|1,0,1]=4 7304 B13R1.9 N#CCCNCc1ccc(cn1)Cl d4e85a8e16cabc8839de67dea97b3820 [0,2,0,0,0,0|1,0,1]=4 7305 B13R1.9 N#CCCNCc1ccc(cn1)F 25ba53067b994f40b7752ba0a8f8ce14 [0,2,0,0,0,0|1,0,1]=4 7306 B13R1.9 N#CCCOCc1ccc(cn1)Br 30615a78f954a34a29fdc476df5aa733 [0,2,0,0,0,0|1,0,1]=4 7307 B13R1.9 N#CCCOCc1ccc(cn1)Cl 1e627d7995a4fbb19db155c4a09eb33c [0,2,0,0,0,0|1,0,1]=4 7308 B13R1.9 N#CCCOCc1ccc(cn1)F d14f4e329bb3bdbf045138d0f1e66444 [0,2,0,0,0,0|1,0,1]=4 7309 B13R1.9 N#CCCOCc1ccc(cn1)I 4d49ba5ee90077550a99c58a4fda3b82 [0,2,0,0,0,0|1,0,1]=4 7310 B13R1.9 N#CCNCCc1ccc(cn1)Br 7e673c990849108445eab0500727a97d [0,2,0,0,0,0|1,0,1]=4 7311 B13R1.9 N#CCOCCc1ccc(cn1)Br 43867f00513de310b1a715abcd513155 [0,2,0,0,0,0|1,0,1]=4 7312 B13R1.9 N#CCOCCc1ccc(cn1)F 4deb14054b0d646245df5c0398fa6e80 [0,2,0,0,0,0|1,0,1]=4 7313 B13R1.9 NOCCNCc1ccc(cn1)Br 4beb4f28e0adf7a7debe16dfd945e02b [0,2,0,0,0,0|2,0,0]=4 7314 B13R1.9 NOCCNCc1ccc(cn1)Cl 1d3e6c2c53d5096fb942b61b7314482b [0,2,0,0,0,0|2,0,0]=4 7315 B13R1.9 NOCCNCc1ccc(cn1)F 7dc28af16544e6808715b9209e51d580 [0,2,0,0,0,0|2,0,0]=4 7316 B13R1.9 O=CCCCNc1ccc(cn1)Br aa9c9b033482fc841b186dcfa2f802b9 [0,2,0,0,0,0|1,0,1]=4 7317 B13R1.9 O=CCCCNc1ccc(cn1)Cl d107104df068b8172ab7b35c6dd1411e [0,2,0,0,0,0|1,0,1]=4 7318 B13R1.9 O=CCCCNc1ccc(cn1)F 2e3b3c7c9ed87fbf5cfa9381ad6d80f6 [0,2,0,0,0,0|1,0,1]=4 7319 B13R1.9 O=CCCCNc1ccc(cn1)I 174841a4dbb6295107974e8a27ebe778 [0,2,0,0,0,0|1,0,1]=4 7320 B13R1.9 O=CCCCOc1ccc(cn1)Cl 2cbcc3afa46841e720ddd8f18d465182 [0,2,0,0,0,0|1,0,1]=4 7321 B13R1.9 O=CCCCOc1ccc(cn1)F 0653e855bee277610aeb7aeca64fb316 [0,2,0,0,0,0|1,0,1]=4 7322 B13R1.9 O=CCCCOc1ccc(cn1)I a7df039882329043039d3d328990556b [0,2,0,0,0,0|1,0,1]=4 7323 B13R1.9 O=CCCNCc1ccc(cn1)Br c3937ab1b214be34078ed74ba1790881 [0,2,0,0,0,0|1,0,1]=4 7324 B13R1.9 O=CCCNCc1ccc(cn1)Cl 986809e71d693688d3b5d755a19c467b [0,2,0,0,0,0|1,0,1]=4 7325 B13R1.9 O=CCCNCc1ccc(cn1)F 894e6e39d9c4679b7ebb779b213d4155 [0,2,0,0,0,0|1,0,1]=4 7326 B13R1.9 O=CCCOCc1ccc(cn1)Br 7d794e9f28ae8864613bac7fd05368e0 [0,2,0,0,0,0|1,0,1]=4 7327 B13R1.9 O=CCCOCc1ccc(cn1)Cl 69c49ffafe2523b39051c7dbf87be157 [0,2,0,0,0,0|1,0,1]=4 7328 B13R1.9 O=CCCOCc1ccc(cn1)F ee91069a626ac488bf4eea83015cdfcd [0,2,0,0,0,0|1,0,1]=4 7329 B13R1.9 O=CCCOCc1ccc(cn1)I b951e17f543aaa1885a2d64b002ff732 [0,2,0,0,0,0|1,0,1]=4 7330 B13R1.9 O=CCNCCc1ccc(cn1)Br f31aa6e346ef71871326ec0be2eeda6a [0,2,0,0,0,0|1,0,1]=4 7331 B13R1.9 O=CCOCCc1ccc(cn1)Br 28ce574fc6dfdf4296e5871714e1612b [0,2,0,0,0,0|1,0,1]=4 7332 B13R1.9 O=CCOCCc1ccc(cn1)F 1a3c9619a0350dad6dc66f5f6057cfa4 [0,2,0,0,0,0|1,0,1]=4 7333 B13R1.9 O=c1ccc(n[nH]1)NCCCCCl 547a002422e5eecda75cc74b4265973e [0,2,0,0,0,0|2,0,0]=4 7334 B13R1.9 O=c1ccc(n[nH]1)NCCCCO eeb68eb7c84c484cedea0aa62263aea0 [0,2,0,0,0,0|2,0,0]=4 7335 B13R1.9 OCCCCNc1c[nH]c(=S)cn1 5a5dba2f173d815fc474268af4982492 [0,2,0,0,0,0|2,0,0]=4 7336 B13R1.9 OCCCCNc1ccc(cc1)Br 410825679ceecb13320d0218ab0254f9 [0,2,0,0,0,0|2,0,0]=4 7337 B13R1.9 OCCCCNc1ccc(cc1)Cl e55d4c244787bc00c4d8952006de4ecd [0,2,0,0,0,0|2,0,0]=4 7338 B13R1.9 OCCCCNc1ccc(cc1)F 9270bd1a565db66acd80900d7dc18663 [0,2,0,0,0,0|2,0,0]=4 7339 B13R1.9 OCCCCNc1ccc(cc1)I 9e1c3120af712761b0e2ffe9dd585350 [0,2,0,0,0,0|2,0,0]=4 7340 B13R1.9 OCCCCNc1ccc(cc1)S 14f1e1839adb156da61c3106f3cc3a1a [0,2,0,0,0,0|2,0,0]=4 7341 B13R1.9 OCCCCNc1ccc(cn1)Br d6ab31e4cc3ef535e22131c9bf84404a [0,2,0,0,0,0|1,0,0]=3 7342 B13R1.9 OCCCCNc1ccc(cn1)Cl b02ee3fca414a2fcc001c0527374c902 [0,2,0,0,0,0|1,0,0]=3 7343 B13R1.9 OCCCCNc1ccc(cn1)F 35f4b8b1e5ac61f9dda049fb61274839 [0,2,0,0,0,0|1,0,0]=3 7344 B13R1.9 OCCCCNc1ccc(cn1)I 94dd9bfb1d83212f723a5c278f2e6d39 [0,2,0,0,0,0|1,0,0]=3 7345 B13R1.9 OCCCCNc1ccc(nn1)Br 67c9a33e7c86cc864cdc3b3374b7a2ac [0,2,0,0,0,0|2,0,0]=4 7346 B13R1.9 OCCCCNc1ccc(nn1)Cl d01d4c05bffc25ba0d416bcd45e3ff7f [0,2,0,0,0,0|2,0,0]=4 7347 B13R1.9 OCCCCNc1ccc(nn1)F 2a305682a5ca76706cd7fc3e87daa63f [0,2,0,0,0,0|2,0,0]=4 7348 B13R1.9 OCCCCNc1ccc(nn1)I 1993eee0af4afa5b82a7284e703f5b11 [0,2,0,0,0,0|2,0,0]=4 7349 B13R1.9 OCCCCNc1cnc(cn1)Br 8642bddfdf08f600211af631df586267 [0,2,0,0,0,0|2,0,0]=4 7350 B13R1.9 OCCCCNc1cnc(cn1)Cl 11d2d2ca9de4c0ae2f72e88b44cffbc2 [0,2,0,0,0,0|2,0,0]=4 7351 B13R1.9 OCCCCNc1cnc(cn1)I c62c21786fe9870dd82a0ad649178a50 [0,2,0,0,0,0|2,0,0]=4 7352 B13R1.9 OCCCCNc1ncc(cn1)Br 7a6e69ba3dbc5c12fdd4d496185ca66e [0,2,0,0,0,0|2,0,0]=4 7353 B13R1.9 OCCCCNc1ncc(cn1)Cl 571c097d46c6fbe8ed300819ebb47520 [0,2,0,0,0,0|2,0,0]=4 7354 B13R1.9 OCCCCNc1ncc(cn1)F 97f49b27611ec16f654dd67149bbf011 [0,2,0,0,0,0|2,0,0]=4 7355 B13R1.9 OCCCCNc1ncc(cn1)I 02fd2382925f926282ec2f1c6f463e49 [0,2,0,0,0,0|2,0,0]=4 7356 B13R1.9 OCCCNCc1ccc(cc1)Br 996284a7afb7096a1311c59036978f1d [0,2,0,0,0,0|2,0,0]=4 7357 B13R1.9 OCCCNCc1ccc(cc1)Cl 1abf0371cf4d37820164ca7f3c01186a [0,2,0,0,0,0|2,0,0]=4 7358 B13R1.9 OCCCNCc1ccc(cc1)F 3f0c80b84619317f12d13380814a6f75 [0,2,0,0,0,0|2,0,0]=4 7359 B13R1.9 OCCCNCc1ccc(cc1)I df4361b21f161091fe571dd151cfb750 [0,2,0,0,0,0|2,0,0]=4 7360 B13R1.9 OCCCNCc1ccc(cn1)Br 885f1e08fd5bcee1593974115fd960de [0,2,0,0,0,0|1,0,0]=3 7361 B13R1.9 OCCCNCc1ccc(cn1)Cl 4e37210c690a7ef62388fb05507429dc [0,2,0,0,0,0|1,0,0]=3 7362 B13R1.9 OCCCNCc1ccc(cn1)F 10d3b206ea2ed1f78d2f925c4684bf90 [0,2,0,0,0,0|1,0,0]=3 7363 B13R1.9 OCCCNCc1ccc(nn1)Cl cfd25c79d6bd781cbfa73eb2dc889247 [0,2,0,0,0,0|2,0,0]=4 7364 B13R1.9 OCCCNCc1cnc(cn1)Br 489964eaf3ee86f552add9f3348cab80 [0,2,0,0,0,0|2,0,0]=4 7365 B13R1.9 OCCCNCc1cnc(cn1)Cl 7ea0d482e0d043378c78dd89f4a8c049 [0,2,0,0,0,0|2,0,0]=4 7366 B13R1.9 OCCCNCc1ncc(cn1)Br 31cfa53f4091606a7009ed450311ac14 [0,2,0,0,0,0|2,0,0]=4 7367 B13R1.9 OCCCNCc1ncc(cn1)Cl 3ed13992cc96f2211df117815e6a8d0a [0,2,0,0,0,0|2,0,0]=4 7368 B13R1.9 OCCCNCc1ncc(cn1)F 408c9ee7e65b06d58369b6fbedbafa0a [0,2,0,0,0,0|2,0,0]=4 7369 B13R1.9 OCCNCCc1ccc(cc1)Br a34de29c47ce3c87ea48c87b875be930 [0,2,0,0,0,0|2,0,0]=4 7370 B13R1.9 OCCNCCc1ccc(cc1)Cl 39fa8ac73fcafb1e02b9de5435a4adb5 [0,2,0,0,0,0|2,0,0]=4 7371 B13R1.9 OCCNCCc1ccc(cc1)F a619feb5707002c49ce490352da323fa [0,2,0,0,0,0|2,0,0]=4 7372 B13R1.9 OCCNCCc1ccc(cc1)I 18a151fddd7975041a90d15bb4c36e75 [0,2,0,0,0,0|2,0,0]=4 7373 B13R1.9 OCCNCCc1ccc(cn1)Br 970bc7f316d437dd7c96594b54f09273 [0,2,0,0,0,0|1,0,0]=3 7374 B13R1.9 OCNCCCc1ccc(cc1)Br 0bf9780769df558170f2719fa7bbf1c3 [0,2,0,0,0,0|2,0,0]=4 7375 B13R1.9 OCNCCCc1ccc(cc1)Cl 515b58fcbf5a0db2760588055b2d747a [0,2,0,0,0,0|2,0,0]=4 7376 B13R1.9 OCNCCCc1ccc(cc1)F 14d8f8ce0b4dd03872b1c8ed544d9aa1 [0,2,0,0,0,0|2,0,0]=4 7377 B13R1.9 OCNCCOc1ccc(cn1)Br a49bbc0e7b6837c44f4010301a08ab34 [0,2,0,0,0,0|2,0,0]=4 7378 B13R1.9 Oc1ccc(cc1)NCCCCCl 9558d1e77fd848b068ffdc9c47c6a973 [0,2,0,0,0,0|2,0,0]=4 7379 B13R1.9 Oc1ccc(nc1)NCCCCCl 4ff7e822965275f6c63f01d80aa03aa7 [0,2,0,0,0,0|1,0,0]=3 7380 B13R1.9 S=c1cnc(c[nH]1)NCCCCCl 5a0aa92ece585d0dee01b53776c78f2d [0,2,0,0,0,0|2,0,0]=4 7381 B13R1.9 S=c1cnc(c[nH]1)NCCCCS 02bbac852828dfea2a5e0aa4d7641f31 [0,2,0,0,0,0|2,0,0]=4 7382 B13R1.9 SCCCCNc1ccc(cc1)S 62e6fea7d8eab61f641fe165f2223453 [0,2,0,0,0,0|2,0,0]=4 7383 B13R1.9 SCCCNCc1ccc(cc1)Br dcf3e203274c54f219e1b5fb03496f48 [0,2,0,0,0,0|2,0,0]=4 7384 B13R1.9 SCCCNCc1ccc(cc1)Cl a21e40083a543c124907e66edfd5714a [0,2,0,0,0,0|2,0,0]=4 7385 B13R1.9 SCCCNCc1ccc(cc1)I ccb81aade5c872cd5edbb73b499c8164 [0,2,0,0,0,0|2,0,0]=4 7386 B13R1.9 SCCCNCc1ccc(cn1)Br ed18cd27ca2ad29d22ae776e643799ba [0,2,0,0,0,0|1,0,0]=3 7387 B13R1.9 SCCCNCc1ccc(cn1)Cl a9692130052830a5b49bf9b446491de6 [0,2,0,0,0,0|1,0,0]=3 7388 B13R1.9 SCCCNCc1ccc(nn1)Cl 25fe716570b29c04e552d0ab1b82eb08 [0,2,0,0,0,0|2,0,0]=4 7389 B13R1.9 SCCCNCc1cnc(cn1)Br ed072771f1ab0121b31d5ee9b0c7d244 [0,2,0,0,0,0|2,0,0]=4 7390 B13R1.9 SCCCNCc1cnc(cn1)Cl beeb87b20f78282a14e08aebb0a5f2f6 [0,2,0,0,0,0|2,0,0]=4 7391 B13R1.9 SCCCNCc1ncc(cn1)Br e8c8cbd2245d7fcd2138d8e150257fcf [0,2,0,0,0,0|2,0,0]=4 7392 B13R1.9 SCCCNCc1ncc(cn1)Cl d0a6e9911464447211ae517282e5de24 [0,2,0,0,0,0|2,0,0]=4 7393 B13R1.9 SCCCOCc1ccc(cc1)Br ff6719c5ff41f48ef2321733cf5b3363 [0,2,0,0,0,0|2,0,0]=4 7394 B13R1.9 SCCCOCc1ccc(cc1)Cl 240d366a2cf8bd9c66779656f876084b [0,2,0,0,0,0|2,0,0]=4 7395 B13R1.9 SCCCOCc1ccc(cc1)I 40a47f1db7473da10079c8a0a6b3b4ad [0,2,0,0,0,0|2,0,0]=4 7396 B13R1.9 SCCCOCc1ccc(cc1)S c3cec2afcc144465eda56cf0331fbc69 [0,2,0,0,0,0|2,0,0]=4 7397 B13R1.9 SCCCOCc1ccc(cn1)Br 8a53910f406051feb4f480a943c49393 [0,2,0,0,0,0|1,0,0]=3 7398 B13R1.9 SCCCOCc1ccc(cn1)Cl 20cafbbf7451f9fa5e95efeeb6ae3fed [0,2,0,0,0,0|1,0,0]=3 7399 B13R1.9 SCCCOCc1ccc(cn1)I a855dc70b7c7898d67c09439b32e5a48 [0,2,0,0,0,0|1,0,0]=3 7400 B13R1.9 SCCCOCc1ccc(nn1)Cl 5144303a35eefc3ba4696860948c2f4c [0,2,0,0,0,0|2,0,0]=4 7401 B13R1.9 SCCCOCc1cnc(cn1)Br 0990911d1f8d3c92d840ffcc75296510 [0,2,0,0,0,0|2,0,0]=4 7402 B13R1.9 SCCCOCc1cnc(cn1)Cl 121601493ee88513ea7d66546685d8fa [0,2,0,0,0,0|2,0,0]=4 7403 B13R1.9 SCCCOCc1ncc(cn1)Br e67bc05a803a70a223e753ee68930f7d [0,2,0,0,0,0|2,0,0]=4 7404 B13R1.9 SCCCOCc1ncc(cn1)Cl 810294db1be121954f34b865764fa74b [0,2,0,0,0,0|2,0,0]=4 7405 B13R1.9 SCCNCCc1ccc(cc1)Br 76e355414f32e53af3a6a6cc035b2ffc [0,2,0,0,0,0|2,0,0]=4 7406 B13R1.9 SCCNCCc1ccc(cc1)Cl 7759885c32d21d870503c45d158be53f [0,2,0,0,0,0|2,0,0]=4 7407 B13R1.9 SCCNCCc1ccc(cc1)I 532729fa98f384e9ea977dcce19cda63 [0,2,0,0,0,0|2,0,0]=4 7408 B13R1.9 SCCNCCc1ccc(cn1)Br 80a72294f548e69455b866bb1c599333 [0,2,0,0,0,0|1,0,0]=3 7409 B13R1.9 SCCOCCc1ccc(cc1)Br 6723c6e799ded4063092ef89a3278e61 [0,2,0,0,0,0|2,0,0]=4 7410 B13R1.9 SCCOCCc1ccc(cc1)Cl cc90186262b1316f00b9bbad3efdfe9e [0,2,0,0,0,0|2,0,0]=4 7411 B13R1.9 SCCOCCc1ccc(cc1)I 4e507496c3892b7015322085979499eb [0,2,0,0,0,0|2,0,0]=4 7412 B13R1.9 SCCOCCc1ccc(cn1)Br 03e2f7e6a976dc0d27e9032b436c090e [0,2,0,0,0,0|1,0,0]=3 7413 B13R1.9 SCCOCCc1ncc(cn1)Br 5d45c302249911bbd0c5afa9ad0b01ad [0,2,0,0,0,0|2,0,0]=4 7414 B13R1.9 Sc1ccc(cc1)NCCCCCl 8a1468941a5ea55570fa3d70b4b787af [0,2,0,0,0,0|2,0,0]=4 7415 B13R1.9 Sc1ccc(nc1)NCCCCCl e35591a4a98de98bbbe86b65a01a0202 [0,2,0,0,0,0|1,0,0]=3 7416 B13R1.9 Sc1ccc(nn1)NCCCCCl c51a0d799e2e67b7ffab98a16e5280b1 [0,2,0,0,0,0|2,0,0]=4 7417 B13R1.14 C=C(CC)CNc1ccc(cn1)Br a350653eff61c8f81ab59edf1588d2f2 [0,2,0,0,0,0|1,0,1]=4 7418 B13R1.14 C=C(CC)CNc1ccc(cn1)C f79367cf3213e5471247f7178d43d5ab [0,2,0,0,0,0|1,0,1]=4 7419 B13R1.14 C=C(CC)CNc1ccc(cn1)Cl 00e6f9c8fb873c94528a4a079c601cf9 [0,2,0,0,0,0|1,0,1]=4 7420 B13R1.14 C=C(CC)CNc1ccc(cn1)F 0e95e8fafdc2efa7966a4832a5027077 [0,2,0,0,0,0|1,0,1]=4 7421 B13R1.14 C=C(CC)CNc1ccc(cn1)I 87aba439e8d590ec24cff421dbc9a607 [0,2,0,0,0,0|1,0,1]=4 7422 B13R1.14 C=C(CC)COc1ccc(cn1)C 48577f59c3233d657c5a73e7c3e22bee [0,2,0,0,0,0|1,0,1]=4 7423 B13R1.14 C=C(CC)COc1ccc(cn1)Cl 8e9f9b898c347ef95a875a72bca86be3 [0,2,0,0,0,0|1,0,1]=4 7424 B13R1.14 C=C(CC)COc1ccc(cn1)I 17761bb9e463190ff87410af810d64ca [0,2,0,0,0,0|1,0,1]=4 7425 B13R1.14 CC(CF)OCc1ccc(cn1)Cl d36eb4fbffb10e8e2d8976aef175bc86 [0,2,0,0,0,0|2,0,0]=4 7426 B13R1.14 CC(CF)OCc1ccc(cn1)F aa79b49ed3787d1a8cf1f612911457ec [0,2,0,0,0,0|2,0,0]=4 7427 B13R1.14 CC(CO)CNc1ccc(cn1)Br 6bcbbc4672e5dcac897604520a46e5fb [0,2,0,0,0,0|2,0,0]=4 7428 B13R1.14 CC(CO)CNc1ccc(cn1)Cl a60ee06ade51b74ccfe6cfccc7afb6cd [0,2,0,0,0,0|2,0,0]=4 7429 B13R1.14 CC(CO)CNc1ccc(cn1)F 67e7ceae8f78987b93924e3dce1efae9 [0,2,0,0,0,0|2,0,0]=4 7430 B13R1.14 CC(CO)CNc1ccc(cn1)I 3b0dd7a528d360546e0b06f35001df8c [0,2,0,0,0,0|2,0,0]=4 7431 B13R1.14 CC(CO)NCc1ccc(cn1)Br c3a0cb54af1ce5d666850b15126f26de [0,2,0,0,0,0|2,0,0]=4 7432 B13R1.14 CC(CO)NCc1ccc(cn1)Cl a1ae107be09f06394a9de651333a7df8 [0,2,0,0,0,0|2,0,0]=4 7433 B13R1.14 CC(CO)NCc1ccc(cn1)F f5945c215b04d59800d3714923b6e6c9 [0,2,0,0,0,0|2,0,0]=4 7434 B13R1.14 CC(CS)OCc1ccc(cn1)Cl 3c28582e9d7a5d7c3802159d2e1919f0 [0,2,0,0,0,0|2,0,0]=4 7435 B13R1.14 CC(CS)OCc1ccc(cn1)F 562aee75b74fcde7edd90989489a6f1f [0,2,0,0,0,0|2,0,0]=4 7436 B13R1.14 CCC(=O)CNc1ccc(cn1)Br c3315f2224f2889a6841026d60682db5 [0,2,0,0,0,0|1,0,1]=4 7437 B13R1.14 CCC(=O)CNc1ccc(cn1)C 7e684c324613d4c58748b1e70d88a413 [0,2,0,0,0,0|1,0,1]=4 7438 B13R1.14 CCC(=O)CNc1ccc(cn1)Cl ca0ef4e8e35b6c10a4b05611d1a81675 [0,2,0,0,0,0|1,0,1]=4 7439 B13R1.14 CCC(=O)CNc1ccc(cn1)F fd40e381219eaba806c06240241d71c7 [0,2,0,0,0,0|1,0,1]=4 7440 B13R1.14 CCC(=O)CNc1ccc(cn1)I 97431800d39fa3faf372deef254ae55d [0,2,0,0,0,0|1,0,1]=4 7441 B13R1.14 CCC(=O)COc1ccc(cn1)C be047a2181abf4540db34155d45aa2df [0,2,0,0,0,0|1,0,1]=4 7442 B13R1.14 CCC(=O)COc1ccc(cn1)Cl 300ba84cfc1ad8fccf92dd56209ec304 [0,2,0,0,0,0|1,0,1]=4 7443 B13R1.14 CCC(=O)COc1ccc(cn1)F 2e9539b15053c29e33d0fc0ffab6bf79 [0,2,0,0,0,0|1,0,1]=4 7444 B13R1.14 CCC(=O)COc1ccc(cn1)I 4f6afbee44be6b9d3bb8034bff9f5d13 [0,2,0,0,0,0|1,0,1]=4 7445 B13R1.14 CCC(=O)NCc1ccc(cn1)Br 09b5c85d84215dfed66e848d35e88b4b [0,2,0,0,0,0|1,0,1]=4 7446 B13R1.14 CCC(=O)NCc1ccc(cn1)C 58f58665ed55083d49a2e24879dd91cf [0,2,0,0,0,0|1,0,1]=4 7447 B13R1.14 CCC(=O)NCc1ccc(cn1)Cl 0ccfb0c429c306fb28cede190b464de7 [0,2,0,0,0,0|1,0,1]=4 7448 B13R1.14 CCC(=O)NCc1ccc(cn1)F f1c0ca4ba1a2c2152ea45db4795230bf [0,2,0,0,0,0|1,0,1]=4 7449 B13R1.14 CCC(=O)NCc1ccc(cn1)O 07e715408bb326c8770cbf3fe760ab47 [0,2,0,0,0,0|1,0,1]=4 7450 B13R1.14 CCC(C)CNc1ccc(cc1)Br 3df817d747d198ce669d9f081ca82eb1 [0,2,0,0,0,0|2,0,0]=4 7451 B13R1.14 CCC(C)CNc1ccc(cc1)C 27dbbdf7a2357f4c041948b44febc0bd [0,2,0,0,0,0|2,0,0]=4 7452 B13R1.14 CCC(C)CNc1ccc(cc1)Cl efac779d21b9a928331a8c135df98e86 [0,2,0,0,0,0|2,0,0]=4 7453 B13R1.14 CCC(C)CNc1ccc(cc1)F 2947f8d87c5e310b333229f77b59193c [0,2,0,0,0,0|2,0,0]=4 7454 B13R1.14 CCC(C)CNc1ccc(cc1)I e0e757ddd7a5de19b5b1064b0661fc2f [0,2,0,0,0,0|2,0,0]=4 7455 B13R1.14 CCC(C)CNc1ccc(cc1)S 23839ee3e80641f07ac501a8dfcc1931 [0,2,0,0,0,0|2,0,0]=4 7456 B13R1.14 CCC(C)CNc1ccc(cn1)Br d4210bda0033bfc563adbf29816c7a4c [0,2,0,0,0,0|1,0,0]=3 7457 B13R1.14 CCC(C)CNc1ccc(cn1)C b188fd8af897a9b3000893ac82ce2d89 [0,2,0,0,0,0|1,0,0]=3 7458 B13R1.14 CCC(C)CNc1ccc(cn1)Cl 6aa18722970e8ac5d644e95dc021bc48 [0,2,0,0,0,0|1,0,0]=3 7459 B13R1.14 CCC(C)CNc1ccc(cn1)F 19555cf17fdab4a15c4925cd302bbed2 [0,2,0,0,0,0|1,0,0]=3 7460 B13R1.14 CCC(C)CNc1ccc(cn1)I 0451090a70538beae6fb34af33fefecf [0,2,0,0,0,0|1,0,0]=3 7461 B13R1.14 CCC(C)CNc1ccc(nn1)Br 694ea9d2071b177c1e83f4d33c2a29e8 [0,2,0,0,0,0|2,0,0]=4 7462 B13R1.14 CCC(C)CNc1ccc(nn1)C f2bde4d08acd0c314d4dccb4c076efbc [0,2,0,0,0,0|2,0,0]=4 7463 B13R1.14 CCC(C)CNc1ccc(nn1)Cl d85296fee8aad7bd9442c0ea15e734cc [0,2,0,0,0,0|2,0,0]=4 7464 B13R1.14 CCC(C)CNc1ccc(nn1)F bf074f8584a2f7fee3830903548f84c8 [0,2,0,0,0,0|2,0,0]=4 7465 B13R1.14 CCC(C)CNc1ccc(nn1)I 0f1d8a606ff1dfd7059831cedf2d5d4b [0,2,0,0,0,0|2,0,0]=4 7466 B13R1.14 CCC(C)CNc1cnc(cn1)Br 40cb8e58d7dec7abe84723804165707b [0,2,0,0,0,0|2,0,0]=4 7467 B13R1.14 CCC(C)CNc1cnc(cn1)C 9544bfd2a900c6c437e752c0c2408423 [0,2,0,0,0,0|2,0,0]=4 7468 B13R1.14 CCC(C)CNc1cnc(cn1)Cl 83b80d69e4639ce2d417ebe0f6f05d52 [0,2,0,0,0,0|2,0,0]=4 7469 B13R1.14 CCC(C)CNc1cnc(cn1)I c3de3e7cacfd4851f06402a802173e72 [0,2,0,0,0,0|2,0,0]=4 7470 B13R1.14 CCC(C)CNc1ncc(cn1)Br 535e46cd3b6cd0ba8544f08f30a6d41d [0,2,0,0,0,0|2,0,0]=4 7471 B13R1.14 CCC(C)CNc1ncc(cn1)C c4b7a03f09c11fb0af75bb4b9031c21d [0,2,0,0,0,0|2,0,0]=4 7472 B13R1.14 CCC(C)CNc1ncc(cn1)Cl a52505b58309fd3ddbb93824353830e8 [0,2,0,0,0,0|2,0,0]=4 7473 B13R1.14 CCC(C)CNc1ncc(cn1)F c3d09a7ccd82941277ee872ba7bcaadd [0,2,0,0,0,0|2,0,0]=4 7474 B13R1.14 CCC(C)CNc1ncc(cn1)I 272f1089681d3a9ba096c8821a7ed696 [0,2,0,0,0,0|2,0,0]=4 7475 B13R1.14 CCC(C)COc1ccc(cc1)Br 4e0b11ec03b805658dad52317340ff4c [0,2,0,0,0,0|2,0,0]=4 7476 B13R1.14 CCC(C)COc1ccc(cc1)C eff43219015a977fa29d00aed2620dc6 [0,2,0,0,0,0|2,0,0]=4 7477 B13R1.14 CCC(C)COc1ccc(cc1)Cl 19a9044da2753d70ab2fb0a6ce5c8729 [0,2,0,0,0,0|2,0,0]=4 7478 B13R1.14 CCC(C)COc1ccc(cc1)F 02b6c2ae66b6844e6c081a07b60da2dc [0,2,0,0,0,0|2,0,0]=4 7479 B13R1.14 CCC(C)COc1ccc(cc1)I 8214af71a40f4445bb9905b1cd7e134b [0,2,0,0,0,0|2,0,0]=4 7480 B13R1.14 CCC(C)COc1ccc(cc1)S e495f6c6e80d266083b0efaad9999766 [0,2,0,0,0,0|2,0,0]=4 7481 B13R1.14 CCC(C)COc1ccc(cn1)C 62f9074e752bf3e236918a18d5484f31 [0,2,0,0,0,0|1,0,0]=3 7482 B13R1.14 CCC(C)COc1ccc(cn1)Cl 9768b056cc883e02a4015898c0344433 [0,2,0,0,0,0|1,0,0]=3 7483 B13R1.14 CCC(C)COc1ccc(cn1)F aa2748c38e42b371c7328c93f4fdab00 [0,2,0,0,0,0|1,0,0]=3 7484 B13R1.14 CCC(C)COc1ccc(cn1)I 2a4b75d0ea1ce36bb24411be509a3aed [0,2,0,0,0,0|1,0,0]=3 7485 B13R1.14 CCC(C)COc1ccc(nn1)Br 81234cf282c784c96f47a0cb4f848aa3 [0,2,0,0,0,0|2,0,0]=4 7486 B13R1.14 CCC(C)COc1ccc(nn1)C f00052ea60efe785278c5dc115e2b32c [0,2,0,0,0,0|2,0,0]=4 7487 B13R1.14 CCC(C)COc1ccc(nn1)Cl b219050d552cc0067c8913d9e2e69ae7 [0,2,0,0,0,0|2,0,0]=4 7488 B13R1.14 CCC(C)COc1cnc(cn1)Br 3e0047780d22aae148aefbb4d0dd2972 [0,2,0,0,0,0|2,0,0]=4 7489 B13R1.14 CCC(C)COc1cnc(cn1)C 6e537fc17d7125c1d3e45e863d051d9a [0,2,0,0,0,0|2,0,0]=4 7490 B13R1.14 CCC(C)COc1cnc(cn1)Cl d35e28ed36f8a0cdeed7811851126bfa [0,2,0,0,0,0|2,0,0]=4 7491 B13R1.14 CCC(C)COc1cnc(cn1)I d503f8eb27b0e149a5f2001c8a7a416a [0,2,0,0,0,0|2,0,0]=4 7492 B13R1.14 CCC(C)COc1ncc(cn1)Br f4bcdca1774fb6a89bf58ee0628bbf7e [0,2,0,0,0,0|2,0,0]=4 7493 B13R1.14 CCC(C)COc1ncc(cn1)C 03c61fbc19a7ba0c990dcddcbd91a71c [0,2,0,0,0,0|2,0,0]=4 7494 B13R1.14 CCC(C)COc1ncc(cn1)F 934269c45d593f691f8f7ecfa611a3ba [0,2,0,0,0,0|2,0,0]=4 7495 B13R1.14 CCC(C)COc1ncc(cn1)I bbfc050c7cdbf878fd4a30f8ba9e4317 [0,2,0,0,0,0|2,0,0]=4 7496 B13R1.14 CCC(C)NCc1ccc(cc1)Br 4abe4f89bdf03f770736d5197e7b883b [0,2,0,0,0,0|2,0,0]=4 7497 B13R1.14 CCC(C)NCc1ccc(cc1)C f0a4a7074e963254e8f2dc9718ac8faa [0,2,0,0,0,0|2,0,0]=4 7498 B13R1.14 CCC(C)NCc1ccc(cc1)Cl e9926af688e6f6abb788f4783a5448f6 [0,2,0,0,0,0|2,0,0]=4 7499 B13R1.14 CCC(C)NCc1ccc(cc1)F b97da88900d1e386f77430e387d7fd51 [0,2,0,0,0,0|2,0,0]=4 7500 B13R1.14 CCC(C)NCc1ccc(cc1)I f28ea9682d6730c55e4b6b1783bf60da [0,2,0,0,0,0|2,0,0]=4 7501 B13R1.14 CCC(C)NCc1ccc(cn1)Br 87abdecbb6d379952e77333132b6fd1e [0,2,0,0,0,0|1,0,0]=3 7502 B13R1.14 CCC(C)NCc1ccc(cn1)C 78feb257d656b0021718b63948c33c18 [0,2,0,0,0,0|1,0,0]=3 7503 B13R1.14 CCC(C)NCc1ccc(cn1)Cl 848916c548d14eb315e88ab53c24301a [0,2,0,0,0,0|1,0,0]=3 7504 B13R1.14 CCC(C)NCc1ccc(cn1)F e81018430dd8d79db43ea0abb5bc3bd0 [0,2,0,0,0,0|1,0,0]=3 7505 B13R1.14 CCC(C)NCc1ccc(nn1)C 5382fdd80914e9f8ed399b5a2477320a [0,2,0,0,0,0|2,0,0]=4 7506 B13R1.14 CCC(C)NCc1ccc(nn1)Cl ed0aef4d5b22e647a5df0bc67f370f37 [0,2,0,0,0,0|2,0,0]=4 7507 B13R1.14 CCC(C)NCc1cnc(cn1)Br 44d47aeb2f94f5d15ac6a1239ae06116 [0,2,0,0,0,0|2,0,0]=4 7508 B13R1.14 CCC(C)NCc1cnc(cn1)Cl a03aeb72fe3faa7d5769166d8ade938f [0,2,0,0,0,0|2,0,0]=4 7509 B13R1.14 CCC(C)NCc1ncc(cn1)Br b9a3c3c2a64b6b2ad4aea0527f65421d [0,2,0,0,0,0|2,0,0]=4 7510 B13R1.14 CCC(C)NCc1ncc(cn1)C 608a7c9c0c1fe1d2ebe9dc175f093929 [0,2,0,0,0,0|2,0,0]=4 7511 B13R1.14 CCC(C)NCc1ncc(cn1)Cl 22037911414bfb6e4a8d843a6575eb7a [0,2,0,0,0,0|2,0,0]=4 7512 B13R1.14 CCC(C)NCc1ncc(cn1)F ab91860bed165c5910e99e9c81ea580c [0,2,0,0,0,0|2,0,0]=4 7513 B13R1.14 CCC(C)OCc1ccc(cc1)Br c908b2ace910cbc167d0544d6712f6a4 [0,2,0,0,0,0|2,0,0]=4 7514 B13R1.14 CCC(C)OCc1ccc(cc1)C 88e39972550558e6f250df35da5c8f51 [0,2,0,0,0,0|2,0,0]=4 7515 B13R1.14 CCC(C)OCc1ccc(cc1)Cl 85bfb26d4e95965551c3bf1f664473b8 [0,2,0,0,0,0|2,0,0]=4 7516 B13R1.14 CCC(C)OCc1ccc(cc1)F 6a95bdc8f823980b54e4ce2f3815ca72 [0,2,0,0,0,0|2,0,0]=4 7517 B13R1.14 CCC(C)OCc1ccc(cc1)I 71389b9036f82c94c2cbc3112dba3565 [0,2,0,0,0,0|2,0,0]=4 7518 B13R1.14 CCC(C)OCc1ccc(cc1)S a07d1c91304f65ef652f1327ecfa1c66 [0,2,0,0,0,0|2,0,0]=4 7519 B13R1.14 CCC(C)OCc1ccc(cn1)Br 32c4bfba07b4930a7e2533bb894451e6 [0,2,0,0,0,0|1,0,0]=3 7520 B13R1.14 CCC(C)OCc1ccc(cn1)C 2ef8789c49abb25ff734756a71e28358 [0,2,0,0,0,0|1,0,0]=3 7521 B13R1.14 CCC(C)OCc1ccc(cn1)Cl 0adbc554ecff8859017202dc7ae6d12d [0,2,0,0,0,0|1,0,0]=3 7522 B13R1.14 CCC(C)OCc1ccc(cn1)F 12dbacf3112cdd50215f3e470799adaf [0,2,0,0,0,0|1,0,0]=3 7523 B13R1.14 CCC(C)OCc1ccc(cn1)I 2f5def68f7efa4ec9867d0a4725f3b6e [0,2,0,0,0,0|1,0,0]=3 7524 B13R1.14 CCC(C)OCc1ccc(nn1)C 482304aaf144cc18f54b0592d62f05f5 [0,2,0,0,0,0|2,0,0]=4 7525 B13R1.14 CCC(C)OCc1ccc(nn1)Cl 99e6f35dc124674bda0bdcff37a95396 [0,2,0,0,0,0|2,0,0]=4 7526 B13R1.14 CCC(C)OCc1cnc(cn1)Br 02d543291d81835c9ea6f8489106141a [0,2,0,0,0,0|2,0,0]=4 7527 B13R1.14 CCC(C)OCc1cnc(cn1)Cl f1b6c822e0dfbf50a6596dd93eb62f00 [0,2,0,0,0,0|2,0,0]=4 7528 B13R1.14 CCC(C)OCc1ncc(cn1)Br a6c91de57498daf5b3f7607d9f707eee [0,2,0,0,0,0|2,0,0]=4 7529 B13R1.14 CCC(C)OCc1ncc(cn1)C 050ea6993c533f259df9e5e2f14a8928 [0,2,0,0,0,0|2,0,0]=4 7530 B13R1.14 CCC(C)OCc1ncc(cn1)Cl 32dc5f35683d0c3cd6e62448866eb897 [0,2,0,0,0,0|2,0,0]=4 7531 B13R1.14 CCC(C)OCc1ncc(cn1)F d8e32b72e1f3c3631b3431589a2d93bf [0,2,0,0,0,0|2,0,0]=4 7532 B13R1.14 CCC(O)CNc1ccc(cc1)Br 85278c2a5439604a9cc456d3fa54fa69 [0,2,0,0,0,0|2,0,0]=4 7533 B13R1.14 CCC(O)CNc1ccc(cc1)C 76ed7b0e60701492d6725bd54ecb8238 [0,2,0,0,0,0|2,0,0]=4 7534 B13R1.14 CCC(O)CNc1ccc(cc1)Cl 7dbf0f0a39916a4889bdaee77391db52 [0,2,0,0,0,0|2,0,0]=4 7535 B13R1.14 CCC(O)CNc1ccc(cc1)F 17ce13945c4af67b3135bee802662aa1 [0,2,0,0,0,0|2,0,0]=4 7536 B13R1.14 CCC(O)CNc1ccc(cc1)I 02573c0d66d226307ecada73619e29a4 [0,2,0,0,0,0|2,0,0]=4 7537 B13R1.14 CCC(O)CNc1ccc(cc1)S 191aba248fac4ace960d4e27ee515590 [0,2,0,0,0,0|2,0,0]=4 7538 B13R1.14 CCC(O)CNc1ccc(cn1)Br b3e14de92476ecf616c37b977417ed6c [0,2,0,0,0,0|1,0,0]=3 7539 B13R1.14 CCC(O)CNc1ccc(cn1)C cfb66118ebdd3ecfd279fe6010d28d3a [0,2,0,0,0,0|1,0,0]=3 7540 B13R1.14 CCC(O)CNc1ccc(cn1)Cl 7a7ede32f850153a672ee933b3070e74 [0,2,0,0,0,0|1,0,0]=3 7541 B13R1.14 CCC(O)CNc1ccc(cn1)F ed8dde4c0c914efb05ca213e2a1d42d0 [0,2,0,0,0,0|1,0,0]=3 7542 B13R1.14 CCC(O)CNc1ccc(cn1)I 689840b5f3d3c0df69413f3fd9046a2e [0,2,0,0,0,0|1,0,0]=3 7543 B13R1.14 CCC(O)CNc1ccc(nn1)C 29d94610a8a1976989b7de3b8bb12f96 [0,2,0,0,0,0|2,0,0]=4 7544 B13R1.14 CCC(O)CNc1ccc(nn1)Cl b75c3ddb9c3db417df9126828f01c002 [0,2,0,0,0,0|2,0,0]=4 7545 B13R1.14 CCC(O)CNc1ccc(nn1)F 35c3b595c87ebf1490734dec5b595369 [0,2,0,0,0,0|2,0,0]=4 7546 B13R1.14 CCC(O)CNc1cnc(cn1)Br 5221c116348989f894dd0290bb4d3c0d [0,2,0,0,0,0|2,0,0]=4 7547 B13R1.14 CCC(O)CNc1cnc(cn1)C 137aa2c557baebb8550c28ba969b141f [0,2,0,0,0,0|2,0,0]=4 7548 B13R1.14 CCC(O)CNc1cnc(cn1)Cl 75751ccaf2e5a68742c5a1c533ad4651 [0,2,0,0,0,0|2,0,0]=4 7549 B13R1.14 CCC(O)CNc1cnc(cn1)I d926c7f66e2aa1086c7906a5509489cc [0,2,0,0,0,0|2,0,0]=4 7550 B13R1.14 CCC(O)CNc1ncc(cn1)Br ad78d2f0d3e6c77a23e027cd47404680 [0,2,0,0,0,0|2,0,0]=4 7551 B13R1.14 CCC(O)CNc1ncc(cn1)C ab6fc032f2a1000a04d2fbd0fbfc3059 [0,2,0,0,0,0|2,0,0]=4 7552 B13R1.14 CCC(O)CNc1ncc(cn1)Cl b73e2801154cd7c52fd9292d8cd4a858 [0,2,0,0,0,0|2,0,0]=4 7553 B13R1.14 CCC(O)CNc1ncc(cn1)F 15afedc5e0b76ccd4d9bbf71ffc3b731 [0,2,0,0,0,0|2,0,0]=4 7554 B13R1.14 CCC(O)CNc1ncc(cn1)I a014283efc24661177a610a1a2e948de [0,2,0,0,0,0|2,0,0]=4 7555 B13R1.14 CCN(C)CCc1ccc(cc1)Br d05f6660a495a52ef54d2ff5599e78af [0,2,0,0,0,0|2,0,0]=4 7556 B13R1.14 CCN(C)CCc1ccc(cc1)C 0b6f01873c3150724c0a78e8befc91d0 [0,2,0,0,0,0|2,0,0]=4 7557 B13R1.14 CCN(C)CCc1ccc(cc1)Cl bae98dc63fb1f0afe4f3048a7721e6ea [0,2,0,0,0,0|2,0,0]=4 7558 B13R1.14 CCN(C)CCc1ccc(cc1)F b56857c054326a5a7ddd7175570113cf [0,2,0,0,0,0|2,0,0]=4 7559 B13R1.14 CCN(C)CCc1ccc(cc1)I 4b664aa21606dc2fcf5c98dfa2d591a7 [0,2,0,0,0,0|2,0,0]=4 7560 B13R1.14 CC[C@@H](C)CNc1ccc(cc1)Br b65c69c4203239d2c061c6c73df84038 [0,2,0,0,0,0|2,0,0]=4 7561 B13R1.14 CC[C@@H](C)CNc1ccc(cc1)C e0ce160015896446d333b55ca72f47c5 [0,2,0,0,0,0|2,0,0]=4 7562 B13R1.14 CC[C@@H](C)CNc1ccc(cc1)Cl db93f329ff79be78a2512e1dfb378481 [0,2,0,0,0,0|2,0,0]=4 7563 B13R1.14 CC[C@@H](C)CNc1ccc(cc1)F 1edb865598afb0f6353288af25b017cd [0,2,0,0,0,0|2,0,0]=4 7564 B13R1.14 CC[C@@H](C)CNc1ccc(cc1)I 4092e8eaf43f108a411fc6dd42a7c4d3 [0,2,0,0,0,0|2,0,0]=4 7565 B13R1.14 CC[C@@H](C)CNc1ccc(cc1)S 31319f0c16b99e610088d2f7da9112ce [0,2,0,0,0,0|2,0,0]=4 7566 B13R1.14 CC[C@@H](C)CNc1ccc(cn1)Br 40655e9d765240c38b37c3356823c745 [0,2,0,0,0,0|1,0,0]=3 7567 B13R1.14 CC[C@@H](C)CNc1ccc(cn1)C 5969f7acdd56c1f2ba0c02c1aa06e2d3 [0,2,0,0,0,0|1,0,0]=3 7568 B13R1.14 CC[C@@H](C)CNc1ccc(cn1)Cl 185d29a8bd04c59d4e3d30d1657167a3 [0,2,0,0,0,0|1,0,0]=3 7569 B13R1.14 CC[C@@H](C)CNc1ccc(cn1)F 34774e9240b6e9c62c4c2d9731819ac2 [0,2,0,0,0,0|1,0,0]=3 7570 B13R1.14 CC[C@@H](C)CNc1ccc(cn1)I f5298c24bcde82e6fc14c6cc8d7768f7 [0,2,0,0,0,0|1,0,0]=3 7571 B13R1.14 CC[C@@H](C)CNc1ccc(nn1)Br ddcced8fccb3d16d3572d0505dfc01d9 [0,2,0,0,0,0|2,0,0]=4 7572 B13R1.14 CC[C@@H](C)CNc1ccc(nn1)C a72594f460958cd0dd37f09ea7d049db [0,2,0,0,0,0|2,0,0]=4 7573 B13R1.14 CC[C@@H](C)CNc1ccc(nn1)Cl 7c5d28131b97992237cad8a122c672dc [0,2,0,0,0,0|2,0,0]=4 7574 B13R1.14 CC[C@@H](C)CNc1ccc(nn1)F 9867088d8efed962c4c462d7f71fbe99 [0,2,0,0,0,0|2,0,0]=4 7575 B13R1.14 CC[C@@H](C)CNc1ccc(nn1)I 6f1e76bcc260e16be37b61f87533efcd [0,2,0,0,0,0|2,0,0]=4 7576 B13R1.14 CC[C@@H](C)CNc1cnc(cn1)Br 8583f44108546d6f20bfd076b3e0fcd0 [0,2,0,0,0,0|2,0,0]=4 7577 B13R1.14 CC[C@@H](C)CNc1cnc(cn1)C d15cc56a93a74feb3864f027ef913ec1 [0,2,0,0,0,0|2,0,0]=4 7578 B13R1.14 CC[C@@H](C)CNc1cnc(cn1)Cl ba4356c54165b55c96b97e492eb2bf94 [0,2,0,0,0,0|2,0,0]=4 7579 B13R1.14 CC[C@@H](C)CNc1cnc(cn1)I d33fa3bfcb308c04dce281eb1ba48b1e [0,2,0,0,0,0|2,0,0]=4 7580 B13R1.14 CC[C@@H](C)CNc1ncc(cn1)Br 1a4f7649d393e2e1a8ee3e09bc9ba784 [0,2,0,0,0,0|2,0,0]=4 7581 B13R1.14 CC[C@@H](C)CNc1ncc(cn1)C 5eee0f747f97682e63009194940552ba [0,2,0,0,0,0|2,0,0]=4 7582 B13R1.14 CC[C@@H](C)CNc1ncc(cn1)Cl 73ad395ab17cf84694f7b294305f781a [0,2,0,0,0,0|2,0,0]=4 7583 B13R1.14 CC[C@@H](C)CNc1ncc(cn1)F 138aad4a7ccc8f3426c81a0417ad0c29 [0,2,0,0,0,0|2,0,0]=4 7584 B13R1.14 CC[C@@H](C)CNc1ncc(cn1)I e8c9166ce5770d04d1dc285f24e68839 [0,2,0,0,0,0|2,0,0]=4 7585 B13R1.14 CC[C@@H](C)COc1ccc(cc1)Br c49bf7a380dc299b5b22fc33cc9dfa07 [0,2,0,0,0,0|2,0,0]=4 7586 B13R1.14 CC[C@@H](C)COc1ccc(cc1)C d19941edd339c981caf752d025de86da [0,2,0,0,0,0|2,0,0]=4 7587 B13R1.14 CC[C@@H](C)COc1ccc(cc1)Cl 2f19ed7e6c2c594d2c70ac4c06f1de1b [0,2,0,0,0,0|2,0,0]=4 7588 B13R1.14 CC[C@@H](C)COc1ccc(cc1)F 52b257eeac3b8b935e7e8a9a4ff84a09 [0,2,0,0,0,0|2,0,0]=4 7589 B13R1.14 CC[C@@H](C)COc1ccc(cc1)I 0c77bb2b160ed861557fde5a43107815 [0,2,0,0,0,0|2,0,0]=4 7590 B13R1.14 CC[C@@H](C)COc1ccc(cc1)S 76d9060df38a1c8381cb06aad390fc36 [0,2,0,0,0,0|2,0,0]=4 7591 B13R1.14 CC[C@@H](C)COc1ccc(cn1)C bf06c5df902c4253249a846d1b0e4c4b [0,2,0,0,0,0|1,0,0]=3 7592 B13R1.14 CC[C@@H](C)COc1ccc(cn1)F 609a7d304ff1c11a6dc40e5c62e66e8f [0,2,0,0,0,0|1,0,0]=3 7593 B13R1.14 CC[C@@H](C)COc1ccc(cn1)I d23a0778126d711e77a9157400273ff3 [0,2,0,0,0,0|1,0,0]=3 7594 B13R1.14 CC[C@@H](C)COc1ccc(nn1)Br 5d9c4db5b16a12fb7a8a6e8fcee7c3e4 [0,2,0,0,0,0|2,0,0]=4 7595 B13R1.14 CC[C@@H](C)COc1ccc(nn1)C 6b0b7747a4564d0177448ba129ba1c3a [0,2,0,0,0,0|2,0,0]=4 7596 B13R1.14 CC[C@@H](C)COc1ccc(nn1)Cl 78199b070e89e1012c6aba82e143cb3e [0,2,0,0,0,0|2,0,0]=4 7597 B13R1.14 CC[C@@H](C)COc1cnc(cn1)Br 34b942e4bd1154bac180b2853b9efe9e [0,2,0,0,0,0|2,0,0]=4 7598 B13R1.14 CC[C@@H](C)COc1cnc(cn1)C 8830edb215118a57c501e490a2dd604d [0,2,0,0,0,0|2,0,0]=4 7599 B13R1.14 CC[C@@H](C)COc1cnc(cn1)Cl c90a396e89f0e49f1a953fae32349aa0 [0,2,0,0,0,0|2,0,0]=4 7600 B13R1.14 CC[C@@H](C)COc1cnc(cn1)I 767ae2a4ac14880e4f4270c795d6984a [0,2,0,0,0,0|2,0,0]=4 7601 B13R1.14 CC[C@@H](C)COc1ncc(cn1)Br b7d98bc91882dd78b8d30e1dc78406a4 [0,2,0,0,0,0|2,0,0]=4 7602 B13R1.14 CC[C@@H](C)COc1ncc(cn1)C aaad84cb0f1c5f9b89ebf933b0d94c16 [0,2,0,0,0,0|2,0,0]=4 7603 B13R1.14 CC[C@@H](C)COc1ncc(cn1)F e45e9e37c2d75a5730c40aaf72d0144a [0,2,0,0,0,0|2,0,0]=4 7604 B13R1.14 CC[C@@H](C)COc1ncc(cn1)I bff134435060a51babc87a46e9471ed0 [0,2,0,0,0,0|2,0,0]=4 7605 B13R1.14 CC[C@@H](C)NCc1ccc(cc1)Br 3ff9d82fa26b0079fa42216a0a66fced [0,2,0,0,0,0|2,0,0]=4 7606 B13R1.14 CC[C@@H](C)NCc1ccc(cc1)C 8e49a5ade28c8be4117262a4417c0700 [0,2,0,0,0,0|2,0,0]=4 7607 B13R1.14 CC[C@@H](C)NCc1ccc(cc1)Cl dcd7b6bbbb2603492684d3d9edec7111 [0,2,0,0,0,0|2,0,0]=4 7608 B13R1.14 CC[C@@H](C)NCc1ccc(cc1)F 03e5451e4ef53bd886bd13e2f0fc01f7 [0,2,0,0,0,0|2,0,0]=4 7609 B13R1.14 CC[C@@H](C)NCc1ccc(cc1)I 7ebfc5866429d5e49443c4162a968451 [0,2,0,0,0,0|2,0,0]=4 7610 B13R1.14 CC[C@@H](C)NCc1ccc(cn1)Br fef56179244a451ae874b764b01e7f81 [0,2,0,0,0,0|1,0,0]=3 7611 B13R1.14 CC[C@@H](C)NCc1ccc(cn1)C 9aee29f481daea67d37fcab3f62229fd [0,2,0,0,0,0|1,0,0]=3 7612 B13R1.14 CC[C@@H](C)NCc1ccc(cn1)Cl 81ab146280832ca9e1f3b70dc7b2aace [0,2,0,0,0,0|1,0,0]=3 7613 B13R1.14 CC[C@@H](C)NCc1ccc(cn1)F d150c2008fae71a1101d823c31d36d42 [0,2,0,0,0,0|1,0,0]=3 7614 B13R1.14 CC[C@@H](C)NCc1cnc(cn1)Br fa264f6a9e2f4fa00a67ce3073d11c28 [0,2,0,0,0,0|2,0,0]=4 7615 B13R1.14 CC[C@@H](C)NCc1ncc(cn1)Br 77db0d056b8c0d7203c7ca224f303515 [0,2,0,0,0,0|2,0,0]=4 7616 B13R1.14 CC[C@@H](C)NCc1ncc(cn1)C db728de5985175aff04de4b0a33684a8 [0,2,0,0,0,0|2,0,0]=4 7617 B13R1.14 CC[C@@H](C)NCc1ncc(cn1)Cl 3c8d2d5b488e83a110f2dc076caa8f50 [0,2,0,0,0,0|2,0,0]=4 7618 B13R1.14 CC[C@@H](C)OCc1ccc(cc1)Br ab082d26ffcbc0d94f829c18539aea4f [0,2,0,0,0,0|2,0,0]=4 7619 B13R1.14 CC[C@@H](C)OCc1ccc(cc1)C f554301de3a543cfe2e7ec6eb67b3fd5 [0,2,0,0,0,0|2,0,0]=4 7620 B13R1.14 CC[C@@H](C)OCc1ccc(cc1)Cl 5ad21ff7f014fb224ebed22096a8f243 [0,2,0,0,0,0|2,0,0]=4 7621 B13R1.14 CC[C@@H](C)OCc1ccc(cc1)F bda97487875bbb387e31383a434770a2 [0,2,0,0,0,0|2,0,0]=4 7622 B13R1.14 CC[C@@H](C)OCc1ccc(cc1)I 178305fd0c396a47fed0c143f98a8164 [0,2,0,0,0,0|2,0,0]=4 7623 B13R1.14 CC[C@@H](C)OCc1ccc(cn1)Cl 9cd43f6395caf9c8982d1ee48f48f8a6 [0,2,0,0,0,0|1,0,0]=3 7624 B13R1.14 CC[C@@H](C)OCc1ccc(cn1)F e9cd49c20027fae83f1ca2fc288c78c5 [0,2,0,0,0,0|1,0,0]=3 7625 B13R1.14 CC[C@@H](C)OCc1cnc(cn1)Br 1b94ee2ff94dee668834d425237ca243 [0,2,0,0,0,0|2,0,0]=4 7626 B13R1.14 CC[C@@H](C)OCc1ncc(cn1)Br c7dd0ae7c1d1ec19263e3563c5741591 [0,2,0,0,0,0|2,0,0]=4 7627 B13R1.14 CC[C@@H](C)OCc1ncc(cn1)C 8297dd18b65ef0a380f46f94a7c8f4b5 [0,2,0,0,0,0|2,0,0]=4 7628 B13R1.14 CC[C@@H](C)OCc1ncc(cn1)Cl 1d3a51ab5b8ec18d2d972ea379b8b535 [0,2,0,0,0,0|2,0,0]=4 7629 B13R1.14 CC[C@@H](C)OCc1ncc(cn1)F a52e6fdd4a1f22b635010e7ad35e537f [0,2,0,0,0,0|2,0,0]=4 7630 B13R1.14 CC[C@@H](O)CNc1ccc(cc1)C d9eb34a9bb213a62a681e5abb5a9bc9e [0,2,0,0,0,0|2,0,0]=4 7631 B13R1.14 CC[C@@H](O)CNc1ccc(cc1)S 486c3a69df85f7e30d8a19c31fe9d044 [0,2,0,0,0,0|2,0,0]=4 7632 B13R1.14 CC[C@H](C)CNc1ccc(cc1)Br d5ea2711869b7dd71b60632b70260d0a [0,2,0,0,0,0|2,0,0]=4 7633 B13R1.14 CC[C@H](C)CNc1ccc(cc1)C d5fd6fd52df8db56fa5f75fbdce7a329 [0,2,0,0,0,0|2,0,0]=4 7634 B13R1.14 CC[C@H](C)CNc1ccc(cc1)Cl 74e41806befbf399d77f87bb90a27cbc [0,2,0,0,0,0|2,0,0]=4 7635 B13R1.14 CC[C@H](C)CNc1ccc(cc1)F be19e951b98fc2955e87daf12ad1dc42 [0,2,0,0,0,0|2,0,0]=4 7636 B13R1.14 CC[C@H](C)CNc1ccc(cc1)I 84ff9e2895b7a7b8fa6ced5a2df00a20 [0,2,0,0,0,0|2,0,0]=4 7637 B13R1.14 CC[C@H](C)CNc1ccc(cc1)S 8813810fc6478e9947c0d7a3c0668d16 [0,2,0,0,0,0|2,0,0]=4 7638 B13R1.14 CC[C@H](C)CNc1ccc(cn1)Br 985fa8fcd62977e5ced28427d8535bc3 [0,2,0,0,0,0|1,0,0]=3 7639 B13R1.14 CC[C@H](C)CNc1ccc(cn1)C 22a426f8af9f914508bf74de2d97e118 [0,2,0,0,0,0|1,0,0]=3 7640 B13R1.14 CC[C@H](C)CNc1ccc(cn1)Cl 68ed7a5bb52248943b500c3fb18bb921 [0,2,0,0,0,0|1,0,0]=3 7641 B13R1.14 CC[C@H](C)CNc1ccc(cn1)F f54a179114c6cb4c54c783a8ad66d0be [0,2,0,0,0,0|1,0,0]=3 7642 B13R1.14 CC[C@H](C)CNc1ccc(cn1)I 776c1d810c6be983bb0fa1524a0e2b4b [0,2,0,0,0,0|1,0,0]=3 7643 B13R1.14 CC[C@H](C)CNc1ccc(nn1)Br 377fafef9fdddd7e04b6bc4c5c91efed [0,2,0,0,0,0|2,0,0]=4 7644 B13R1.14 CC[C@H](C)CNc1ccc(nn1)C 104851916f4962e764d12951d60ea1b0 [0,2,0,0,0,0|2,0,0]=4 7645 B13R1.14 CC[C@H](C)CNc1ccc(nn1)Cl cff233a004aff7e2bda0c65616e39663 [0,2,0,0,0,0|2,0,0]=4 7646 B13R1.14 CC[C@H](C)CNc1ccc(nn1)F 82833a95d8a6d317ddba9724f4d84c0e [0,2,0,0,0,0|2,0,0]=4 7647 B13R1.14 CC[C@H](C)CNc1ccc(nn1)I 2c78896a5b5ca16548ba9f410a7c43ae [0,2,0,0,0,0|2,0,0]=4 7648 B13R1.14 CC[C@H](C)CNc1cnc(cn1)Br de9dc1fe925228f22fa9ff6bc312c806 [0,2,0,0,0,0|2,0,0]=4 7649 B13R1.14 CC[C@H](C)CNc1cnc(cn1)C d0decc4f865da20e57cd9fc4e4dc8ca4 [0,2,0,0,0,0|2,0,0]=4 7650 B13R1.14 CC[C@H](C)CNc1cnc(cn1)Cl 8c926004fa1be7b3b13b8917bc07d288 [0,2,0,0,0,0|2,0,0]=4 7651 B13R1.14 CC[C@H](C)CNc1cnc(cn1)I 353ea928b8dbffb39fa36830ffb0a98b [0,2,0,0,0,0|2,0,0]=4 7652 B13R1.14 CC[C@H](C)CNc1ncc(cn1)Br 514d33334e9196879f9fdec3cccf89f4 [0,2,0,0,0,0|2,0,0]=4 7653 B13R1.14 CC[C@H](C)CNc1ncc(cn1)C d418c00a245b0cbc40c963064d83542b [0,2,0,0,0,0|2,0,0]=4 7654 B13R1.14 CC[C@H](C)CNc1ncc(cn1)Cl 61e2946c190d4a9bd548f0191e915f72 [0,2,0,0,0,0|2,0,0]=4 7655 B13R1.14 CC[C@H](C)CNc1ncc(cn1)F 39c0079e13d31f6f90f2266e8b886a46 [0,2,0,0,0,0|2,0,0]=4 7656 B13R1.14 CC[C@H](C)CNc1ncc(cn1)I 31665d82a724215dffb393f2d34036d3 [0,2,0,0,0,0|2,0,0]=4 7657 B13R1.14 CC[C@H](C)COc1ccc(cc1)Br 1907f0f1b9479c6222aa8ea8ec67d438 [0,2,0,0,0,0|2,0,0]=4 7658 B13R1.14 CC[C@H](C)COc1ccc(cc1)C 770451c0c0a9f6dee7738ea72a58fef9 [0,2,0,0,0,0|2,0,0]=4 7659 B13R1.14 CC[C@H](C)COc1ccc(cc1)Cl 06232ff0850e9622a9f61667cdb5b97a [0,2,0,0,0,0|2,0,0]=4 7660 B13R1.14 CC[C@H](C)COc1ccc(cc1)F 9b0af230b94977c333dda56623c8e447 [0,2,0,0,0,0|2,0,0]=4 7661 B13R1.14 CC[C@H](C)COc1ccc(cc1)I 368fe406dedb8acec85246bf3ecff4b4 [0,2,0,0,0,0|2,0,0]=4 7662 B13R1.14 CC[C@H](C)COc1ccc(cc1)S 79c212400d92d4b3a41e19165790dcd5 [0,2,0,0,0,0|2,0,0]=4 7663 B13R1.14 CC[C@H](C)COc1ccc(cn1)C 841fec94bb1a54fcbfcfe5aba622322b [0,2,0,0,0,0|1,0,0]=3 7664 B13R1.14 CC[C@H](C)COc1ccc(cn1)Cl 40a071f5dd5db7d1bb43c426337cccb5 [0,2,0,0,0,0|1,0,0]=3 7665 B13R1.14 CC[C@H](C)COc1ccc(cn1)F 41de5d5913f2ec2bb6d4309d744c2fc2 [0,2,0,0,0,0|1,0,0]=3 7666 B13R1.14 CC[C@H](C)COc1ccc(cn1)I 540545a380c955e3ae8565692beed987 [0,2,0,0,0,0|1,0,0]=3 7667 B13R1.14 CC[C@H](C)COc1ccc(nn1)Br 0fc7d83b65faeda9c0695812a47e67bd [0,2,0,0,0,0|2,0,0]=4 7668 B13R1.14 CC[C@H](C)COc1ccc(nn1)C 637cc3b074b464e3f5a6398bde183895 [0,2,0,0,0,0|2,0,0]=4 7669 B13R1.14 CC[C@H](C)COc1ccc(nn1)Cl ae5f8b35218683aafce3cca5729e4d61 [0,2,0,0,0,0|2,0,0]=4 7670 B13R1.14 CC[C@H](C)COc1cnc(cn1)Br 07834d4dfc0fea3df8b3c3bbce00622a [0,2,0,0,0,0|2,0,0]=4 7671 B13R1.14 CC[C@H](C)COc1cnc(cn1)C a3d50c5e459f236ac31c6f8b39f2af6f [0,2,0,0,0,0|2,0,0]=4 7672 B13R1.14 CC[C@H](C)COc1cnc(cn1)Cl 10149e71f0d68f687c0e66cf21717696 [0,2,0,0,0,0|2,0,0]=4 7673 B13R1.14 CC[C@H](C)COc1cnc(cn1)I dadb5b8f45569a73f0601a2d7e91c5e4 [0,2,0,0,0,0|2,0,0]=4 7674 B13R1.14 CC[C@H](C)COc1ncc(cn1)Br e080eb37c91129d6c2f50865d96bdffa [0,2,0,0,0,0|2,0,0]=4 7675 B13R1.14 CC[C@H](C)COc1ncc(cn1)C 4e0ba0d42b2dca545dc0d136abff5dd8 [0,2,0,0,0,0|2,0,0]=4 7676 B13R1.14 CC[C@H](C)COc1ncc(cn1)F 2558679de7042d44c23fb4f6ebd8125e [0,2,0,0,0,0|2,0,0]=4 7677 B13R1.14 CC[C@H](C)COc1ncc(cn1)I 7dbe45e666cd04a5a297c86ad1d82cfb [0,2,0,0,0,0|2,0,0]=4 7678 B13R1.14 CC[C@H](C)NCc1ccc(cc1)Br 50b1405d61a19588fc9b582c8506e370 [0,2,0,0,0,0|2,0,0]=4 7679 B13R1.14 CC[C@H](C)NCc1ccc(cc1)C b94b58879f72267d9f64001a24bc8656 [0,2,0,0,0,0|2,0,0]=4 7680 B13R1.14 CC[C@H](C)NCc1ccc(cc1)Cl 0ec668095e308a1b1293ad2b3d5d1b84 [0,2,0,0,0,0|2,0,0]=4 7681 B13R1.14 CC[C@H](C)NCc1ccc(cc1)F bba516c1679996d829bb5436a0ea164a [0,2,0,0,0,0|2,0,0]=4 7682 B13R1.14 CC[C@H](C)NCc1ccc(cc1)I b059fc9371ce4b03fde0e74bf63e1514 [0,2,0,0,0,0|2,0,0]=4 7683 B13R1.14 CC[C@H](C)NCc1ccc(cn1)Br a11ddd15404794f7146254f2a6ecf857 [0,2,0,0,0,0|1,0,0]=3 7684 B13R1.14 CC[C@H](C)NCc1ccc(cn1)C 8930f9e3f7029bca14dc05f8d1361209 [0,2,0,0,0,0|1,0,0]=3 7685 B13R1.14 CC[C@H](C)NCc1ccc(cn1)Cl ba1d07024cdb4138eea0797c6d0e0e21 [0,2,0,0,0,0|1,0,0]=3 7686 B13R1.14 CC[C@H](C)NCc1ccc(cn1)F ea7d29dc81992bf09bd62ad538c53161 [0,2,0,0,0,0|1,0,0]=3 7687 B13R1.14 CC[C@H](C)NCc1cnc(cn1)Br c5612c95cb9410b931ceb29b93ef0d9d [0,2,0,0,0,0|2,0,0]=4 7688 B13R1.14 CC[C@H](C)NCc1ncc(cn1)Br df1ffaebe9ce6c3bf4ff16b97fe7de50 [0,2,0,0,0,0|2,0,0]=4 7689 B13R1.14 CC[C@H](C)NCc1ncc(cn1)C 2b65c1a22839adf97bd48ae5550320a7 [0,2,0,0,0,0|2,0,0]=4 7690 B13R1.14 CC[C@H](C)NCc1ncc(cn1)Cl 4c81ce8baea9d91355e1ca4baf8268e1 [0,2,0,0,0,0|2,0,0]=4 7691 B13R1.14 CC[C@H](C)OCc1ccc(cc1)Br e3db62d82d2b63ca8996a3ac79623212 [0,2,0,0,0,0|2,0,0]=4 7692 B13R1.14 CC[C@H](C)OCc1ccc(cc1)C 22bf190577eaa70a4e1ff49663bc4dcd [0,2,0,0,0,0|2,0,0]=4 7693 B13R1.14 CC[C@H](C)OCc1ccc(cc1)Cl 0b82856428cf3abdc9cf68a7d27ea7d1 [0,2,0,0,0,0|2,0,0]=4 7694 B13R1.14 CC[C@H](C)OCc1ccc(cc1)F 9f5f2379e2a552690a12850e384f264f [0,2,0,0,0,0|2,0,0]=4 7695 B13R1.14 CC[C@H](C)OCc1ccc(cc1)I ee6cd1ad70de386f0e5517af59e2473c [0,2,0,0,0,0|2,0,0]=4 7696 B13R1.14 CC[C@H](C)OCc1ccc(cn1)Cl 9fa4d790654e07097707a7f3ae457d75 [0,2,0,0,0,0|1,0,0]=3 7697 B13R1.14 CC[C@H](C)OCc1ccc(cn1)F 5b440f60c96e2d7f4e2c7feff9bd518e [0,2,0,0,0,0|1,0,0]=3 7698 B13R1.14 CC[C@H](C)OCc1cnc(cn1)Br 0d6465cc3a4d7df5cb63254fdb41be32 [0,2,0,0,0,0|2,0,0]=4 7699 B13R1.14 CC[C@H](C)OCc1ncc(cn1)Br c9dbc1b05884ec7289bbbf71501d40c4 [0,2,0,0,0,0|2,0,0]=4 7700 B13R1.14 CC[C@H](C)OCc1ncc(cn1)C 0fa6377b9d9be8ad1eaba44c44f17848 [0,2,0,0,0,0|2,0,0]=4 7701 B13R1.14 CC[C@H](C)OCc1ncc(cn1)Cl 18754fc8e86ef87d55f3120ecab23f18 [0,2,0,0,0,0|2,0,0]=4 7702 B13R1.14 CC[C@H](C)OCc1ncc(cn1)F fa60718d706ab322566446f6ba94659f [0,2,0,0,0,0|2,0,0]=4 7703 B13R1.14 COC(C)CNc1ccc(cn1)Br 2fa7c2303585d2d57c8e69d5a283fb2b [0,2,0,0,0,0|2,0,0]=4 7704 B13R1.14 COC(C)CNc1ccc(cn1)C eeb6c3523ecf0d9ca3f808357e3858e9 [0,2,0,0,0,0|2,0,0]=4 7705 B13R1.14 COC(C)CNc1ccc(cn1)Cl 05e5659ae19fb0c1edf72ed0eedfd3f3 [0,2,0,0,0,0|2,0,0]=4 7706 B13R1.14 COC(C)CNc1ccc(cn1)F f79a71044721035c785cc7a17c963332 [0,2,0,0,0,0|2,0,0]=4 7707 B13R1.14 COC(C)CNc1ccc(cn1)I a14ce1a1af2a8164323fec41995ae7ea [0,2,0,0,0,0|2,0,0]=4 7708 B13R1.14 COC(C)COc1ccc(cn1)C 414d0909ac9e90d4f6a21fde4c1765a0 [0,2,0,0,0,0|2,0,0]=4 7709 B13R1.14 COC(C)COc1ccc(cn1)Cl ace8a46e3e3ff6d03bcc7571fb2b80ed [0,2,0,0,0,0|2,0,0]=4 7710 B13R1.14 COC(C)COc1ccc(cn1)F c44eee5d5b9d00fb23e7b937f51b3283 [0,2,0,0,0,0|2,0,0]=4 7711 B13R1.14 COC(C)COc1ccc(cn1)I 1222bbd6679c276b16b70280544c4407 [0,2,0,0,0,0|2,0,0]=4 7712 B13R1.14 CO[C@@H](C)CNc1ccc(cn1)Br 8f8b6b1628f413ebb31f0bae54dddc67 [0,2,0,0,0,0|2,0,0]=4 7713 B13R1.14 CO[C@@H](C)CNc1ccc(cn1)C 0e7828f4555605c82de4dcbba6816b16 [0,2,0,0,0,0|2,0,0]=4 7714 B13R1.14 CO[C@@H](C)CNc1ccc(cn1)Cl 882c3845103a454cf49d34112b98899a [0,2,0,0,0,0|2,0,0]=4 7715 B13R1.14 CO[C@@H](C)CNc1ccc(cn1)F ac6abcea44f89b331d24853ebed89402 [0,2,0,0,0,0|2,0,0]=4 7716 B13R1.14 CO[C@@H](C)CNc1ccc(cn1)I 2908a18a4b8ee76584f728c33a1fefae [0,2,0,0,0,0|2,0,0]=4 7717 B13R1.14 CO[C@@H](C)COc1ccc(cn1)C 4661cbe9d15e974e0cb25b6ba69fb4de [0,2,0,0,0,0|2,0,0]=4 7718 B13R1.14 CO[C@@H](C)COc1ccc(cn1)Cl 7f957bbb91ede754fcfc6b3b5c06ed07 [0,2,0,0,0,0|2,0,0]=4 7719 B13R1.14 CO[C@@H](C)COc1ccc(cn1)F 933eaa64370bb4f54ce9d6cf840f4dd6 [0,2,0,0,0,0|2,0,0]=4 7720 B13R1.14 CO[C@@H](C)COc1ccc(cn1)I 22f481decc31e07f55325a6e3e69be64 [0,2,0,0,0,0|2,0,0]=4 7721 B13R1.14 CO[C@H](C)CNc1ccc(cn1)Br b718cb1cf9043b212a5cd20356df30e5 [0,2,0,0,0,0|2,0,0]=4 7722 B13R1.14 CO[C@H](C)CNc1ccc(cn1)C 7a9d34df5ddd1aa0f1b9e9b189487713 [0,2,0,0,0,0|2,0,0]=4 7723 B13R1.14 CO[C@H](C)CNc1ccc(cn1)Cl 8dbf0b5ef78c2707c9882c2a44b98532 [0,2,0,0,0,0|2,0,0]=4 7724 B13R1.14 CO[C@H](C)CNc1ccc(cn1)F a6a01754839bd9b74bd9c2b58f2ff93f [0,2,0,0,0,0|2,0,0]=4 7725 B13R1.14 CO[C@H](C)CNc1ccc(cn1)I efe0f67740b37cc17debb771084e2474 [0,2,0,0,0,0|2,0,0]=4 7726 B13R1.14 CO[C@H](C)COc1ccc(cn1)C df8329d86344cf5453bac46ddff1b944 [0,2,0,0,0,0|2,0,0]=4 7727 B13R1.14 CO[C@H](C)COc1ccc(cn1)Cl ff0a376ec555bd4237ffd021f82ce21d [0,2,0,0,0,0|2,0,0]=4 7728 B13R1.14 CO[C@H](C)COc1ccc(cn1)F 68432c3f0993de15ced41fddac4b61a9 [0,2,0,0,0,0|2,0,0]=4 7729 B13R1.14 CO[C@H](C)COc1ccc(cn1)I 714cb27cbc336520a382cd7921654e31 [0,2,0,0,0,0|2,0,0]=4 7730 B13R1.14 C[C@@H](CO)CNc1ccc(cn1)Br 8fb43bc6d82b3b6aa5d46a8274479427 [0,2,0,0,0,0|2,0,0]=4 7731 B13R1.14 C[C@@H](CO)CNc1ccc(cn1)Cl 9f7dbe86b34479c090fdc735da3ef71c [0,2,0,0,0,0|2,0,0]=4 7732 B13R1.14 C[C@@H](CO)CNc1ccc(cn1)F 4621eefd513161c63931d7af1944a3d3 [0,2,0,0,0,0|2,0,0]=4 7733 B13R1.14 C[C@@H](CO)CNc1ccc(cn1)I 0a19fee5e1c5746c4cb11122d4552455 [0,2,0,0,0,0|2,0,0]=4 7734 B13R1.14 C[C@@H](CO)NCc1ccc(cn1)Br 61bf0258b428b86dfab501219b225e1a [0,2,0,0,0,0|2,0,0]=4 7735 B13R1.14 C[C@@H](CO)NCc1ccc(cn1)Cl 596e4c1f27f1c5ef351d1cb300719468 [0,2,0,0,0,0|2,0,0]=4 7736 B13R1.14 C[C@@H](CO)NCc1ccc(cn1)F 8840506755dd0af60fccb6ae8d134123 [0,2,0,0,0,0|2,0,0]=4 7737 B13R1.14 C[C@H](CO)CNc1ccc(cn1)Br 3559713cd8f3ed84d770bd3ff1b7e28b [0,2,0,0,0,0|2,0,0]=4 7738 B13R1.14 C[C@H](CO)CNc1ccc(cn1)Cl d433514a809a221aabcb4b4b59dd400f [0,2,0,0,0,0|2,0,0]=4 7739 B13R1.14 C[C@H](CO)CNc1ccc(cn1)F 5c0cb4ef0dfe7a3b4ea9bd71acfac557 [0,2,0,0,0,0|2,0,0]=4 7740 B13R1.14 C[C@H](CO)CNc1ccc(cn1)I 13d3c8f11d404225739efa5521706197 [0,2,0,0,0,0|2,0,0]=4 7741 B13R1.14 C[C@H](CO)NCc1ccc(cn1)Br 8a7a0c4fd05196bcb017715b649b30e7 [0,2,0,0,0,0|2,0,0]=4 7742 B13R1.14 C[C@H](CO)NCc1ccc(cn1)Cl aee5fa3087a068720873a433734f70fd [0,2,0,0,0,0|2,0,0]=4 7743 B13R1.14 C[C@H](CO)NCc1ccc(cn1)F 7e6cb46552be924b65134904c29f59f3 [0,2,0,0,0,0|2,0,0]=4 7744 B13R1.14 C[C@H](CS)OCc1ccc(cn1)Cl ca85a01dee4cf5a5624ea7c574001e06 [0,2,0,0,0,0|2,0,0]=4 7745 B13R1.14 C[C@H](CS)OCc1ccc(cn1)F afd00b49ae0cf1e30fd89643706fafe6 [0,2,0,0,0,0|2,0,0]=4 7746 B13R1.14 Cc1ccc(nc1)CNC(C)CO 53a16a9e4fd94289d7110d570b36b42c [0,2,0,0,0,0|2,0,0]=4 7747 B13R1.14 Cc1ccc(nc1)CN[C@@H](C)CO 124441ca7c7b9e5e77c77506883d96d2 [0,2,0,0,0,0|2,0,0]=4 7748 B13R1.14 Cc1ccc(nc1)CN[C@H](C)CO c651be5b37a09595a86380cff99209a6 [0,2,0,0,0,0|2,0,0]=4 7749 B13R1.14 Cc1ccc(nc1)COC(C)CF d787c66e01b8557029af7f4b3254c9e4 [0,2,0,0,0,0|2,0,0]=4 7750 B13R1.14 Cc1ccc(nc1)NCC(C)CO ace45c63ae3d3939fbd5429840cafb4f [0,2,0,0,0,0|2,0,0]=4 7751 B13R1.14 Cc1ccc(nc1)NCC(F)CO 182c9b072c15d0cc7cab395ee5560b5d [0,2,0,0,0,0|2,0,0]=4 7752 B13R1.14 Cc1ccc(nc1)NCC(O)CF 19235d499d1c0a2780d273062a4ac0a1 [0,2,0,0,0,0|2,0,0]=4 7753 B13R1.14 Cc1ccc(nc1)NCC(O)CO fb46ac7b4ffd5e60525292a5566748db [0,2,0,0,0,0|2,0,0]=4 7754 B13R1.14 Cc1ccc(nc1)NC[C@@H](C)CO 3d96d2beb869550d809d823a0c32c6bc [0,2,0,0,0,0|2,0,0]=4 7755 B13R1.14 Cc1ccc(nc1)NC[C@@H](F)CO 7f4cd057582248cb3be475cd0fceee76 [0,2,0,0,0,0|2,0,0]=4 7756 B13R1.14 Cc1ccc(nc1)NC[C@@H](O)CO e2b684f5c9278cfc10fb6c1ccb695424 [0,2,0,0,0,0|2,0,0]=4 7757 B13R1.14 Cc1ccc(nc1)NC[C@H](C)CO f3db4c8b0d25fe25c3a95dde3c869cb3 [0,2,0,0,0,0|2,0,0]=4 7758 B13R1.14 Cc1ccc(nc1)NC[C@H](F)CO be85a820b56d744836f6bca1c1e62a2f [0,2,0,0,0,0|2,0,0]=4 7759 B13R1.14 Cc1ccc(nc1)NC[C@H](O)CO 2110b80132c956014e1bf7192af6e756 [0,2,0,0,0,0|2,0,0]=4 7760 B13R1.14 Cc1ccc(nc1)OCC(O)CO 6f2dd52d4137a0edda2298aec2f35416 [0,2,0,0,0,0|2,0,0]=4 7761 B13R1.14 Cc1ccc(nc1)OC[C@@H](O)CO 51ae55e092fcffcc1390a9a4147d539d [0,2,0,0,0,0|2,0,0]=4 7762 B13R1.14 Cc1ccc(nc1)OC[C@H](O)CO 191a57ba759d0a8b9f44903f9491ef21 [0,2,0,0,0,0|2,0,0]=4 7763 B13R1.14 OC(CF)CNc1ccc(cn1)Br da5b20a865a241ad562f42f1e6ac56fc [0,2,0,0,0,0|2,0,0]=4 7764 B13R1.14 OC(CF)CNc1ccc(cn1)Cl da097e32a91185eb641855da63729970 [0,2,0,0,0,0|2,0,0]=4 7765 B13R1.14 OC(CF)CNc1ccc(cn1)F 6990eda8018e7708eb0594b5362d519c [0,2,0,0,0,0|2,0,0]=4 7766 B13R1.14 OC(CF)CNc1ccc(cn1)I 0a52965688141a6759ac37cfede153d6 [0,2,0,0,0,0|2,0,0]=4 7767 B13R1.14 OCC(F)CNc1ccc(cn1)F 2c87d10c01d10100855793f5d0fa5c7e [0,2,0,0,0,0|2,0,0]=4 7768 B13R1.14 OCC(F)CNc1ccc(cn1)O b8bdc412ad609ee55726248f93f3684a [0,2,0,0,0,0|2,0,0]=4 7769 B13R1.14 OCC(F)CNc1ccc(cn1)S 78e981aac53fede157995beab1135073 [0,2,0,0,0,0|2,0,0]=4 7770 B13R1.14 OCC(O)CNc1ccc(cn1)Br 6bcc572e0dd82f1a89f202cbcda65e98 [0,2,0,0,0,0|2,0,0]=4 7771 B13R1.14 OCC(O)CNc1ccc(cn1)Cl 0ba7d729137d78c00e9ab9a3cd1bb7cd [0,2,0,0,0,0|2,0,0]=4 7772 B13R1.14 OCC(O)CNc1ccc(cn1)F 62b3f5257fc891990c362907c6262731 [0,2,0,0,0,0|2,0,0]=4 7773 B13R1.14 OCC(O)CNc1ccc(cn1)I 9fca37deefcfed29c470c4f4c25dfd3e [0,2,0,0,0,0|2,0,0]=4 7774 B13R1.14 OCC(O)COc1ccc(cn1)Cl 55a5b1c12ca93ce4b95461a06beea417 [0,2,0,0,0,0|2,0,0]=4 7775 B13R1.14 OCC(O)COc1ccc(cn1)F b7118d72c008cbee2658efbd383582de [0,2,0,0,0,0|2,0,0]=4 7776 B13R1.14 OCC(O)COc1ccc(cn1)I 9a452d0a48193f57e5957c276ebb3c9c [0,2,0,0,0,0|2,0,0]=4 7777 B13R1.14 OC[C@@H](F)CNc1ccc(cn1)F 6bd9db8b6609330b69d76e71d94b6600 [0,2,0,0,0,0|2,0,0]=4 7778 B13R1.14 OC[C@@H](F)CNc1ccc(cn1)O 683fa040f626598145d3eb3d5fb717c4 [0,2,0,0,0,0|2,0,0]=4 7779 B13R1.14 OC[C@@H](F)CNc1ccc(cn1)S d4adf3fc89d622c21c148d01331e6fcd [0,2,0,0,0,0|2,0,0]=4 7780 B13R1.14 OC[C@@H](O)CNc1ccc(cn1)Br 342e64a3c32d6e2b92500290b8ed02e4 [0,2,0,0,0,0|2,0,0]=4 7781 B13R1.14 OC[C@@H](O)CNc1ccc(cn1)Cl 4a26d31b78cf708a7dd03e7293f0e790 [0,2,0,0,0,0|2,0,0]=4 7782 B13R1.14 OC[C@@H](O)CNc1ccc(cn1)F a65898f7adbe72e780e3b6225d428d28 [0,2,0,0,0,0|2,0,0]=4 7783 B13R1.14 OC[C@@H](O)CNc1ccc(cn1)I 42c0fd877b7f1faec5fe1624e1996608 [0,2,0,0,0,0|2,0,0]=4 7784 B13R1.14 OC[C@@H](O)COc1ccc(cn1)Cl d4ecb698df396a4e37babd80e34dbdf0 [0,2,0,0,0,0|2,0,0]=4 7785 B13R1.14 OC[C@@H](O)COc1ccc(cn1)F 662760966c260370430fe4c39bbe7685 [0,2,0,0,0,0|2,0,0]=4 7786 B13R1.14 OC[C@@H](O)COc1ccc(cn1)I 7f24b27e808f8f61cc8bcbda12d44390 [0,2,0,0,0,0|2,0,0]=4 7787 B13R1.14 OC[C@H](F)CNc1ccc(cn1)F c41f67e5c57f8ce175cb135282e8e1cb [0,2,0,0,0,0|2,0,0]=4 7788 B13R1.14 OC[C@H](F)CNc1ccc(cn1)O c196cf502e046f566d275bf1700179ca [0,2,0,0,0,0|2,0,0]=4 7789 B13R1.14 OC[C@H](F)CNc1ccc(cn1)S 0c7371e539766f900cc5cea7e621dab1 [0,2,0,0,0,0|2,0,0]=4 7790 B13R1.14 OC[C@H](O)CNc1ccc(cn1)Br 2b77722e07f9ca0299cfcbc74d14cf55 [0,2,0,0,0,0|2,0,0]=4 7791 B13R1.14 OC[C@H](O)CNc1ccc(cn1)Cl f9b405ec69928b1c6cb6924e1ddfbc72 [0,2,0,0,0,0|2,0,0]=4 7792 B13R1.14 OC[C@H](O)CNc1ccc(cn1)F 90e5d71c4a3ebf7daa4b7d4b11ca23aa [0,2,0,0,0,0|2,0,0]=4 7793 B13R1.14 OC[C@H](O)CNc1ccc(cn1)I 22d21a97510c23fbcaffb23138153195 [0,2,0,0,0,0|2,0,0]=4 7794 B13R1.14 OC[C@H](O)COc1ccc(cn1)Cl ff5451ceb6576786c566603f2c9bff93 [0,2,0,0,0,0|2,0,0]=4 7795 B13R1.14 OC[C@H](O)COc1ccc(cn1)F 632193f8d2934afd94446c761ac7bd1f [0,2,0,0,0,0|2,0,0]=4 7796 B13R1.14 OC[C@H](O)COc1ccc(cn1)I ef47f579d53f5c125135041f053d4ff3 [0,2,0,0,0,0|2,0,0]=4 7797 B13R1.17 CC(NCCF)c1ccc(cn1)Cl f8c18803290dc1a4b136873899559fea [0,2,0,0,0,0|2,0,0]=4 7798 B13R1.17 CC(NCCF)c1ccc(cn1)F 7d27cbcb70938eec7b93c4bed283b2bb [0,2,0,0,0,0|2,0,0]=4 7799 B13R1.17 CC(NCCO)c1ccc(cn1)Br ee4bc4c407541b1b002cc3947d8e7f38 [0,2,0,0,0,0|2,0,0]=4 7800 B13R1.17 CC(NCCO)c1ccc(cn1)Cl 43629940a52e04c04de601b4176a3c05 [0,2,0,0,0,0|2,0,0]=4 7801 B13R1.17 CC(NCCO)c1ccc(cn1)F 7d26f968098a0f46064dbb71f7d81f0e [0,2,0,0,0,0|2,0,0]=4 7802 B13R1.17 CC(NCCS)c1ccc(cn1)Br 416feeaedd07eeab2cd0dcec8a259941 [0,2,0,0,0,0|2,0,0]=4 7803 B13R1.17 CC(NCCS)c1ccc(cn1)Cl 46b96b04512721748a0e9ec2bcb28dbc [0,2,0,0,0,0|2,0,0]=4 7804 B13R1.17 CC(NCCS)c1ccc(cn1)F 2e9bb16a32b7e9ecd8709a7d010c5088 [0,2,0,0,0,0|2,0,0]=4 7805 B13R1.17 CC(OCCF)c1ccc(cn1)Cl d2941ea5f89c384fe4655a7f6c27b89f [0,2,0,0,0,0|2,0,0]=4 7806 B13R1.17 CC(OCCF)c1ccc(cn1)F a55d72f2d49864ff3af6c6ebfc2d416a [0,2,0,0,0,0|2,0,0]=4 7807 B13R1.17 CC(OCCS)c1ccc(cn1)Br d7772fd26ee06e2e0e5a961773e97a3b [0,2,0,0,0,0|2,0,0]=4 7808 B13R1.17 CC(OCCS)c1ccc(cn1)Cl 9ada83f82abec094fbcb77959674e59c [0,2,0,0,0,0|2,0,0]=4 7809 B13R1.17 CC(OCCS)c1ccc(cn1)F ad54a0192edbded09e177ba1e142e31b [0,2,0,0,0,0|2,0,0]=4 7810 B13R1.17 CCCCN(C)c1ccc(cc1)Br f16ef2f02509851013cad24921578897 [0,2,0,0,0,0|2,0,0]=4 7811 B13R1.17 CCCCN(C)c1ccc(cc1)C c664092c8bdde1169e196acc9f637acd [0,2,0,0,0,0|2,0,0]=4 7812 B13R1.17 CCCCN(C)c1ccc(cc1)Cl 303db46f989346866f82ebd32fb90a35 [0,2,0,0,0,0|2,0,0]=4 7813 B13R1.17 CCCCN(C)c1ccc(cc1)F ef3444c6dd21f529db6d041c33e42374 [0,2,0,0,0,0|2,0,0]=4 7814 B13R1.17 CCCCN(C)c1ccc(cc1)I 524ae53e5c68208ba6b2e06be348331c [0,2,0,0,0,0|2,0,0]=4 7815 B13R1.17 CCCCN(C)c1ccc(cc1)S 38523be267e5483ff9b277189ca60133 [0,2,0,0,0,0|2,0,0]=4 7816 B13R1.17 CCCCN(C)c1ccc(cn1)Br 4c40fb9f31eafd4df418afa3a5c8a092 [0,2,0,0,0,0|1,0,0]=3 7817 B13R1.17 CCCCN(C)c1ccc(cn1)C 572b4efe5bd6320bd74d1f11f636f332 [0,2,0,0,0,0|1,0,0]=3 7818 B13R1.17 CCCCN(C)c1ccc(cn1)Cl c3dc1a262259cb5b39817611e43e18ce [0,2,0,0,0,0|1,0,0]=3 7819 B13R1.17 CCCCN(C)c1ccc(cn1)F bd1dadede668a8ceb16bf6fe065344e9 [0,2,0,0,0,0|1,0,0]=3 7820 B13R1.17 CCCCN(C)c1ccc(cn1)I 6235e1ed3a309f3edd7133521bce9a62 [0,2,0,0,0,0|1,0,0]=3 7821 B13R1.17 CCCCN(C)c1ccc(nn1)Br 553d236b5fa636b63e78efaf2c7265fa [0,2,0,0,0,0|2,0,0]=4 7822 B13R1.17 CCCCN(C)c1ccc(nn1)Cl 86420d84cb626f5ea636251a3b956cc7 [0,2,0,0,0,0|2,0,0]=4 7823 B13R1.17 CCCCN(C)c1cnc(cn1)Br 3f39fc4c4834bbbbdaedc8b5846c70fa [0,2,0,0,0,0|2,0,0]=4 7824 B13R1.17 CCCCN(C)c1cnc(cn1)C d4c6287a47e212f89a7762aac41b3e97 [0,2,0,0,0,0|2,0,0]=4 7825 B13R1.17 CCCCN(C)c1cnc(cn1)Cl e78fcbdcd1d1533367e64bc5f37fc932 [0,2,0,0,0,0|2,0,0]=4 7826 B13R1.17 CCCCN(C)c1ncc(cn1)Br 0a3283599e30ab6823a9df1bf0346014 [0,2,0,0,0,0|2,0,0]=4 7827 B13R1.17 CCCCN(C)c1ncc(cn1)C 528be243ce357621c2570e6cd6e2cabc [0,2,0,0,0,0|2,0,0]=4 7828 B13R1.17 CCCCN(C)c1ncc(cn1)Cl a261aff58d17f07ecb0c516ca42e1be2 [0,2,0,0,0,0|2,0,0]=4 7829 B13R1.17 CCCCN(C)c1ncc(cn1)F ed9de6698542f80e8a1c46aff3783ac6 [0,2,0,0,0,0|2,0,0]=4 7830 B13R1.17 CCCNC(=O)c1ccc(cn1)Br b2c285d0c9d6693831d09fee0f93bc56 [0,2,0,0,0,0|1,0,1]=4 7831 B13R1.17 CCCNC(=O)c1ccc(cn1)C b22c76f6a86a8bc3f93102d324fa8426 [0,2,0,0,0,0|1,0,1]=4 7832 B13R1.17 CCCNC(=O)c1ccc(cn1)Cl a5e8e397aefb81b07569119a7dabb28c [0,2,0,0,0,0|1,0,1]=4 7833 B13R1.17 CCCNC(=O)c1ccc(cn1)F e94e65f514d64ee8e3663078d7c953a4 [0,2,0,0,0,0|1,0,1]=4 7834 B13R1.17 CCCNC(=O)c1ccc(cn1)I 454e8725cb5aedc375aaf7539e6b6959 [0,2,0,0,0,0|1,0,1]=4 7835 B13R1.17 CCCNC(=O)c1ccc(cn1)O 1d7a4c1ffa36c9b85bac266aea30787a [0,2,0,0,0,0|1,0,1]=4 7836 B13R1.17 CCCNC(C)c1ccc(cc1)Br 149d45e68c419a13000ff7a7332779ce [0,2,0,0,0,0|2,0,0]=4 7837 B13R1.17 CCCNC(C)c1ccc(cc1)C be9411501dd3ba25492210c1ec55fb33 [0,2,0,0,0,0|2,0,0]=4 7838 B13R1.17 CCCNC(C)c1ccc(cc1)F 6346231ae3cb9ca27ddc8af4bef3f568 [0,2,0,0,0,0|2,0,0]=4 7839 B13R1.17 CCCNC(C)c1ccc(cc1)I 29715955b8b0cac2cef214e92c6322f7 [0,2,0,0,0,0|2,0,0]=4 7840 B13R1.17 CCCNC(C)c1ccc(cn1)C 46b05cfe21e5583ef56d1e3eeb074ef5 [0,2,0,0,0,0|1,0,0]=3 7841 B13R1.17 CCCNC(C)c1ccc(cn1)Cl e01d17c676b13de7b9b4d5ed48b64f57 [0,2,0,0,0,0|1,0,0]=3 7842 B13R1.17 CCCNC(C)c1ccc(cn1)F 69429a96497632a3c9ae0f8fef581b5d [0,2,0,0,0,0|1,0,0]=3 7843 B13R1.17 CCCNC(C)c1ncc(cn1)C 40c00b23cf38fd9b936f56fd4b58d907 [0,2,0,0,0,0|2,0,0]=4 7844 B13R1.17 CCCNC(C)c1ncc(cn1)F e70cbd097d39bacef7bff5214f0bdc1a [0,2,0,0,0,0|2,0,0]=4 7845 B13R1.17 CCCN[C@@H](C)c1ccc(cc1)Br 4c36e818323715c4093b3da121e9eb04 [0,2,0,0,0,0|2,0,0]=4 7846 B13R1.17 CCCN[C@@H](C)c1ccc(cc1)C 296d7ffd97f30d15a270e7aaee1b88c7 [0,2,0,0,0,0|2,0,0]=4 7847 B13R1.17 CCCN[C@@H](C)c1ccc(cc1)F fe53c4a44f13e246100324c5a09e7218 [0,2,0,0,0,0|2,0,0]=4 7848 B13R1.17 CCCN[C@@H](C)c1ccc(cc1)I 3d7bbb8ef1109b3670ffd0dcb42b36f7 [0,2,0,0,0,0|2,0,0]=4 7849 B13R1.17 CCCN[C@@H](C)c1ccc(cn1)Cl 812427141c1bc05f1543170094e5c167 [0,2,0,0,0,0|1,0,0]=3 7850 B13R1.17 CCCN[C@@H](C)c1ccc(cn1)F e151d8ff636e03b9ec1c3626e687e346 [0,2,0,0,0,0|1,0,0]=3 7851 B13R1.17 CCCN[C@@H](C)c1ncc(cn1)C c3c5edeed20eaa966731304b97daa1ad [0,2,0,0,0,0|2,0,0]=4 7852 B13R1.17 CCCN[C@@H](C)c1ncc(cn1)F 148e2e314fd10981230923d7546ba368 [0,2,0,0,0,0|2,0,0]=4 7853 B13R1.17 CCCN[C@H](C)c1ccc(cc1)Br 9ed7228ff8db2a7ee9cbcac4bb722be6 [0,2,0,0,0,0|2,0,0]=4 7854 B13R1.17 CCCN[C@H](C)c1ccc(cc1)C 6408087848430a4fed1d1a70ed5b0b6c [0,2,0,0,0,0|2,0,0]=4 7855 B13R1.17 CCCN[C@H](C)c1ccc(cc1)F 9655711fb7ce93ab3ae189761d17fe6a [0,2,0,0,0,0|2,0,0]=4 7856 B13R1.17 CCCN[C@H](C)c1ccc(cc1)I 6bed810f506b2c7b6e766969c9f26032 [0,2,0,0,0,0|2,0,0]=4 7857 B13R1.17 CCCN[C@H](C)c1ccc(cn1)C eac73bd9f202eb4332038017599cbf9a [0,2,0,0,0,0|1,0,0]=3 7858 B13R1.17 CCCN[C@H](C)c1ncc(cn1)F d778631216ed20956c440a8b553823cf [0,2,0,0,0,0|2,0,0]=4 7859 B13R1.17 CCCOC(C)c1ccc(cc1)Br 24e9fc6be2d279796662c6b20f704e6c [0,2,0,0,0,0|2,0,0]=4 7860 B13R1.17 CCCOC(C)c1ccc(cc1)C 2db940d1d4a2b77ea414cb36093162cd [0,2,0,0,0,0|2,0,0]=4 7861 B13R1.17 CCCOC(C)c1ccc(cc1)Cl 1ea807a30b00bbb4da60c630db391d89 [0,2,0,0,0,0|2,0,0]=4 7862 B13R1.17 CCCOC(C)c1ccc(cc1)F b02029d96d953868ea041c71ffe50e2d [0,2,0,0,0,0|2,0,0]=4 7863 B13R1.17 CCCOC(C)c1ccc(cc1)I b7cd81099c485cb8e0f483501f46222a [0,2,0,0,0,0|2,0,0]=4 7864 B13R1.17 CCCOC(C)c1ccc(cn1)C a9709550248944a29872ded1e2421e6c [0,2,0,0,0,0|1,0,0]=3 7865 B13R1.17 CCCOC(C)c1ccc(cn1)Cl 9ec24a6852b90aab4b17b7d2215af364 [0,2,0,0,0,0|1,0,0]=3 7866 B13R1.17 CCCOC(C)c1ccc(cn1)F 43e97e4fbe9d8e90017f070a3ef15f6f [0,2,0,0,0,0|1,0,0]=3 7867 B13R1.17 CCCOC(C)c1ccc(nn1)C f27ad22163c150aec490d7c7a82cf04f [0,2,0,0,0,0|2,0,0]=4 7868 B13R1.17 CCCOC(C)c1ncc(cn1)F 9c34ef89a68fed4b24672381a7e1499a [0,2,0,0,0,0|2,0,0]=4 7869 B13R1.17 CCCO[C@@H](C)c1ccc(cc1)Br e430af95dfd9cd28f5a0320cf32f25d9 [0,2,0,0,0,0|2,0,0]=4 7870 B13R1.17 CCCO[C@@H](C)c1ccc(cc1)C 9da61d82ea7feff1a540691d9d178098 [0,2,0,0,0,0|2,0,0]=4 7871 B13R1.17 CCCO[C@@H](C)c1ccc(cc1)Cl 284e36b019d479e807504ea421575b50 [0,2,0,0,0,0|2,0,0]=4 7872 B13R1.17 CCCO[C@@H](C)c1ccc(cc1)F 43cf5aeb48eae5bab1cbef38bf82c916 [0,2,0,0,0,0|2,0,0]=4 7873 B13R1.17 CCCO[C@@H](C)c1ccc(cc1)I b36c7551934e64f484772e172d69efae [0,2,0,0,0,0|2,0,0]=4 7874 B13R1.17 CCCO[C@H](C)c1ccc(cc1)Br d6b3e4a36ee16607da8eaac1e0469ce6 [0,2,0,0,0,0|2,0,0]=4 7875 B13R1.17 CCCO[C@H](C)c1ccc(cc1)C 106fe624213a9914a9ccc05e14c6718f [0,2,0,0,0,0|2,0,0]=4 7876 B13R1.17 CCCO[C@H](C)c1ccc(cc1)Cl 7353fddcf530d3a36ec0ed4f540a40bb [0,2,0,0,0,0|2,0,0]=4 7877 B13R1.17 CCCO[C@H](C)c1ccc(cc1)F 655245918f4f08458cf26f98c7bd282e [0,2,0,0,0,0|2,0,0]=4 7878 B13R1.17 CCCO[C@H](C)c1ccc(cc1)I 82b8586b5ee141c5610d51708938fa4c [0,2,0,0,0,0|2,0,0]=4 7879 B13R1.17 CCCO[C@H](C)c1ccc(cn1)F 677977ff088f3d9749079bff3bc6294a [0,2,0,0,0,0|1,0,0]=3 7880 B13R1.17 CCNCC(O)c1ccc(cc1)Br c5078f73f9236806de13372fb4090799 [0,2,0,0,0,0|2,0,0]=4 7881 B13R1.17 CCNCC(O)c1ccc(cc1)C b3b55aee14fd11e98aaf485cbc3b8f36 [0,2,0,0,0,0|2,0,0]=4 7882 B13R1.17 CCNCC(O)c1ccc(cc1)Cl 2b0339c50e5a60c0760ef52598579d32 [0,2,0,0,0,0|2,0,0]=4 7883 B13R1.17 CCNCC(O)c1ccc(cc1)F b1b03683730dbf1ed29315cf11677ed9 [0,2,0,0,0,0|2,0,0]=4 7884 B13R1.17 CCOCC(C)c1ccc(cc1)C d452040fe2e7a411bae9689de9820629 [0,2,0,0,0,0|2,0,0]=4 7885 B13R1.17 CCOCC(C)c1ccc(cc1)F f7b923544fb63ea21b8522717ef752cb [0,2,0,0,0,0|2,0,0]=4 7886 B13R1.17 CCOCN(C)c1ccc(cn1)Cl 3eecc102e38ef0496a0937269b8f481f [0,2,0,0,0,0|2,0,0]=4 7887 B13R1.17 CCOCN(C)c1ccc(cn1)F 92d0aea2dc83182ab0e3020dcd7e105d [0,2,0,0,0,0|2,0,0]=4 7888 B13R1.17 CCOCN(C)c1ccc(cn1)I 342fe0bcd917f4f8460d8394f6bc4598 [0,2,0,0,0,0|2,0,0]=4 7889 B13R1.17 CN(CCCF)c1ccc(cn1)Br df3145e9aa42603e201b59c2b459ddef [0,2,0,0,0,0|2,0,0]=4 7890 B13R1.17 CN(CCCF)c1ccc(cn1)Cl c6c07c84bbb381d17921f49387ea7e8a [0,2,0,0,0,0|2,0,0]=4 7891 B13R1.17 CN(CCCF)c1ccc(cn1)F 8fa73c1b2adab4ffb457f02cd742f164 [0,2,0,0,0,0|2,0,0]=4 7892 B13R1.17 CN(CCCF)c1ccc(cn1)I 253a3a3911a510d582077bc6b8fcbb70 [0,2,0,0,0,0|2,0,0]=4 7893 B13R1.17 CN(CCCO)c1ccc(cn1)Br eca1e2319278a1da6d71363646daafeb [0,2,0,0,0,0|2,0,0]=4 7894 B13R1.17 CN(CCCO)c1ccc(cn1)Cl f39c1324aabe7f0c2061d724a92dd2ec [0,2,0,0,0,0|2,0,0]=4 7895 B13R1.17 CN(CCCO)c1ccc(cn1)F 900e78259cc5d1b001aba57547d097eb [0,2,0,0,0,0|2,0,0]=4 7896 B13R1.17 CN(CCCO)c1ccc(cn1)I c08236e13c460a683e6b30a5b488f4b4 [0,2,0,0,0,0|2,0,0]=4 7897 B13R1.17 CN(CCCS)c1ccc(cn1)Br 3508c8adf3eeb48d1b0b9f1dcca98981 [0,2,0,0,0,0|2,0,0]=4 7898 B13R1.17 CN(CCCS)c1ccc(cn1)Cl e96ffc6fa99de1b37598a762cc97eb4e [0,2,0,0,0,0|2,0,0]=4 7899 B13R1.17 CN(CCCS)c1ccc(cn1)F 5b7546909818135f013137cc256c3120 [0,2,0,0,0,0|2,0,0]=4 7900 B13R1.17 CN(CCCS)c1ccc(cn1)I 4c71dc5f8b3560d7bcf5b8a4f1227185 [0,2,0,0,0,0|2,0,0]=4 7901 B13R1.17 COCCN(C)c1ccc(cn1)Br 54c4cce768b02210d3d32f1f8e39f659 [0,2,0,0,0,0|2,0,0]=4 7902 B13R1.17 COCCN(C)c1ccc(cn1)C 766a972ee90870fe606aa85701de0721 [0,2,0,0,0,0|2,0,0]=4 7903 B13R1.17 COCCN(C)c1ccc(cn1)Cl d97e2080bb730555e405aecef6f44066 [0,2,0,0,0,0|2,0,0]=4 7904 B13R1.17 COCCN(C)c1ccc(cn1)F 0c5df491f8ad890f919ac23096d07fb2 [0,2,0,0,0,0|2,0,0]=4 7905 B13R1.17 COCCN(C)c1ccc(cn1)I 85a5b31624eb43c338bb8900f34f8384 [0,2,0,0,0,0|2,0,0]=4 7906 B13R1.17 COCNC(C)c1ccc(cn1)Br 850b13c3497144faad1768e7fe24920e [0,2,0,0,0,0|2,0,0]=4 7907 B13R1.17 COCNC(C)c1ccc(cn1)C 1c1231bd4ef60318ab5f90868a7e69c1 [0,2,0,0,0,0|2,0,0]=4 7908 B13R1.17 COCNC(C)c1ccc(cn1)Cl d1722e78b3bd8c6b8f786d802c00b84f [0,2,0,0,0,0|2,0,0]=4 7909 B13R1.17 COCNC(C)c1ccc(cn1)F fbd659d925384802f901a894c9340a68 [0,2,0,0,0,0|2,0,0]=4 7910 B13R1.17 COCN[C@@H](C)c1ccc(cn1)Br 40b95798f974e5b1f2fac6e6e907b7ff [0,2,0,0,0,0|2,0,0]=4 7911 B13R1.17 COCN[C@@H](C)c1ccc(cn1)Cl 8c866d6416c08965a9bdb709b5b98557 [0,2,0,0,0,0|2,0,0]=4 7912 B13R1.17 COCN[C@@H](C)c1ccc(cn1)F b394b8af6638163429aae627ba01798a [0,2,0,0,0,0|2,0,0]=4 7913 B13R1.17 COCN[C@H](C)c1ccc(cn1)Br 6cf5945b1858b2eaf476c42654666710 [0,2,0,0,0,0|2,0,0]=4 7914 B13R1.17 COCN[C@H](C)c1ccc(cn1)C a2683dee9d99a5f05fab0eceb17b88dc [0,2,0,0,0,0|2,0,0]=4 7915 B13R1.17 CSCCN(C)c1ccc(cn1)Br 8095c0b80b33d79699003b8755541907 [0,2,0,0,0,0|2,0,0]=4 7916 B13R1.17 CSCCN(C)c1ccc(cn1)C 9dba349907ce7c4d8c267996b3efa56c [0,2,0,0,0,0|2,0,0]=4 7917 B13R1.17 CSCCN(C)c1ccc(cn1)Cl 5899f510289a6e62650916daeba1b071 [0,2,0,0,0,0|2,0,0]=4 7918 B13R1.17 CSCCN(C)c1ccc(cn1)F de838a2a76def3ad2fe1ea2303d26dea [0,2,0,0,0,0|2,0,0]=4 7919 B13R1.17 CSCCN(C)c1ccc(cn1)I 3028f542a2aac37d260d7143212e9b31 [0,2,0,0,0,0|2,0,0]=4 7920 B13R1.17 CSCNC(C)c1ccc(cn1)C 54323049691877f0ee12748466e992bf [0,2,0,0,0,0|2,0,0]=4 7921 B13R1.17 CSCNC(C)c1ccc(cn1)Cl a10ef16ce99dad7219bdc73a079a01bb [0,2,0,0,0,0|2,0,0]=4 7922 B13R1.17 CSCNC(C)c1ccc(cn1)F 90195a19a3c1532b0d786e7b101a6e05 [0,2,0,0,0,0|2,0,0]=4 7923 B13R1.17 CSCN[C@@H](C)c1ccc(cn1)Cl 18f4447bcfbbd490834304b6467c7cbe [0,2,0,0,0,0|2,0,0]=4 7924 B13R1.17 CSCN[C@@H](C)c1ccc(cn1)F 4ca1a95b3f22bf8fba389da4f84f5670 [0,2,0,0,0,0|2,0,0]=4 7925 B13R1.17 CSCN[C@H](C)c1ccc(cn1)C bc1dbf508ba2f9c4487c66fc3019a349 [0,2,0,0,0,0|2,0,0]=4 7926 B13R1.17 C[C@@H](NCCO)c1ccc(cn1)Br 182b718aa7d1358fd0e8e23dd540e020 [0,2,0,0,0,0|2,0,0]=4 7927 B13R1.17 C[C@@H](NCCS)c1ccc(cn1)Br ace602f7dffa27cd00b77c1fed3ee3f8 [0,2,0,0,0,0|2,0,0]=4 7928 B13R1.17 C[C@@H](OCCF)c1ccc(cn1)F ad9f4f01b33b40377c7d78771a5a36ac [0,2,0,0,0,0|2,0,0]=4 7929 B13R1.17 C[C@@H](OCCS)c1ccc(cn1)Br 6add5bdb6f52828a6e455c2343af83d3 [0,2,0,0,0,0|2,0,0]=4 7930 B13R1.17 C[C@@H](OCCS)c1ccc(cn1)F aa5d2184dffa230a7fb5874996a35e10 [0,2,0,0,0,0|2,0,0]=4 7931 B13R1.17 C[C@H](NCCF)c1ccc(cn1)Cl 2dc8b9e49c8f89a2030cf3b1b98033b5 [0,2,0,0,0,0|2,0,0]=4 7932 B13R1.17 C[C@H](NCCF)c1ccc(cn1)F 026baf3f61509c4e149cd554145943ec [0,2,0,0,0,0|2,0,0]=4 7933 B13R1.17 C[C@H](NCCO)c1ccc(cn1)Br 3adc3c459580a3a5bd1182bdb63a5c8f [0,2,0,0,0,0|2,0,0]=4 7934 B13R1.17 C[C@H](NCCO)c1ccc(cn1)Cl 242643520358c4672ab8851bec242296 [0,2,0,0,0,0|2,0,0]=4 7935 B13R1.17 C[C@H](NCCO)c1ccc(cn1)F 9355f27f512e830ef8e1f4b00bbdf23f [0,2,0,0,0,0|2,0,0]=4 7936 B13R1.17 C[C@H](NCCS)c1ccc(cn1)Br 65a8a9a5e64a280066c321dc143d9f31 [0,2,0,0,0,0|2,0,0]=4 7937 B13R1.17 C[C@H](NCCS)c1ccc(cn1)Cl f337d88fb4b9aa18c4d253e7c86cb109 [0,2,0,0,0,0|2,0,0]=4 7938 B13R1.17 C[C@H](NCCS)c1ccc(cn1)F 5f4c671d3233e1fe02a45dcbb76b6c6a [0,2,0,0,0,0|2,0,0]=4 7939 B13R1.17 C[C@H](OCCS)c1ccc(cn1)Br 6714e7c21ec72c60b2b53981ff722d37 [0,2,0,0,0,0|2,0,0]=4 7940 B13R1.17 Cc1ccc(nc1)C(C)NCCF 112e7dd33f59a1da7bcc2bdc6f403d3a [0,2,0,0,0,0|2,0,0]=4 7941 B13R1.17 Cc1ccc(nc1)C(C)NCCO 93eaeea15bdb6453f5c27458ff14104e [0,2,0,0,0,0|2,0,0]=4 7942 B13R1.17 Cc1ccc(nc1)C(C)NCCS b2a182778bc02f73772bb8f4e17ef918 [0,2,0,0,0,0|2,0,0]=4 7943 B13R1.17 Cc1ccc(nc1)C(C)OCCF c06223774c1bd3bd697031e647ba1aff [0,2,0,0,0,0|2,0,0]=4 7944 B13R1.17 Cc1ccc(nc1)C(C)OCCS 53aa980cc2289d65c232add34b1b5195 [0,2,0,0,0,0|2,0,0]=4 7945 B13R1.17 Cc1ccc(nc1)N(C)CCCF 49c5c6075650e05ca2443a31eb7c040a [0,2,0,0,0,0|2,0,0]=4 7946 B13R1.17 Cc1ccc(nc1)N(C)CCCO 36af8dbcfa2e51b0c23ef1da4ed78f6f [0,2,0,0,0,0|2,0,0]=4 7947 B13R1.17 Cc1ccc(nc1)N(C)CCCS 8ba1fccabea1677d35204d2728e652fd [0,2,0,0,0,0|2,0,0]=4 7948 B13R1.17 Cc1ccc(nc1)[C@@H](C)NCCF fe2366df90cc0823e1c9da09e2dd4806 [0,2,0,0,0,0|2,0,0]=4 7949 B13R1.17 Cc1ccc(nc1)[C@@H](C)NCCO 2ed7d8c4cce44e463cae68bee6450032 [0,2,0,0,0,0|2,0,0]=4 7950 B13R1.17 Cc1ccc(nc1)[C@@H](C)NCCS d438f53383b7de83b07e6a903aec16bb [0,2,0,0,0,0|2,0,0]=4 7951 B13R1.19 CC(CCO)Nc1ccc(cn1)Br 7adc42398e91070f9356418e6c999f7b [0,2,0,0,0,0|2,0,0]=4 7952 B13R1.19 CC(CCO)Nc1ccc(cn1)Cl 294ba86d62e1c1e5d090a086c4825620 [0,2,0,0,0,0|2,0,0]=4 7953 B13R1.19 CC(CCO)Nc1ccc(cn1)F b86ec6ac9183cff482f7409cc3b44545 [0,2,0,0,0,0|2,0,0]=4 7954 B13R1.19 CC(CCO)Nc1ccc(cn1)I 1d7547eb785162aea2b86b3ff6ca7a2c [0,2,0,0,0,0|2,0,0]=4 7955 B13R1.19 CCCC(=O)Nc1ccc(cn1)C 969658f9c4472e5d90ca5f6c2b841fac [0,2,0,0,0,0|1,0,1]=4 7956 B13R1.19 CCCC(=O)Nc1ccc(cn1)Cl 23ae439dd28e6a41978393a07122cdaa [0,2,0,0,0,0|1,0,1]=4 7957 B13R1.19 CCCC(=O)Nc1ccc(cn1)F 71a53ebad5e3deb06e053364b128af4e [0,2,0,0,0,0|1,0,1]=4 7958 B13R1.19 CCCC(=O)Nc1ccc(cn1)I ac255d33dfdd2ab87b159a91308bf62f [0,2,0,0,0,0|1,0,1]=4 7959 B13R1.19 CCCC(=O)Nc1ccc(cn1)O 9b0a79f05caf912e8354afe536c92635 [0,2,0,0,0,0|1,0,1]=4 7960 B13R1.19 CCCC(C)Nc1ccc(cc1)Br 94393f6e49ce4e841afe71c5d786e821 [0,2,0,0,0,0|2,0,0]=4 7961 B13R1.19 CCCC(C)Nc1ccc(cc1)C db390ceecbe6d9b557ce25a76c589ded [0,2,0,0,0,0|2,0,0]=4 7962 B13R1.19 CCCC(C)Nc1ccc(cc1)Cl 5fe588f161354eab1df368531b9a9fbb [0,2,0,0,0,0|2,0,0]=4 7963 B13R1.19 CCCC(C)Nc1ccc(cc1)F 9b117c2943444557d5c79269a591d427 [0,2,0,0,0,0|2,0,0]=4 7964 B13R1.19 CCCC(C)Nc1ccc(cc1)I 2bd442d313ec350a57b5e8be529a4d62 [0,2,0,0,0,0|2,0,0]=4 7965 B13R1.19 CCCC(C)Nc1ccc(cc1)S 1fc3c0d23527ca99313ddc6b8d354f2a [0,2,0,0,0,0|2,0,0]=4 7966 B13R1.19 CCCC(C)Nc1ccc(cn1)Br c033684cf2efe0bdb7e3bd2033041f38 [0,2,0,0,0,0|1,0,0]=3 7967 B13R1.19 CCCC(C)Nc1ccc(cn1)C e77cb007792971f549584c60a422b6b5 [0,2,0,0,0,0|1,0,0]=3 7968 B13R1.19 CCCC(C)Nc1ccc(cn1)Cl 897fdb5ddc6cbbc0cc42a54083e5079b [0,2,0,0,0,0|1,0,0]=3 7969 B13R1.19 CCCC(C)Nc1ccc(cn1)F e66d252dd9e712d471276c6aaf7e2fce [0,2,0,0,0,0|1,0,0]=3 7970 B13R1.19 CCCC(C)Nc1ccc(cn1)I 55136affe9a0e05784b43c29be20594b [0,2,0,0,0,0|1,0,0]=3 7971 B13R1.19 CCCC(C)Nc1ccc(nn1)Br 5c968fa089fd0cfad7c766bcc8569fb2 [0,2,0,0,0,0|2,0,0]=4 7972 B13R1.19 CCCC(C)Nc1ccc(nn1)C 8d29777c3244bd0e877956b97ea959c3 [0,2,0,0,0,0|2,0,0]=4 7973 B13R1.19 CCCC(C)Nc1ccc(nn1)Cl 5268bad65b2a671c559b5d83795c97b3 [0,2,0,0,0,0|2,0,0]=4 7974 B13R1.19 CCCC(C)Nc1ccc(nn1)F 9734922d813d20338d37f66a4c38b350 [0,2,0,0,0,0|2,0,0]=4 7975 B13R1.19 CCCC(C)Nc1ccc(nn1)I 649604573c5aa501d443198a160c3fe5 [0,2,0,0,0,0|2,0,0]=4 7976 B13R1.19 CCCC(C)Nc1cnc(cn1)Br 19918fb707e07d8f8cfe05295ddcf436 [0,2,0,0,0,0|2,0,0]=4 7977 B13R1.19 CCCC(C)Nc1cnc(cn1)C add5c2fb1f694808545d2fff510f7acd [0,2,0,0,0,0|2,0,0]=4 7978 B13R1.19 CCCC(C)Nc1ncc(cn1)F b44dd18ab58137e37f959c3b0be2c804 [0,2,0,0,0,0|2,0,0]=4 7979 B13R1.19 CCCC(C)Nc1ncc(cn1)I 5693075ce5421fd726f63f58af373127 [0,2,0,0,0,0|2,0,0]=4 7980 B13R1.19 CCCC(C)Oc1ccc(cc1)Br 97143a3beb53b6f1359b804ff8f86d16 [0,2,0,0,0,0|2,0,0]=4 7981 B13R1.19 CCCC(C)Oc1ccc(cc1)C 6239bcb3d775da9017463ca9a98eade5 [0,2,0,0,0,0|2,0,0]=4 7982 B13R1.19 CCCC(C)Oc1ccc(cc1)Cl 787f944b860105fe6945086d5c4d9e86 [0,2,0,0,0,0|2,0,0]=4 7983 B13R1.19 CCCC(C)Oc1ccc(cc1)F 3f6b27b6bc4976d7789d184f6f31cb6c [0,2,0,0,0,0|2,0,0]=4 7984 B13R1.19 CCCC(C)Oc1ccc(cc1)I 23632f36d532ab262b74b44e96d3c34f [0,2,0,0,0,0|2,0,0]=4 7985 B13R1.19 CCCC(C)Oc1ccc(cc1)S f246d37ac9b2852123cea010ef5b52d2 [0,2,0,0,0,0|2,0,0]=4 7986 B13R1.19 CCCC(C)Oc1ccc(cn1)C a148c702b995833b1754ea70bf660696 [0,2,0,0,0,0|1,0,0]=3 7987 B13R1.19 CCCC(C)Oc1ccc(cn1)Cl 24d406f7aa1a424108a69e6c5b2a2423 [0,2,0,0,0,0|1,0,0]=3 7988 B13R1.19 CCCC(C)Oc1ccc(cn1)F fc0ad407ee1600cac54323b47633cb07 [0,2,0,0,0,0|1,0,0]=3 7989 B13R1.19 CCCC(C)Oc1ccc(cn1)I 793094c742483557760eefa50f590610 [0,2,0,0,0,0|1,0,0]=3 7990 B13R1.19 CCCC(C)Oc1ccc(nn1)Br 8e66e9b206fc1b916bb62bc2aa9f0358 [0,2,0,0,0,0|2,0,0]=4 7991 B13R1.19 CCCC(C)Oc1ccc(nn1)C de9f2200c0fadee702ba9a2b067bd534 [0,2,0,0,0,0|2,0,0]=4 7992 B13R1.19 CCCC(C)Oc1ccc(nn1)Cl aca8f6fa010a8e7036383e479388f073 [0,2,0,0,0,0|2,0,0]=4 7993 B13R1.19 CCCC(C)Oc1cnc(cn1)Br 5f741adf5c2e9200d6e83c800da55aa3 [0,2,0,0,0,0|2,0,0]=4 7994 B13R1.19 CCCC(C)Oc1cnc(cn1)C e29d8f3354f3561fa3a71b43fed5ed44 [0,2,0,0,0,0|2,0,0]=4 7995 B13R1.19 CCCC(C)Oc1cnc(cn1)Cl 8df58f5071237e240f541e9099ddd93e [0,2,0,0,0,0|2,0,0]=4 7996 B13R1.19 CCCC(C)Oc1ncc(cn1)C 56e01326ac6894d53dc5d1437b48003a [0,2,0,0,0,0|2,0,0]=4 7997 B13R1.19 CCCC(C)Oc1ncc(cn1)F ee04c1f2000adee417288f914326d437 [0,2,0,0,0,0|2,0,0]=4 7998 B13R1.19 CCCC(C)Oc1ncc(cn1)I 22ae52cfd3da0415ef5e0ab69e23f3bf [0,2,0,0,0,0|2,0,0]=4 7999 B13R1.19 CCCN(C)Cc1ccc(cc1)Br 62653a86be42ce3e72d9e9b083dd762e [0,2,0,0,0,0|2,0,0]=4 8000 B13R1.19 CCCN(C)Cc1ccc(cc1)C 133e85b2690cc266927e4399c3b74d22 [0,2,0,0,0,0|2,0,0]=4 8001 B13R1.19 CCCN(C)Cc1ccc(cc1)Cl b89261bc18c005a2226107e9698e562e [0,2,0,0,0,0|2,0,0]=4 8002 B13R1.19 CCCN(C)Cc1ccc(cc1)F b02f2b1cbbff64c1b543d296ff1560b0 [0,2,0,0,0,0|2,0,0]=4 8003 B13R1.19 CCCN(C)Cc1ccc(cc1)I 8998eb47904d8cc875d70322570e79cf [0,2,0,0,0,0|2,0,0]=4 8004 B13R1.19 CCCN(C)Cc1ccc(cn1)C 7f88ebd139e15299465dd89e274892f5 [0,2,0,0,0,0|1,0,0]=3 8005 B13R1.19 CCCN(C)Cc1ccc(cn1)Cl cbeb8b40c1c4f1c8344d420661e30d15 [0,2,0,0,0,0|1,0,0]=3 8006 B13R1.19 CCCN(C)Cc1ccc(cn1)F d863df7e144ab0bc78cd2d91485ae5f6 [0,2,0,0,0,0|1,0,0]=3 8007 B13R1.19 CCCN(C)Cc1ncc(cn1)Br b6cefb25da00a1a4cbb6d21746aa5300 [0,2,0,0,0,0|2,0,0]=4 8008 B13R1.19 CCCN(C)Cc1ncc(cn1)Cl e8cbc8e82001e36b46ce885ef6251bf4 [0,2,0,0,0,0|2,0,0]=4 8009 B13R1.19 CCCN(C)Cc1ncc(cn1)F e996dbd0d3251f57f8632833ae24ff29 [0,2,0,0,0,0|2,0,0]=4 8010 B13R1.19 CCOC(C)Cc1ccc(cc1)Br 3fdf521a319e0e78be0495bf12eb7f03 [0,2,0,0,0,0|2,0,0]=4 8011 B13R1.19 CCOC(C)Cc1ccc(cc1)C aac6b7aadd720c4e186d38ccb56b3a07 [0,2,0,0,0,0|2,0,0]=4 8012 B13R1.19 CCOC(C)Cc1ccc(cc1)Cl c54d0ccb44b9aa8afda74608e8eabef9 [0,2,0,0,0,0|2,0,0]=4 8013 B13R1.19 CCOC(C)Cc1ccc(cc1)F f2833c102a33390986dcb8c6a2e5b305 [0,2,0,0,0,0|2,0,0]=4 8014 B13R1.19 CN(CCF)Cc1ccc(cn1)Cl 535fea0f4688f3327c788c1181ac2fec [0,2,0,0,0,0|2,0,0]=4 8015 B13R1.19 CN(CCF)Cc1ccc(cn1)F 1d3d8a29c13e365c347615d67c2379f5 [0,2,0,0,0,0|2,0,0]=4 8016 B13R1.19 CN(CCO)Cc1ccc(cn1)Cl f2ae2125769f9c2f479f6667088ca862 [0,2,0,0,0,0|2,0,0]=4 8017 B13R1.19 CN(CCO)Cc1ccc(cn1)F 248eb8453362c83e6ce6a114192d22d5 [0,2,0,0,0,0|2,0,0]=4 8018 B13R1.19 COCC(C)Nc1ccc(cn1)Br 31550051dfe7d5b2b5d279ce37671c0e [0,2,0,0,0,0|2,0,0]=4 8019 B13R1.19 COCC(C)Nc1ccc(cn1)C b7c6723f7b91502d2ec355e94981f28d [0,2,0,0,0,0|2,0,0]=4 8020 B13R1.19 COCC(C)Nc1ccc(cn1)Cl 5d736b429407c7f9a4f30ed261d038df [0,2,0,0,0,0|2,0,0]=4 8021 B13R1.19 COCC(C)Nc1ccc(cn1)F 031884176376a6d3e45255ec05bfb3f7 [0,2,0,0,0,0|2,0,0]=4 8022 B13R1.19 COCC(C)Nc1ccc(cn1)I c6bb2b9f311a5de6386a6628396bd98a [0,2,0,0,0,0|2,0,0]=4 8023 B13R1.19 COCC(C)Oc1ccc(cn1)C e8abb393529daa58ee281e9974593a90 [0,2,0,0,0,0|2,0,0]=4 8024 B13R1.19 COCC(C)Oc1ccc(cn1)Cl b7ff40473ddd1f5a6fda3fc4893735cc [0,2,0,0,0,0|2,0,0]=4 8025 B13R1.19 COCC(C)Oc1ccc(cn1)F 561f74138d7db7578e6655e54912f66f [0,2,0,0,0,0|2,0,0]=4 8026 B13R1.19 COCC(C)Oc1ccc(cn1)I d8306b536b35523e98fdf3a9cab2bc82 [0,2,0,0,0,0|2,0,0]=4 8027 B13R1.19 COCN(C)Cc1ccc(cn1)C adfc4d510695ddf0c33a95899ac16d39 [0,2,0,0,0,0|2,0,0]=4 8028 B13R1.19 CSCN(C)Cc1ccc(cn1)C 6995e5a965775beeb5d5b6ba42c45683 [0,2,0,0,0,0|2,0,0]=4 8029 B13R1.19 Cc1ccc(nc1)CN(C)CCF 5c7c09f50e72397f948586c1c547e851 [0,2,0,0,0,0|2,0,0]=4 8030 B13R1.19 Cc1ccc(nc1)CN(C)CCO d4d914d53af1b9dd0399a426fa7442e2 [0,2,0,0,0,0|2,0,0]=4 8031 B13R1.19 Cc1ccc(nc1)CN(C)CCS dc1261a4d72df5457d8bfb6b35188f2c [0,2,0,0,0,0|2,0,0]=4 8032 B13R1.19 Cc1ccc(nc1)NC(C)CCO 388ac8ca032a9754f035294e47def666 [0,2,0,0,0,0|2,0,0]=4 8033 B13R1.369 CCCCNc1ccc(c[n+]1[O-])C 78dcdbfb240e0a60339dc79ad21539d6 [0,2,0,0,0,0|1,0,1]=4 8034 B13R1.369 CCCCNc1ccc(c[n+]1[O-])F e3a7f208c06be222fd6b55e2f8918fd5 [0,2,0,0,0,0|1,0,1]=4 8035 B13R1.369 CCCCNc1ccc(cc1Br)Cl d9cb2f37401e2a10a077307295c6057e [0,2,0,0,0,0|2,0,0]=4 8036 B13R1.369 CCCCNc1ccc(cc1Br)F 2247224c5b1d1f1e6eac4a108133494f [0,2,0,0,0,0|2,0,0]=4 8037 B13R1.369 CCCCNc1ccc(cc1Br)I 076ad6c0a0b492b3fbb4893884b70a63 [0,2,0,0,0,0|2,0,0]=4 8038 B13R1.369 CCCCNc1ccc(cc1C)C 56aeaec6a7816e8f1e30961c029fd190 [0,2,0,0,0,0|2,0,0]=4 8039 B13R1.369 CCCCNc1ccc(cc1C)Cl ea791f332b4fe3b840908e05965e1a97 [0,2,0,0,0,0|2,0,0]=4 8040 B13R1.369 CCCCNc1ccc(cc1C)F d2ac7b0f923f68222665a8bf0c5f1572 [0,2,0,0,0,0|2,0,0]=4 8041 B13R1.369 CCCCNc1ccc(cc1C)I c8054896e518325b810f7d560a4f6ef9 [0,2,0,0,0,0|2,0,0]=4 8042 B13R1.369 CCCCNc1ccc(cc1Cl)Br 95667088a00a1f58d64ea5cdedab3f43 [0,2,0,0,0,0|2,0,0]=4 8043 B13R1.369 CCCCNc1ccc(cc1Cl)C 036c9fe186f5639db8d87d230b64a9f1 [0,2,0,0,0,0|2,0,0]=4 8044 B13R1.369 CCCCNc1ccc(cc1Cl)Cl 8ea82fc1349b8ea1b7349908b6f65a7c [0,2,0,0,0,0|2,0,0]=4 8045 B13R1.369 CCCCNc1ccc(cc1Cl)F a19c326622b92ffa009a447a7f1fbfb4 [0,2,0,0,0,0|2,0,0]=4 8046 B13R1.369 CCCCNc1ccc(cc1Cl)I 1c1e742eeed6dc62724eed9db49bb385 [0,2,0,0,0,0|2,0,0]=4 8047 B13R1.369 CCCCNc1ccc(cc1F)Cl 653ae73969fce9edd173ec5616dffd9e [0,2,0,0,0,0|2,0,0]=4 8048 B13R1.369 CCCCNc1ccc(cc1F)I 556bf262babe7d37b67c6e70dc490bb2 [0,2,0,0,0,0|2,0,0]=4 8049 B13R1.369 CCCCNc1ccc(cc1I)Br 73277c89ab308597eae34db0a153d8a2 [0,2,0,0,0,0|2,0,0]=4 8050 B13R1.369 CCCCNc1ccc(cc1I)C 5bd4f4f4059f576f2f6c56213fce32e2 [0,2,0,0,0,0|2,0,0]=4 8051 B13R1.369 CCCCNc1ccc(cc1I)Cl e059838d94f97bc613f28be49ddcaeff [0,2,0,0,0,0|2,0,0]=4 8052 B13R1.369 CCCCNc1ccc(cc1I)F 087937c71b5ea03a7eb97f6ef88ae2cf [0,2,0,0,0,0|2,0,0]=4 8053 B13R1.369 CCCCNc1ccc(cc1I)I 59d8c7b11ce8c0b20f56a7a97429a79f [0,2,0,0,0,0|2,0,0]=4 8054 B13R1.369 CCCCNc1ccc(cc1N)N 33d7a73c390e543483be266cc4ff5e4e [0,2,0,0,0,0|2,0,0]=4 8055 B13R1.369 CCCCNc1ccc(cc1S)Br 788982252a598888b09128bc38c4ffa9 [0,2,0,0,0,0|2,0,0]=4 8056 B13R1.369 CCCCNc1ccc(cc1S)Cl 7c1e7b020834c48dc56a72a0ed7ae01c [0,2,0,0,0,0|2,0,0]=4 8057 B13R1.369 CCCCNc1ccc(cc1S)F f92ac07a02bb7ce6be6d995b51cdb1b7 [0,2,0,0,0,0|2,0,0]=4 8058 B13R1.369 CCCCNc1ncc([nH]c1=O)Br b6dd7c44211daca8093954902b4f6e59 [0,2,0,0,0,0|2,0,0]=4 8059 B13R1.369 CCCCNc1ncc([nH]c1=O)C 4df1677cb9fad6b3c009ab030f9e9e3f [0,2,0,0,0,0|2,0,0]=4 8060 B13R1.369 CCCCNc1ncc(cc1Br)Br 8f9c38224675aa51fa2a6d0a9c7abd41 [0,2,0,0,0,0|1,0,0]=3 8061 B13R1.369 CCCCNc1ncc(cc1Br)C 62d3db32a14a40e4a579c017ae1bcfcd [0,2,0,0,0,0|1,0,0]=3 8062 B13R1.369 CCCCNc1ncc(cc1Br)Cl 727b7609ec04cb10502e8324c9f61519 [0,2,0,0,0,0|1,0,0]=3 8063 B13R1.369 CCCCNc1ncc(cc1Br)F 35201de84252c3ba4174614c153b771b [0,2,0,0,0,0|1,0,0]=3 8064 B13R1.369 CCCCNc1ncc(cc1Br)I 725e334d3cc01a841f53e7ca50494fb7 [0,2,0,0,0,0|1,0,0]=3 8065 B13R1.369 CCCCNc1ncc(cc1C)Br a9847added93561fc1efb3cd80844323 [0,2,0,0,0,0|1,0,0]=3 8066 B13R1.369 CCCCNc1ncc(cc1C)C 20d042fcc00724c9d3d8fed5f5f3703d [0,2,0,0,0,0|1,0,0]=3 8067 B13R1.369 CCCCNc1ncc(cc1C)Cl 558951a7bdb7661b25b266c273ff1622 [0,2,0,0,0,0|1,0,0]=3 8068 B13R1.369 CCCCNc1ncc(cc1C)F 9c2cd5b94320784988e87b61e4deb4a5 [0,2,0,0,0,0|1,0,0]=3 8069 B13R1.369 CCCCNc1ncc(cc1C)I e4f3fa8bc76dcaedf4375d148296f3fe [0,2,0,0,0,0|1,0,0]=3 8070 B13R1.369 CCCCNc1ncc(cc1Cl)Br 16528de56407f0f9f36f8f8dd6565074 [0,2,0,0,0,0|1,0,0]=3 8071 B13R1.369 CCCCNc1ncc(cc1Cl)C 2bbbbbbd30b6c561e5ca0b04fff9a376 [0,2,0,0,0,0|1,0,0]=3 8072 B13R1.369 CCCCNc1ncc(cc1Cl)Cl 2da3f3df80638945061dd58e58d99dfb [0,2,0,0,0,0|1,0,0]=3 8073 B13R1.369 CCCCNc1ncc(cc1Cl)F 3231caccd040a3082a72f84f072de8c2 [0,2,0,0,0,0|1,0,0]=3 8074 B13R1.369 CCCCNc1ncc(cc1Cl)I 6afb819490ae1563f2bbfcc108a744ed [0,2,0,0,0,0|1,0,0]=3 8075 B13R1.369 CCCCNc1ncc(cc1F)Br 440a1391bf2f66007b1e26e82618ea86 [0,2,0,0,0,0|1,0,0]=3 8076 B13R1.369 CCCCNc1ncc(cc1F)C 9deec9329b35371d459350d4e5548ca3 [0,2,0,0,0,0|1,0,0]=3 8077 B13R1.369 CCCCNc1ncc(cc1F)Cl 42da181161568560cac0259318a10085 [0,2,0,0,0,0|1,0,0]=3 8078 B13R1.369 CCCCNc1ncc(cc1F)F db7b3211a9def3fdf382750c925ae439 [0,2,0,0,0,0|1,0,0]=3 8079 B13R1.369 CCCCNc1ncc(cc1F)I 1a85b54cf80bd3062771e1bd1503538b [0,2,0,0,0,0|1,0,0]=3 8080 B13R1.369 CCCCNc1ncc(cc1I)Br 3f5f7361fb871711a53a6474d7aebbc2 [0,2,0,0,0,0|1,0,0]=3 8081 B13R1.369 CCCCNc1ncc(cc1I)C c410c90aa71227bf554fadd163137085 [0,2,0,0,0,0|1,0,0]=3 8082 B13R1.369 CCCCNc1ncc(cc1I)Cl 7edff3b1c361142dfc3a1650deaa24ef [0,2,0,0,0,0|1,0,0]=3 8083 B13R1.369 CCCCNc1ncc(cc1I)F 3fde9ef98df698517717f2e117a9b584 [0,2,0,0,0,0|1,0,0]=3 8084 B13R1.369 CCCCNc1ncc(cc1I)I 5cef14fc46f72d2b0021d56cd31c3d7a [0,2,0,0,0,0|1,0,0]=3 8085 B13R1.369 CCCCNc1ncc(cc1N)N 2397da53f54f2195ca88af8de2ba1989 [0,2,0,0,0,0|1,0,0]=3 8086 B13R1.369 CCCCNc1ncc(nc1Br)Br a616820e472e01113858bf6d568063de [0,2,0,0,0,0|2,0,0]=4 8087 B13R1.369 CCCCNc1ncc(nc1Br)C 0086a7ea81ded0df6ed356288b3fdda7 [0,2,0,0,0,0|2,0,0]=4 8088 B13R1.369 CCCCNc1ncc(nc1Br)Cl a34e4ce3d30975266d67a320579919e0 [0,2,0,0,0,0|2,0,0]=4 8089 B13R1.369 CCCCNc1ncc(nc1Br)I 5ac6d842d1879da91745b6d01af86b6e [0,2,0,0,0,0|2,0,0]=4 8090 B13R1.369 CCCCNc1ncc(nc1C)Br 3bf067a1d9df5f83aa4b3cbe5ea3a72c [0,2,0,0,0,0|2,0,0]=4 8091 B13R1.369 CCCCNc1ncc(nc1C)C 46fa82cc1d5a6da3c23b9b888618484c [0,2,0,0,0,0|2,0,0]=4 8092 B13R1.369 CCCCNc1ncc(nc1C)Cl 90e7a6007f12829960537896793245b6 [0,2,0,0,0,0|2,0,0]=4 8093 B13R1.369 CCCCNc1ncc(nc1C)I adcc2c0bdb8708b015d4be97bdf09649 [0,2,0,0,0,0|2,0,0]=4 8094 B13R1.369 CCCCNc1ncc(nc1Cl)Br 39156c46983065c70e5f909a82c84cf8 [0,2,0,0,0,0|2,0,0]=4 8095 B13R1.369 CCCCNc1ncc(nc1Cl)C 7c833e54fdcf2ca98140d4eb54cda3e6 [0,2,0,0,0,0|2,0,0]=4 8096 B13R1.369 CCCCNc1ncc(nc1Cl)Cl d32c695c954abc936bbf1b3ea8e339f1 [0,2,0,0,0,0|2,0,0]=4 8097 B13R1.369 CCCCNc1ncc(nc1Cl)I 622b82ee73d94ed6a10469ea7ac948a6 [0,2,0,0,0,0|2,0,0]=4 8098 B13R1.369 CCCCNc1ncc(nc1I)Br a4cb8a27ffb7a1b490963c5b2fa3d96f [0,2,0,0,0,0|2,0,0]=4 8099 B13R1.369 CCCCNc1ncc(nc1I)Cl 5b198682f1e43e1412e21170e80ed11d [0,2,0,0,0,0|2,0,0]=4 8100 B13R1.369 CCCCNc1ncc(nc1N)N f4f4649d5a79fc7d7a868e5060681855 [0,2,0,0,0,0|2,0,0]=4 8101 B13R1.369 CCCCNc1nnc(cc1Br)Br 103f5637f28edd17383527089b93c00e [0,2,0,0,0,0|2,0,0]=4 8102 B13R1.369 CCCCNc1nnc(cc1Br)C 2d66e797b3f0d286caa3432c076a2c97 [0,2,0,0,0,0|2,0,0]=4 8103 B13R1.369 CCCCNc1nnc(cc1Br)Cl 24ce7bf055556f2a2eae26d0c73a8393 [0,2,0,0,0,0|2,0,0]=4 8104 B13R1.369 CCCCNc1nnc(cc1C)C ed78ab1c7bfcff11fe2602b563d7fed2 [0,2,0,0,0,0|2,0,0]=4 8105 B13R1.369 CCCCNc1nnc(cc1C)Cl 6942e3c2410ec8bab7fc188d987c7a22 [0,2,0,0,0,0|2,0,0]=4 8106 B13R1.369 CCCCNc1nnc(cc1Cl)C 03d7c6edd871fedfc230b17b7a4d8173 [0,2,0,0,0,0|2,0,0]=4 8107 B13R1.369 CCCCNc1nnc(cc1Cl)Cl a410e5c3aad842660edf77bdebc0cf07 [0,2,0,0,0,0|2,0,0]=4 8108 B13R1.369 CCCCNc1nnc(cc1S)C 48ed69c4969c4b15b5aa10200ef9b94b [0,2,0,0,0,0|2,0,0]=4 8109 B13R1.369 CCCCOc1ccc(cc1Br)Br e3837c5ec356d16f4b0e8607989b5e20 [0,2,0,0,0,0|2,0,0]=4 8110 B13R1.369 CCCCOc1ccc(cc1Br)C ea9aa0e02159fafee7f43dbda18164a5 [0,2,0,0,0,0|2,0,0]=4 8111 B13R1.369 CCCCOc1ccc(cc1Br)Cl bbeabef49fcbe093bc15adb8bf69858a [0,2,0,0,0,0|2,0,0]=4 8112 B13R1.369 CCCCOc1ccc(cc1Br)F b6febbba00856cde4a8cca2ac1cd0387 [0,2,0,0,0,0|2,0,0]=4 8113 B13R1.369 CCCCOc1ccc(cc1Br)I 8150f12b6b60683484a7762041bbd5d1 [0,2,0,0,0,0|2,0,0]=4 8114 B13R1.369 CCCCOc1ccc(cc1C)Br 44ca8e9610404fd8af0ff7b146e45242 [0,2,0,0,0,0|2,0,0]=4 8115 B13R1.369 CCCCOc1ccc(cc1C)C ca4645a8056192de4f196bde0caea973 [0,2,0,0,0,0|2,0,0]=4 8116 B13R1.369 CCCCOc1ccc(cc1C)Cl d8369a6a32a6dc72d3869fcc8dbf81e0 [0,2,0,0,0,0|2,0,0]=4 8117 B13R1.369 CCCCOc1ccc(cc1C)F 392071ae77ae5a6d929567a27a084aaa [0,2,0,0,0,0|2,0,0]=4 8118 B13R1.369 CCCCOc1ccc(cc1C)I 55389e0b6466f524cbc4914130a2c9e2 [0,2,0,0,0,0|2,0,0]=4 8119 B13R1.369 CCCCOc1ccc(cc1C)S a2403c825e2288eec3cdd47259fde5fa [0,2,0,0,0,0|2,0,0]=4 8120 B13R1.369 CCCCOc1ccc(cc1Cl)Br 7dc384cc2c7d49aa4952d3c637a30aaa [0,2,0,0,0,0|2,0,0]=4 8121 B13R1.369 CCCCOc1ccc(cc1Cl)C 743ff8a8be5203404e22973c3a8f3ace [0,2,0,0,0,0|2,0,0]=4 8122 B13R1.369 CCCCOc1ccc(cc1Cl)Cl 1336c744ec10acbe3e96aeabcbdf6f38 [0,2,0,0,0,0|2,0,0]=4 8123 B13R1.369 CCCCOc1ccc(cc1Cl)F 9e5ab3ccf37915f636f22d9a8edee031 [0,2,0,0,0,0|2,0,0]=4 8124 B13R1.369 CCCCOc1ccc(cc1Cl)I d9ae44edbefa3c40877ce742255a77de [0,2,0,0,0,0|2,0,0]=4 8125 B13R1.369 CCCCOc1ccc(cc1F)Br 07ef1c6daca3da9dcc1af9eb36702855 [0,2,0,0,0,0|2,0,0]=4 8126 B13R1.369 CCCCOc1ccc(cc1F)C bf447da47246403a3c398c6746f3c368 [0,2,0,0,0,0|2,0,0]=4 8127 B13R1.369 CCCCOc1ccc(cc1F)Cl 969562fad84787a3542b24b4bdc4f9b6 [0,2,0,0,0,0|2,0,0]=4 8128 B13R1.369 CCCCOc1ccc(cc1F)F d46f31657590436b5c06f386763eb9ff [0,2,0,0,0,0|2,0,0]=4 8129 B13R1.369 CCCCOc1ccc(cc1F)I 3d9866404b3f06f0606fb5467380c6f5 [0,2,0,0,0,0|2,0,0]=4 8130 B13R1.369 CCCCOc1ccc(cc1I)Br cd54d6286644952e28929b8a2339d576 [0,2,0,0,0,0|2,0,0]=4 8131 B13R1.369 CCCCOc1ccc(cc1I)C aecef59c244fb2cee69921aa755c9b33 [0,2,0,0,0,0|2,0,0]=4 8132 B13R1.369 CCCCOc1ccc(cc1I)Cl 5039fb0396b70f8f0542d9508d1e7cdb [0,2,0,0,0,0|2,0,0]=4 8133 B13R1.369 CCCCOc1ccc(cc1I)F 29f4bcba4e17bf3eb2f123f718b9ea53 [0,2,0,0,0,0|2,0,0]=4 8134 B13R1.369 CCCCOc1ccc(cc1I)I 073556934886c77e6e5387dae420ff6a [0,2,0,0,0,0|2,0,0]=4 8135 B13R1.369 CCCCOc1ncc(cc1Br)Br 9e61d6bf1b8ed250b88be498d0cdc257 [0,2,0,0,0,0|1,0,0]=3 8136 B13R1.369 CCCCOc1ncc(cc1Br)C 75e815fce2bdad7e3d6c89aa7d0b94c0 [0,2,0,0,0,0|1,0,0]=3 8137 B13R1.369 CCCCOc1ncc(cc1Br)Cl f0162dc73cbb7fba2c963cbfadf6b31e [0,2,0,0,0,0|1,0,0]=3 8138 B13R1.369 CCCCOc1ncc(cc1Br)F 7d5c99973709ff42e753c08eb66892ac [0,2,0,0,0,0|1,0,0]=3 8139 B13R1.369 CCCCOc1ncc(cc1Br)I e7f86fb0c6df49cc5226f79897a04cdd [0,2,0,0,0,0|1,0,0]=3 8140 B13R1.369 CCCCOc1ncc(cc1C)Br 57f6c718ceb134ad618f2aadb90f79e3 [0,2,0,0,0,0|1,0,0]=3 8141 B13R1.369 CCCCOc1ncc(cc1C)Cl 678bf63773f5704a8dee9c6f964f742c [0,2,0,0,0,0|1,0,0]=3 8142 B13R1.369 CCCCOc1ncc(cc1C)F eedec580ad9253e32a076c76d94dfa7f [0,2,0,0,0,0|1,0,0]=3 8143 B13R1.369 CCCCOc1ncc(cc1C)I 71b9b5ab8146f08af8b0fe172c61576e [0,2,0,0,0,0|1,0,0]=3 8144 B13R1.369 CCCCOc1ncc(cc1Cl)Cl 8a4272d3189fd9c3ba5a1b781d8ae7ab [0,2,0,0,0,0|1,0,0]=3 8145 B13R1.369 CCCCOc1ncc(cc1Cl)F 976a0b489c89f8f3c6cc1cdb7bfa9463 [0,2,0,0,0,0|1,0,0]=3 8146 B13R1.369 CCCCOc1ncc(cc1Cl)I 44c73ab23b50bd1fa6b5374901e8f6d4 [0,2,0,0,0,0|1,0,0]=3 8147 B13R1.369 CCCCOc1ncc(cc1F)F 3d64d2ca39198e3b22e9a723b182d0f7 [0,2,0,0,0,0|1,0,0]=3 8148 B13R1.369 CCCCOc1ncc(cc1I)Br da1ecb078331bd20398a9ad70fef4921 [0,2,0,0,0,0|1,0,0]=3 8149 B13R1.369 CCCCOc1ncc(cc1I)C c56973d6d57a14a1d5cfb08c597991ae [0,2,0,0,0,0|1,0,0]=3 8150 B13R1.369 CCCCOc1ncc(cc1I)Cl 3ae6a5c809d9ab2e530ed648f70ce881 [0,2,0,0,0,0|1,0,0]=3 8151 B13R1.369 CCCCOc1ncc(cc1I)F 384b5fd09e3da8070c62a7bf6953b4e0 [0,2,0,0,0,0|1,0,0]=3 8152 B13R1.369 CCCCOc1ncc(cc1I)I 10c302502cdae0407ad5cafa638bcd37 [0,2,0,0,0,0|1,0,0]=3 8153 B13R1.369 CCCCOc1ncc(nc1Br)Br 2a747a695fe293dbe715ddd0053ad015 [0,2,0,0,0,0|2,0,0]=4 8154 B13R1.369 CCCCOc1ncc(nc1C)Br 77cd9a77cba22cf11b54cd998c7bac13 [0,2,0,0,0,0|2,0,0]=4 8155 B13R1.369 CCCCOc1ncc(nc1C)C fa6436c8f0950de0cbda6cc33f273831 [0,2,0,0,0,0|2,0,0]=4 8156 B13R1.369 CCCNCc1ccc(cc1Br)Cl cd61be783e7972c7ade8ed2dd2ade3f0 [0,2,0,0,0,0|2,0,0]=4 8157 B13R1.369 CCCNCc1ccc(cc1Br)F 314bee2e446bcca7c3660ea5f49217a2 [0,2,0,0,0,0|2,0,0]=4 8158 B13R1.369 CCCNCc1ccc(cc1C)Br dd3267698bfda334d04fecf62dacf24b [0,2,0,0,0,0|2,0,0]=4 8159 B13R1.369 CCCNCc1ccc(cc1C)C 0d91510f353f16c9783b4769f30664bf [0,2,0,0,0,0|2,0,0]=4 8160 B13R1.369 CCCNCc1ccc(cc1C)Cl 6766b31c92d559f09376252d9e93a1e8 [0,2,0,0,0,0|2,0,0]=4 8161 B13R1.369 CCCNCc1ccc(cc1C)F 0633c562dc9ca144557a3c37a9c6c68a [0,2,0,0,0,0|2,0,0]=4 8162 B13R1.369 CCCNCc1ccc(cc1Cl)Br 36c012d84351d694567c5f2c176560f9 [0,2,0,0,0,0|2,0,0]=4 8163 B13R1.369 CCCNCc1ccc(cc1Cl)C 96e3455ad943aba3d27b9bbd19b15c45 [0,2,0,0,0,0|2,0,0]=4 8164 B13R1.369 CCCNCc1ccc(cc1Cl)Cl 326457c47ef2a958de2ca8d811dd2cda [0,2,0,0,0,0|2,0,0]=4 8165 B13R1.369 CCCNCc1ccc(cc1Cl)F e7373c3bd4a0a589a652a12b7b2e5990 [0,2,0,0,0,0|2,0,0]=4 8166 B13R1.369 CCCNCc1ccc(cc1Cl)I b776b44690f2e5fb6fae73744d3e4a55 [0,2,0,0,0,0|2,0,0]=4 8167 B13R1.369 CCCNCc1ccc(cc1F)Br 7ebdca41b95409019675004945f33919 [0,2,0,0,0,0|2,0,0]=4 8168 B13R1.369 CCCNCc1ccc(cc1F)C 4bf9355f8a63b0060d409cc34714139b [0,2,0,0,0,0|2,0,0]=4 8169 B13R1.369 CCCNCc1ccc(cc1F)Cl e924e7ea8ebcbb08a4d99c579832c11b [0,2,0,0,0,0|2,0,0]=4 8170 B13R1.369 CCCNCc1ccc(cc1F)F 7c8e103f825901d10257931648f91764 [0,2,0,0,0,0|2,0,0]=4 8171 B13R1.369 CCCNCc1ccc(cc1F)I bb3163d02888315ba5469cfabe609fd9 [0,2,0,0,0,0|2,0,0]=4 8172 B13R1.369 CCCNCc1ccc(cc1I)Br 02762612ff017a052db100d4c83caa32 [0,2,0,0,0,0|2,0,0]=4 8173 B13R1.369 CCCNCc1ccc(cc1I)C b58cc0a20bfb9254d02ee856625e01e9 [0,2,0,0,0,0|2,0,0]=4 8174 B13R1.369 CCCNCc1ccc(cc1I)Cl fe01ba8a8516d3cd41eb2ed97752cfae [0,2,0,0,0,0|2,0,0]=4 8175 B13R1.369 CCCNCc1ccc(cc1I)F 461b9138e013d8a4fa942c190f0af603 [0,2,0,0,0,0|2,0,0]=4 8176 B13R1.369 CCCNCc1ncc(cc1C)Br 8b950500545b4066179e36d8ecd17685 [0,2,0,0,0,0|1,0,0]=3 8177 B13R1.369 CCCNCc1ncc(cc1Cl)C 3b9fde6f9dcf5538774026c13b957b5c [0,2,0,0,0,0|1,0,0]=3 8178 B13R1.369 CCCNCc1ncc(cc1Cl)Cl ea840b016f01f977e040f9c974621ba6 [0,2,0,0,0,0|1,0,0]=3 8179 B13R1.369 CCCNCc1ncc(cc1Cl)F 4c82565147163799fbe763eaba117a14 [0,2,0,0,0,0|1,0,0]=3 8180 B13R1.369 CCCNCc1ncc(cc1F)Br 7f465626bb351df30ef45470ef2a3ca9 [0,2,0,0,0,0|1,0,0]=3 8181 B13R1.369 CCCNCc1ncc(cc1F)C 86d0b2b26939633d999e7e0b0c6773a2 [0,2,0,0,0,0|1,0,0]=3 8182 B13R1.369 CCCNCc1ncc(cc1F)F a20cd94450524592e1e04c49edc3bdbf [0,2,0,0,0,0|1,0,0]=3 8183 B13R1.369 CCCNCc1ncc(nc1Cl)Cl abfd47144f6b709a2dba58415b4a25e8 [0,2,0,0,0,0|2,0,0]=4 8184 B13R1.369 CCCOCc1ccc(cc1Br)Br 5c7e872954877bb6349fab1d83b91c8d [0,2,0,0,0,0|2,0,0]=4 8185 B13R1.369 CCCOCc1ccc(cc1Br)Cl 385e1d9a715bad6eb36f2fdf69d1d4e5 [0,2,0,0,0,0|2,0,0]=4 8186 B13R1.369 CCCOCc1ccc(cc1Br)F df053a3bd2794bf527dbf95158078aa8 [0,2,0,0,0,0|2,0,0]=4 8187 B13R1.369 CCCOCc1ccc(cc1Br)I 03d35a2abe2afe9a973ad650de9b7e13 [0,2,0,0,0,0|2,0,0]=4 8188 B13R1.369 CCCOCc1ccc(cc1C)Br 6645e7935fddc709ad9c8b9ae75b7d44 [0,2,0,0,0,0|2,0,0]=4 8189 B13R1.369 CCCOCc1ccc(cc1C)C 9769a33223766afe539bad981eb77630 [0,2,0,0,0,0|2,0,0]=4 8190 B13R1.369 CCCOCc1ccc(cc1C)Cl 29fecfddae97408226a6b0e4bbff9c4a [0,2,0,0,0,0|2,0,0]=4 8191 B13R1.369 CCCOCc1ccc(cc1C)F 40a5e21152297f607d0a8a66b5754df4 [0,2,0,0,0,0|2,0,0]=4 8192 B13R1.369 CCCOCc1ccc(cc1C)I c52bc6968a53ce494d54ff3c232cb788 [0,2,0,0,0,0|2,0,0]=4 8193 B13R1.369 CCCOCc1ccc(cc1Cl)Br 882fbf1298abcaa7ca399256478b6afa [0,2,0,0,0,0|2,0,0]=4 8194 B13R1.369 CCCOCc1ccc(cc1Cl)C f65aa095930d86812f9bbf17481da9ee [0,2,0,0,0,0|2,0,0]=4 8195 B13R1.369 CCCOCc1ccc(cc1Cl)Cl 6781aa412c7cb2a3a1f853dbf5442dab [0,2,0,0,0,0|2,0,0]=4 8196 B13R1.369 CCCOCc1ccc(cc1Cl)F 5d171b9c4288e963e9b283e89655fe38 [0,2,0,0,0,0|2,0,0]=4 8197 B13R1.369 CCCOCc1ccc(cc1Cl)I 50a7110d97123d060515f52182a74e43 [0,2,0,0,0,0|2,0,0]=4 8198 B13R1.369 CCCOCc1ccc(cc1F)Br 1a7a66b9d0f7260be9ad70ef9cd9cebd [0,2,0,0,0,0|2,0,0]=4 8199 B13R1.369 CCCOCc1ccc(cc1F)C 5c15454e2ad2cd346938e9a482b05698 [0,2,0,0,0,0|2,0,0]=4 8200 B13R1.369 CCCOCc1ccc(cc1F)Cl 2f636c8aa8b8dcc115d701e3489e5065 [0,2,0,0,0,0|2,0,0]=4 8201 B13R1.369 CCCOCc1ccc(cc1F)F 4c831266fcc10b7011f3169f4828d315 [0,2,0,0,0,0|2,0,0]=4 8202 B13R1.369 CCCOCc1ccc(cc1F)I b1b64e38b5f91d104994384a0bc412c1 [0,2,0,0,0,0|2,0,0]=4 8203 B13R1.369 CCCOCc1ccc(cc1I)Br 2f4887d8d46e196cf2e5e3a116e32949 [0,2,0,0,0,0|2,0,0]=4 8204 B13R1.369 CCCOCc1ccc(cc1I)C 17ad086710afe92dfe740057b84bc617 [0,2,0,0,0,0|2,0,0]=4 8205 B13R1.369 CCCOCc1ccc(cc1I)Cl 4731d47ebaa45dc3bca3906d262a4f10 [0,2,0,0,0,0|2,0,0]=4 8206 B13R1.369 CCCOCc1ccc(cc1I)F f920f759d1510e8d71155a7eec4222e5 [0,2,0,0,0,0|2,0,0]=4 8207 B13R1.369 CCCOCc1ncc(cc1Br)Br 5e9092aba15c420cccc75130a11474e2 [0,2,0,0,0,0|1,0,0]=3 8208 B13R1.369 CCCOCc1ncc(cc1Br)Cl ace14c9f19147998a9bb5dab272ed9be [0,2,0,0,0,0|1,0,0]=3 8209 B13R1.369 CCCOCc1ncc(cc1Br)F 40bbaf5c1480d9b5100778ff8557e222 [0,2,0,0,0,0|1,0,0]=3 8210 B13R1.369 CCCOCc1ncc(cc1C)Br 1257dfe56027f1c5fafcdfd5ac70ba6c [0,2,0,0,0,0|1,0,0]=3 8211 B13R1.369 CCCOCc1ncc(cc1C)C d393352e8afd666ec3186c9ca6d539ad [0,2,0,0,0,0|1,0,0]=3 8212 B13R1.369 CCCOCc1ncc(cc1C)F 6249201d046364375de12944d97b2abd [0,2,0,0,0,0|1,0,0]=3 8213 B13R1.369 CCCOCc1ncc(cc1Cl)Br e349187fdea4574e2bd0d2e389a57659 [0,2,0,0,0,0|1,0,0]=3 8214 B13R1.369 CCCOCc1ncc(cc1Cl)C dead8642fda9b57bf0686651191b40af [0,2,0,0,0,0|1,0,0]=3 8215 B13R1.369 CCCOCc1ncc(cc1Cl)Cl 64b427511fa9c1d0225ad218c922a80c [0,2,0,0,0,0|1,0,0]=3 8216 B13R1.369 CCCOCc1ncc(cc1Cl)F 23ad3b65208797b0cdf5b7e1fa342e87 [0,2,0,0,0,0|1,0,0]=3 8217 B13R1.369 CCCOCc1ncc(cc1F)Br e90ca721c152cb09b16b045fba5b6c7a [0,2,0,0,0,0|1,0,0]=3 8218 B13R1.369 CCCOCc1ncc(cc1F)Cl fe5dd04532ea56a3d8e3457506c5788b [0,2,0,0,0,0|1,0,0]=3 8219 B13R1.369 CCCOCc1ncc(cc1F)F 3fa829de44744ccb9c9baab9fea3a37d [0,2,0,0,0,0|1,0,0]=3 8220 B13R1.369 CCNCCc1ccc(cc1C)C 9903a18bb1a78b3ecdc928b0d0b32e90 [0,2,0,0,0,0|2,0,0]=4 8221 B13R1.369 CCNCCc1ccc(cc1Cl)Cl 30bb131c79bd8291a4d3d83b4911d57b [0,2,0,0,0,0|2,0,0]=4 8222 B13R1.369 CCNCCc1ccc(cc1F)Cl 49d6ea2af100fe078fb7d6f3484d8cdf [0,2,0,0,0,0|2,0,0]=4 8223 B13R1.369 CCNCCc1ccc(cc1F)F 93dc0a601996c0a92c8528a450cae982 [0,2,0,0,0,0|2,0,0]=4 8224 B13R1.369 CCOCCc1ccc(cc1Br)Cl 0d264abb79643092f40d0b712868776f [0,2,0,0,0,0|2,0,0]=4 8225 B13R1.369 CCOCCc1ccc(cc1Br)F d162fe88af17976aba2db84cc15347e2 [0,2,0,0,0,0|2,0,0]=4 8226 B13R1.369 CCOCCc1ccc(cc1Cl)Br f5e4bba839a8ab1353abb5520ad9fdba [0,2,0,0,0,0|2,0,0]=4 8227 B13R1.369 CCOCCc1ccc(cc1Cl)Cl 1b4125d60efdcfaaa113b0eb1c88b0e8 [0,2,0,0,0,0|2,0,0]=4 8228 B13R1.369 CCOCCc1ccc(cc1Cl)F 44715ed095b9093d6a7cb3d5bd5c01cd [0,2,0,0,0,0|2,0,0]=4 8229 B13R1.369 CCOCCc1ccc(cc1F)Br 49f766c13a59e881d01a36f1e7d01c51 [0,2,0,0,0,0|2,0,0]=4 8230 B13R1.369 CCOCCc1ccc(cc1F)Cl 8e313399a0bd1c1f12cd04db282bf696 [0,2,0,0,0,0|2,0,0]=4 8231 B13R1.369 CCOCCc1ccc(cc1F)F c8a0e5a4d15d5bbd236be7cfce18a80d [0,2,0,0,0,0|2,0,0]=4 8232 B13R1.369 CCOCNc1ncc(cc1Br)F 6874da95e3fac1da37575c50da5f5c8e [0,2,0,0,0,0|2,0,0]=4 8233 B13R1.369 CCOCNc1ncc(cc1Br)I 4c05fd1c22d9bb34a48afd736e25b4dc [0,2,0,0,0,0|2,0,0]=4 8234 B13R1.369 CCOCNc1ncc(cc1C)Br 017782293a43cd4ce48c60ab99d7b41c [0,2,0,0,0,0|2,0,0]=4 8235 B13R1.369 CCOCNc1ncc(cc1C)C e12f27523e9bc192d42b57a4df5b80e6 [0,2,0,0,0,0|2,0,0]=4 8236 B13R1.369 CCOCNc1ncc(cc1C)Cl 1a17986934e8d05ee87535aad1aa17d9 [0,2,0,0,0,0|2,0,0]=4 8237 B13R1.369 CCOCNc1ncc(cc1C)F fa69b9ada8bde2c1441e74c9f5188f28 [0,2,0,0,0,0|2,0,0]=4 8238 B13R1.369 CCOCNc1ncc(cc1C)I b61d0fcabfb5f44d0083cc75c75d96ff [0,2,0,0,0,0|2,0,0]=4 8239 B13R1.369 CCOCNc1ncc(cc1Cl)F 9529fa1fc497a7dd1f3383cc57c905e2 [0,2,0,0,0,0|2,0,0]=4 8240 B13R1.369 CCOCNc1ncc(cc1F)Br d2bac327c28ce9ba07e643a7bd9bf61f [0,2,0,0,0,0|2,0,0]=4 8241 B13R1.369 CCOCNc1ncc(cc1F)C 190a40d0b0bd871a79cf8cb2b900ebdd [0,2,0,0,0,0|2,0,0]=4 8242 B13R1.369 CCOCNc1ncc(cc1F)Cl 44ea6864d9ea004fdf0803eea8615141 [0,2,0,0,0,0|2,0,0]=4 8243 B13R1.369 CCOCNc1ncc(cc1F)F 6859906c48667567d8fd0f5fbbb480a4 [0,2,0,0,0,0|2,0,0]=4 8244 B13R1.369 CCOCNc1ncc(cc1F)I d33268b6871b7f1227059e2be08c6134 [0,2,0,0,0,0|2,0,0]=4 8245 B13R1.369 CCOCNc1ncc(cc1I)Br 51251dbcf739bde566ec1b928f7cd4ea [0,2,0,0,0,0|2,0,0]=4 8246 B13R1.369 CCOCNc1ncc(cc1I)C 1c19295e4cbecd5c902c8d2ccc330af7 [0,2,0,0,0,0|2,0,0]=4 8247 B13R1.369 CCOCNc1ncc(cc1I)Cl 24a900a9f6b02b54f092691b574b7974 [0,2,0,0,0,0|2,0,0]=4 8248 B13R1.369 CCOCNc1ncc(cc1I)F 2a2414d13309bc948d1718f9be6e656c [0,2,0,0,0,0|2,0,0]=4 8249 B13R1.369 CCOCNc1ncc(cc1I)I e33c34df3f51e821d6fa680f9b905e79 [0,2,0,0,0,0|2,0,0]=4 8250 B13R1.369 CCOCOc1ncc(cc1Br)I a80595223c3de78bbb5914a7ecfa7f9b [0,2,0,0,0,0|2,0,0]=4 8251 B13R1.369 CCOCOc1ncc(cc1C)Cl ee9706da04a1f04e6f7e8bb0270c5a5a [0,2,0,0,0,0|2,0,0]=4 8252 B13R1.369 CCOCOc1ncc(cc1C)F dae6abefef3e32ef80a249fa8308093c [0,2,0,0,0,0|2,0,0]=4 8253 B13R1.369 CCOCOc1ncc(cc1Cl)F 2eb204373d04bedaac2dc72c7f6d6d5b [0,2,0,0,0,0|2,0,0]=4 8254 B13R1.369 CCOCOc1ncc(cc1I)Br 4a023c722e31a5bfb129bf9e706238bd [0,2,0,0,0,0|2,0,0]=4 8255 B13R1.369 CCOCOc1ncc(cc1I)C 0948a8aac419fd36c6ab44d65ca40e21 [0,2,0,0,0,0|2,0,0]=4 8256 B13R1.369 CCOCOc1ncc(cc1I)Cl 5158037cedf25e83f0d6adc483437fa7 [0,2,0,0,0,0|2,0,0]=4 8257 B13R1.369 CCOCOc1ncc(cc1I)F a3e2a4a25240b0c17a29ec12062e5892 [0,2,0,0,0,0|2,0,0]=4 8258 B13R1.369 CCOCOc1ncc(cc1I)I 542d8a00027850902cd1a767ce42cafe [0,2,0,0,0,0|2,0,0]=4 8259 B13R1.369 COCCNc1ncc(cc1Br)Br 572f63e1d7ba0f713bfa4e45ffc7af50 [0,2,0,0,0,0|2,0,0]=4 8260 B13R1.369 COCCNc1ncc(cc1Br)C c17a794f9bd9bdb1f49a35246be84716 [0,2,0,0,0,0|2,0,0]=4 8261 B13R1.369 COCCNc1ncc(cc1Br)Cl 15b865edb178bcfe8b28326e87c2dc95 [0,2,0,0,0,0|2,0,0]=4 8262 B13R1.369 COCCNc1ncc(cc1Br)F c26b5157552f71b0434805ddaa6b873f [0,2,0,0,0,0|2,0,0]=4 8263 B13R1.369 COCCNc1ncc(cc1Br)I 47e9a00aeb3b563c751902eef45db9e2 [0,2,0,0,0,0|2,0,0]=4 8264 B13R1.369 COCCNc1ncc(cc1C)Br 0fca56520e061df61f69e1bdd74f44b9 [0,2,0,0,0,0|2,0,0]=4 8265 B13R1.369 COCCNc1ncc(cc1C)C 3b6768fbd72400c15e83a1b566020d76 [0,2,0,0,0,0|2,0,0]=4 8266 B13R1.369 COCCNc1ncc(cc1C)Cl a8a3cad52f2e825de17063d996cafe23 [0,2,0,0,0,0|2,0,0]=4 8267 B13R1.369 COCCNc1ncc(cc1C)F 1367b13c55a6f20a5ea51516b1e8bcc6 [0,2,0,0,0,0|2,0,0]=4 8268 B13R1.369 COCCNc1ncc(cc1C)I dd010362c8f67c4a65e20fa62952a21c [0,2,0,0,0,0|2,0,0]=4 8269 B13R1.369 COCCNc1ncc(cc1C)O 4cac00e871b8fef672f0dc29ad2a839b [0,2,0,0,0,0|2,0,0]=4 8270 B13R1.369 COCCNc1ncc(cc1Cl)Br 359965895977f10e1162bdb820933183 [0,2,0,0,0,0|2,0,0]=4 8271 B13R1.369 COCCNc1ncc(cc1Cl)C 6353356d63cc4e9f343c3c07ed74f9ab [0,2,0,0,0,0|2,0,0]=4 8272 B13R1.369 COCCNc1ncc(cc1Cl)Cl 41008682d8655a685995c5f378791390 [0,2,0,0,0,0|2,0,0]=4 8273 B13R1.369 COCCNc1ncc(cc1Cl)F 6b22e44aaecc6e7c40f25665f35018f9 [0,2,0,0,0,0|2,0,0]=4 8274 B13R1.369 COCCNc1ncc(cc1Cl)I a2a8f708197760d91b4133af068d3cdc [0,2,0,0,0,0|2,0,0]=4 8275 B13R1.369 COCCNc1ncc(cc1F)Br 6044e4a696017795a97e9ca8e9ca532c [0,2,0,0,0,0|2,0,0]=4 8276 B13R1.369 COCCNc1ncc(cc1F)C 3dcdef002c8d9bd0de01ad0429c208be [0,2,0,0,0,0|2,0,0]=4 8277 B13R1.369 COCCNc1ncc(cc1F)Cl 623b06cb7d8209bdaa12c315e8190be5 [0,2,0,0,0,0|2,0,0]=4 8278 B13R1.369 COCCNc1ncc(cc1F)F 3bd6b9c92ca9f676a4abcb934f2c04b3 [0,2,0,0,0,0|2,0,0]=4 8279 B13R1.369 COCCNc1ncc(cc1F)I 59483e5196cb5348ca29ac5af940a856 [0,2,0,0,0,0|2,0,0]=4 8280 B13R1.369 COCCNc1ncc(cc1I)Br 78b00477c797c03c5f4ba29b9e137492 [0,2,0,0,0,0|2,0,0]=4 8281 B13R1.369 COCCNc1ncc(cc1I)C 47b992f68b739611e68d7d3b62e3ca07 [0,2,0,0,0,0|2,0,0]=4 8282 B13R1.369 COCCNc1ncc(cc1I)Cl b26fb5e71cc0a91387f60b1a70929d5e [0,2,0,0,0,0|2,0,0]=4 8283 B13R1.369 COCCNc1ncc(cc1I)F 93faabb1c1c4ed090c657b54a6351a0f [0,2,0,0,0,0|2,0,0]=4 8284 B13R1.369 COCCNc1ncc(cc1I)I d7dc928835d5143180a736456cf4d292 [0,2,0,0,0,0|2,0,0]=4 8285 B13R1.369 COCCNc1ncc(cc1N)N f054ecb755f18b0492cf7e509707364e [0,2,0,0,0,0|2,0,0]=4 8286 B13R1.369 COCCNc1ncc(cc1O)C 8df0c9adef1183d1083892e7840e02ee [0,2,0,0,0,0|2,0,0]=4 8287 B13R1.369 COCCOc1ncc(cc1Br)Br 83db4e39efec322a8c2880af8d5bab93 [0,2,0,0,0,0|2,0,0]=4 8288 B13R1.369 COCCOc1ncc(cc1Br)C d4e15ccc754a8856ab9f0db4324b9ada [0,2,0,0,0,0|2,0,0]=4 8289 B13R1.369 COCCOc1ncc(cc1Br)Cl f22397b215f11f97d72a512c2b1662fd [0,2,0,0,0,0|2,0,0]=4 8290 B13R1.369 COCCOc1ncc(cc1Br)F e452a1cd48bb5db6174db06c5be434e7 [0,2,0,0,0,0|2,0,0]=4 8291 B13R1.369 COCCOc1ncc(cc1Br)I 44e8d17e13bb529378c6df19e3250c46 [0,2,0,0,0,0|2,0,0]=4 8292 B13R1.369 COCCOc1ncc(cc1C)Br c8b469d269f699da226532f4e3d5dd41 [0,2,0,0,0,0|2,0,0]=4 8293 B13R1.369 COCCOc1ncc(cc1C)Cl 5c9013aa56afb61d7d20b1483def8ad2 [0,2,0,0,0,0|2,0,0]=4 8294 B13R1.369 COCCOc1ncc(cc1C)F 798574402684d40d43ae79002993ff52 [0,2,0,0,0,0|2,0,0]=4 8295 B13R1.369 COCCOc1ncc(cc1C)I 4c55f5f7f1bd6c3a509f7485148a8201 [0,2,0,0,0,0|2,0,0]=4 8296 B13R1.369 COCCOc1ncc(cc1Cl)Cl 58e8f5d4bd33677a7dea9b8baa4a8836 [0,2,0,0,0,0|2,0,0]=4 8297 B13R1.369 COCCOc1ncc(cc1Cl)F dbf56d5fe4e132d12ebd746db7b479e0 [0,2,0,0,0,0|2,0,0]=4 8298 B13R1.369 COCCOc1ncc(cc1Cl)I 857c0834498a0ae5fd8168299dc9ef3d [0,2,0,0,0,0|2,0,0]=4 8299 B13R1.369 COCCOc1ncc(cc1F)F fc5680d02fe0f2b0ed1ec4f59fc9b0a4 [0,2,0,0,0,0|2,0,0]=4 8300 B13R1.369 COCCOc1ncc(cc1I)Br e474f5faae53e8540c0d202ab19ea05f [0,2,0,0,0,0|2,0,0]=4 8301 B13R1.369 COCCOc1ncc(cc1I)C 6cf5b91b3e729da27b24c6f1c0806ea4 [0,2,0,0,0,0|2,0,0]=4 8302 B13R1.369 COCCOc1ncc(cc1I)Cl 865f69baed21a360b014a908b47fdfa9 [0,2,0,0,0,0|2,0,0]=4 8303 B13R1.369 COCCOc1ncc(cc1I)F 6b7f6ef674acffe34c03b95e1537c5e7 [0,2,0,0,0,0|2,0,0]=4 8304 B13R1.369 COCCOc1ncc(cc1I)I 49402801b4c61763a5d7688bccac133a [0,2,0,0,0,0|2,0,0]=4 8305 B13R1.369 COCNCc1ncc(cc1C)Br 6a1daa76fa6be1569313eb33a5eae2f3 [0,2,0,0,0,0|2,0,0]=4 8306 B13R1.369 COCNCc1ncc(cc1Cl)C c24f7efa67e550142f7379518264e4dd [0,2,0,0,0,0|2,0,0]=4 8307 B13R1.369 COCNCc1ncc(cc1Cl)Cl 8e47bc3a57b8691c9784ef136459a613 [0,2,0,0,0,0|2,0,0]=4 8308 B13R1.369 COCNCc1ncc(cc1Cl)F f50b4434352959110cae73c23fd3b609 [0,2,0,0,0,0|2,0,0]=4 8309 B13R1.369 COCNCc1ncc(cc1F)Br c1ca3207f138f8441702f95b4febae2b [0,2,0,0,0,0|2,0,0]=4 8310 B13R1.369 COCNCc1ncc(cc1F)C 158abbbb92f22c6915f8975aab5b9570 [0,2,0,0,0,0|2,0,0]=4 8311 B13R1.369 COCNCc1ncc(cc1F)F 082e4fce495c08101ad64be464ddbb86 [0,2,0,0,0,0|2,0,0]=4 8312 B13R1.369 COCOCc1ncc(cc1C)Br d4580479317fa8434d09ef3882d200a3 [0,2,0,0,0,0|2,0,0]=4 8313 B13R1.369 COCOCc1ncc(cc1C)C 56c492d54aa7d6be136a23895fd34824 [0,2,0,0,0,0|2,0,0]=4 8314 B13R1.369 COCOCc1ncc(cc1C)F e113a9a307e7fa0ac8e9891b35d50c91 [0,2,0,0,0,0|2,0,0]=4 8315 B13R1.369 COCOCc1ncc(cc1Cl)Br 2b796f4d7687667b0d6eee4f898cfb34 [0,2,0,0,0,0|2,0,0]=4 8316 B13R1.369 COCOCc1ncc(cc1Cl)C aa0edbb365142a0ac610b59e3b55a0c4 [0,2,0,0,0,0|2,0,0]=4 8317 B13R1.369 COCOCc1ncc(cc1Cl)Cl 98f7a0c18e5981261d3c2fbfefe2d09e [0,2,0,0,0,0|2,0,0]=4 8318 B13R1.369 COCOCc1ncc(cc1Cl)F 62934e642a1f8a0e95a5ad28af3f241e [0,2,0,0,0,0|2,0,0]=4 8319 B13R1.369 COCOCc1ncc(cc1F)Br a0a6f33bd50ded17d714b752212d6db6 [0,2,0,0,0,0|2,0,0]=4 8320 B13R1.369 COCOCc1ncc(cc1F)Cl a4fd3307a33dc4e344b2b81c7931e2f5 [0,2,0,0,0,0|2,0,0]=4 8321 B13R1.369 COCOCc1ncc(cc1F)F 15df06d53c8455a1bc54a96c5376e01e [0,2,0,0,0,0|2,0,0]=4 8322 B13R1.369 CSCCNc1ncc(cc1Br)Br 559fcc63432d3d8479c46646f5c23326 [0,2,0,0,0,0|2,0,0]=4 8323 B13R1.369 CSCCNc1ncc(cc1Br)C ec5bbf1381d4af2210c00449d3405b0d [0,2,0,0,0,0|2,0,0]=4 8324 B13R1.369 CSCCNc1ncc(cc1Br)Cl 54ccbd99245da270e0d5c3008d31b11f [0,2,0,0,0,0|2,0,0]=4 8325 B13R1.369 CSCCNc1ncc(cc1Br)F 704bf2c33aab5f8e9241358d5ca55377 [0,2,0,0,0,0|2,0,0]=4 8326 B13R1.369 CSCCNc1ncc(cc1Br)I 6c48899781cc61ebb3962f47e4672a91 [0,2,0,0,0,0|2,0,0]=4 8327 B13R1.369 CSCCNc1ncc(cc1C)Br e5db732debec63fbae5d1de8b006a346 [0,2,0,0,0,0|2,0,0]=4 8328 B13R1.369 CSCCNc1ncc(cc1C)C 62457f82eb3e040c080c0631bf37c562 [0,2,0,0,0,0|2,0,0]=4 8329 B13R1.369 CSCCNc1ncc(cc1C)Cl 96249612f87ec67b244e747cb7df9b97 [0,2,0,0,0,0|2,0,0]=4 8330 B13R1.369 CSCCNc1ncc(cc1C)F fb496c47e446a17b3c5575f915a1e177 [0,2,0,0,0,0|2,0,0]=4 8331 B13R1.369 CSCCNc1ncc(cc1C)I 8bbd570dc3087f743e12c8343dbcc0dd [0,2,0,0,0,0|2,0,0]=4 8332 B13R1.369 CSCCNc1ncc(cc1Cl)Br a92556182ca873ae125c5477900249b5 [0,2,0,0,0,0|2,0,0]=4 8333 B13R1.369 CSCCNc1ncc(cc1Cl)C 34a8202e93f64cdd51e6269eb9ca99b5 [0,2,0,0,0,0|2,0,0]=4 8334 B13R1.369 CSCCNc1ncc(cc1Cl)Cl 360f9917374c882a430b13aa8b48a058 [0,2,0,0,0,0|2,0,0]=4 8335 B13R1.369 CSCCNc1ncc(cc1Cl)F dabf68f9684da07eeb4225c91bf54e4a [0,2,0,0,0,0|2,0,0]=4 8336 B13R1.369 CSCCNc1ncc(cc1Cl)I 16943a8cce82dec5d25d6be80058236b [0,2,0,0,0,0|2,0,0]=4 8337 B13R1.369 CSCCNc1ncc(cc1F)Br 72d2e1007ba5074d4907d6f072126116 [0,2,0,0,0,0|2,0,0]=4 8338 B13R1.369 CSCCNc1ncc(cc1F)C 3ecc5bef97a9c9d8bdb4aa8596ffba76 [0,2,0,0,0,0|2,0,0]=4 8339 B13R1.369 CSCCNc1ncc(cc1F)Cl b5d473debb245a6530070544c652bcfd [0,2,0,0,0,0|2,0,0]=4 8340 B13R1.369 CSCCNc1ncc(cc1F)F a0b302e41c0a634616d863baf992d497 [0,2,0,0,0,0|2,0,0]=4 8341 B13R1.369 CSCCNc1ncc(cc1F)I 2927ae20046d16b3263086f8d13848f9 [0,2,0,0,0,0|2,0,0]=4 8342 B13R1.369 CSCCNc1ncc(cc1I)Br fb8ab5027de15664eb952e37d35da740 [0,2,0,0,0,0|2,0,0]=4 8343 B13R1.369 CSCCNc1ncc(cc1I)C d93afdf5effc5268f1e851defb1e7ff1 [0,2,0,0,0,0|2,0,0]=4 8344 B13R1.369 CSCCNc1ncc(cc1I)Cl 47c9f8740446a7fed4452583700fa920 [0,2,0,0,0,0|2,0,0]=4 8345 B13R1.369 CSCCNc1ncc(cc1I)F 6b2aaca46f319c227293a0c0bafd08a0 [0,2,0,0,0,0|2,0,0]=4 8346 B13R1.369 CSCCNc1ncc(cc1I)I 31523db182176263cdb74512ef30170e [0,2,0,0,0,0|2,0,0]=4 8347 B13R1.369 CSCCNc1ncc(cc1N)N 524f6777820290ab4c33c2a62b08202b [0,2,0,0,0,0|2,0,0]=4 8348 B13R1.369 CSCCOc1ncc(cc1Br)Br 6d53c0c43778659158df774e001c6049 [0,2,0,0,0,0|2,0,0]=4 8349 B13R1.369 CSCCOc1ncc(cc1Br)C a546f0465596fcec71d15c1c45b5db92 [0,2,0,0,0,0|2,0,0]=4 8350 B13R1.369 CSCCOc1ncc(cc1Br)Cl c457eec8c56f989fa21feaf7e489473f [0,2,0,0,0,0|2,0,0]=4 8351 B13R1.369 CSCCOc1ncc(cc1Br)F 0438981e82caf7073cc545595bfd434d [0,2,0,0,0,0|2,0,0]=4 8352 B13R1.369 CSCCOc1ncc(cc1Br)I 7516d0466c2e241900bbe7ef8ac53e9b [0,2,0,0,0,0|2,0,0]=4 8353 B13R1.369 CSCCOc1ncc(cc1C)Br 6f1b376d58dff1c0d8aca1928a07c33e [0,2,0,0,0,0|2,0,0]=4 8354 B13R1.369 CSCCOc1ncc(cc1C)Cl 2472ced2a54052ae16f9a22413f0989e [0,2,0,0,0,0|2,0,0]=4 8355 B13R1.369 CSCCOc1ncc(cc1C)F 1b38af1b13dfbfa41f6fdc3d2f504ae4 [0,2,0,0,0,0|2,0,0]=4 8356 B13R1.369 CSCCOc1ncc(cc1C)I bff83c7259f20d1c12cde5cf6e7b347c [0,2,0,0,0,0|2,0,0]=4 8357 B13R1.369 CSCCOc1ncc(cc1Cl)Cl 50da225667644b9d66aa07bc8991e4a9 [0,2,0,0,0,0|2,0,0]=4 8358 B13R1.369 CSCCOc1ncc(cc1Cl)F 3eafb4784de3de18d2e1d500c10496d6 [0,2,0,0,0,0|2,0,0]=4 8359 B13R1.369 CSCCOc1ncc(cc1Cl)I 531cf2e2722f2ae5b02984975f77bb0f [0,2,0,0,0,0|2,0,0]=4 8360 B13R1.369 CSCCOc1ncc(cc1F)F 859ad25248decb608ef60941a1b95570 [0,2,0,0,0,0|2,0,0]=4 8361 B13R1.369 CSCCOc1ncc(cc1I)Br 6692c00181448beef6788e111d0edcfe [0,2,0,0,0,0|2,0,0]=4 8362 B13R1.369 CSCCOc1ncc(cc1I)C 8ee9f7e117effa0fa37c41bf038eeab7 [0,2,0,0,0,0|2,0,0]=4 8363 B13R1.369 CSCCOc1ncc(cc1I)Cl 9ed9e7f250278a54d25f18953be1a4fc [0,2,0,0,0,0|2,0,0]=4 8364 B13R1.369 CSCCOc1ncc(cc1I)F 586347a30b2b9e65d08f8f25ac669b82 [0,2,0,0,0,0|2,0,0]=4 8365 B13R1.369 CSCCOc1ncc(cc1I)I bffb0355f15bcdaf6c80bc6432cd988b [0,2,0,0,0,0|2,0,0]=4 8366 B13R1.369 CSCNCc1ncc(cc1C)Br d4142b79761095cad969f5a75ebd9716 [0,2,0,0,0,0|2,0,0]=4 8367 B13R1.369 CSCNCc1ncc(cc1Cl)C 1ca87f2b739ab9528af1ba8bbbac1e04 [0,2,0,0,0,0|2,0,0]=4 8368 B13R1.369 CSCNCc1ncc(cc1Cl)Cl ba9042aea426daf1bb6896bb1caf702b [0,2,0,0,0,0|2,0,0]=4 8369 B13R1.369 CSCNCc1ncc(cc1Cl)F bee912d16cab4ce75f5c0ac69bfe524a [0,2,0,0,0,0|2,0,0]=4 8370 B13R1.369 CSCNCc1ncc(cc1F)Br 9aa9fef2987d56e1704acd240f3c0b34 [0,2,0,0,0,0|2,0,0]=4 8371 B13R1.369 CSCNCc1ncc(cc1F)C 2633513b6583feddcfc601f5c4516906 [0,2,0,0,0,0|2,0,0]=4 8372 B13R1.369 CSCNCc1ncc(cc1F)F 7286d091c803bf8417655c5c00ae863d [0,2,0,0,0,0|2,0,0]=4 8373 B13R1.369 CSCOCc1ncc(cc1Br)F 7ac3bffb991749be14aaa01f5b7e6aaf [0,2,0,0,0,0|2,0,0]=4 8374 B13R1.369 CSCOCc1ncc(cc1C)Br ec1db7219cddead4ba387bee6736fe8b [0,2,0,0,0,0|2,0,0]=4 8375 B13R1.369 CSCOCc1ncc(cc1C)C 1088884178ed299bc41448766d85e729 [0,2,0,0,0,0|2,0,0]=4 8376 B13R1.369 CSCOCc1ncc(cc1C)F c86177aea75aabfb910abe63bcf33c32 [0,2,0,0,0,0|2,0,0]=4 8377 B13R1.369 CSCOCc1ncc(cc1Cl)Br 61ca3c2015ec21b48c9fa5b4eead883d [0,2,0,0,0,0|2,0,0]=4 8378 B13R1.369 CSCOCc1ncc(cc1Cl)C 5cff704f7c4def6dbfcbe54206858646 [0,2,0,0,0,0|2,0,0]=4 8379 B13R1.369 CSCOCc1ncc(cc1Cl)Cl a8aed8706aa70a15f6a688caa8b683ab [0,2,0,0,0,0|2,0,0]=4 8380 B13R1.369 CSCOCc1ncc(cc1Cl)F 71fc93d5c8a790d27e61021b347c54c0 [0,2,0,0,0,0|2,0,0]=4 8381 B13R1.369 CSCOCc1ncc(cc1F)Br 376fd3cfbdcdfb164f52f93d6d1419c9 [0,2,0,0,0,0|2,0,0]=4 8382 B13R1.369 CSCOCc1ncc(cc1F)Cl 49d0a1a04b05255f2a48c013f1096c19 [0,2,0,0,0,0|2,0,0]=4 8383 B13R1.369 CSCOCc1ncc(cc1F)F 5635210451892606cade4e8d3760e2a9 [0,2,0,0,0,0|2,0,0]=4 8384 B13R1.369 Cc1cc(cnc1CNCCF)Br 77de38fa075426f507b5fedc6a9f77ca [0,2,0,0,0,0|2,0,0]=4 8385 B13R1.369 Cc1cc(cnc1CNCCO)Br fd2a49ef743f124ebbeb2ea82c0b8a95 [0,2,0,0,0,0|2,0,0]=4 8386 B13R1.369 Cc1cc(cnc1CNCCS)Br 931a1247a5e775bdd97ab4a045b0e0ae [0,2,0,0,0,0|2,0,0]=4 8387 B13R1.369 Cc1cc(cnc1COCCF)Br 5f8235ee25e06062ba0bc71265b00d5f [0,2,0,0,0,0|2,0,0]=4 8388 B13R1.369 Cc1cc(cnc1COCCF)F 74693f27ba382e779ff17b22f99e9fd4 [0,2,0,0,0,0|2,0,0]=4 8389 B13R1.369 Cc1cc(cnc1COCCS)Br 1abdc0495388d6619bd68cbdef6fef65 [0,2,0,0,0,0|2,0,0]=4 8390 B13R1.369 Cc1cc(cnc1COCCS)F 7e5fee04ea00bdb446622667bc85726e [0,2,0,0,0,0|2,0,0]=4 8391 B13R1.369 Cc1cc(cnc1NCCCF)Br 52c9727e9efead910f63f901b3470f1b [0,2,0,0,0,0|2,0,0]=4 8392 B13R1.369 Cc1cc(cnc1NCCCF)Cl b6627f528e831b2a468ac1654c740369 [0,2,0,0,0,0|2,0,0]=4 8393 B13R1.369 Cc1cc(cnc1NCCCF)F b052b94872bcc87dddab12777bc2d929 [0,2,0,0,0,0|2,0,0]=4 8394 B13R1.369 Cc1cc(cnc1NCCCF)I 79dab52ca4f6c7f4329d6cb3ba133044 [0,2,0,0,0,0|2,0,0]=4 8395 B13R1.369 Cc1cc(cnc1NCCCO)Br 8f35693cbe0c88178f6e4a784b003101 [0,2,0,0,0,0|2,0,0]=4 8396 B13R1.369 Cc1cc(cnc1NCCCO)Cl 6a50e44908cc54ed404e549fa63c1c65 [0,2,0,0,0,0|2,0,0]=4 8397 B13R1.369 Cc1cc(cnc1NCCCO)F d2ed0fad506f0dedd58c60fb052e8ccb [0,2,0,0,0,0|2,0,0]=4 8398 B13R1.369 Cc1cc(cnc1NCCCO)I c6c6bc60cbcd2295d0511af6d1cc38f6 [0,2,0,0,0,0|2,0,0]=4 8399 B13R1.369 Cc1cc(cnc1NCCCS)Br 7135161f51622ff7d558179c5aa5314e [0,2,0,0,0,0|2,0,0]=4 8400 B13R1.369 Cc1cc(cnc1NCCCS)Cl b4b40312226db692ab67c29217ef4800 [0,2,0,0,0,0|2,0,0]=4 8401 B13R1.369 Cc1cc(cnc1NCCCS)F 5714e0196a54be48833faf828da1ced4 [0,2,0,0,0,0|2,0,0]=4 8402 B13R1.369 Cc1cc(cnc1NCCCS)I def80af01c1a2ac5d0ac522de404baa2 [0,2,0,0,0,0|2,0,0]=4 8403 B13R1.369 Cc1cc(cnc1OCCCF)Br 624a043e32a2e8634142ccc335ef8adf [0,2,0,0,0,0|2,0,0]=4 8404 B13R1.369 Cc1cc(cnc1OCCCF)Cl 3af6050c3923b07acb4605e17982f0bf [0,2,0,0,0,0|2,0,0]=4 8405 B13R1.369 Cc1cc(cnc1OCCCF)F be2b1c87c5808c6b09a2670fcec1684e [0,2,0,0,0,0|2,0,0]=4 8406 B13R1.369 Cc1cc(cnc1OCCCF)I a010bb7d81de2d15120d3485527acfb2 [0,2,0,0,0,0|2,0,0]=4 8407 B13R1.369 Cc1cc(cnc1OCCCS)Br 99a12e97e6ad11cf03f2f296028e30a3 [0,2,0,0,0,0|2,0,0]=4 8408 B13R1.369 Cc1cc(cnc1OCCCS)Cl bc00fdc78f21000e5d1accf2fd445037 [0,2,0,0,0,0|2,0,0]=4 8409 B13R1.369 Cc1cc(cnc1OCCCS)F bb485fccaeb3a35110760e0bd51531f6 [0,2,0,0,0,0|2,0,0]=4 8410 B13R1.369 Cc1cc(cnc1OCCCS)I d6863996e428fc3b64abe4ccab2acedd [0,2,0,0,0,0|2,0,0]=4 8411 B13R1.369 Cc1cnc(c(c1)Br)COCCF a14e574cdb74f18ab97b29a69c014edd [0,2,0,0,0,0|2,0,0]=4 8412 B13R1.369 Cc1cnc(c(c1)Br)COCCS c93adc0284f209d178de6b3853553c49 [0,2,0,0,0,0|2,0,0]=4 8413 B13R1.369 Cc1cnc(c(c1)Br)NCCCF 45027e19085872f9eef598af0cfb5dae [0,2,0,0,0,0|2,0,0]=4 8414 B13R1.369 Cc1cnc(c(c1)Br)NCCCO ba574e9906f7ec2e94ac6e3836f81eee [0,2,0,0,0,0|2,0,0]=4 8415 B13R1.369 Cc1cnc(c(c1)Br)NCCCS 88480d31a83821aba2b78417ce4a98f6 [0,2,0,0,0,0|2,0,0]=4 8416 B13R1.369 Cc1cnc(c(c1)Br)OCCCF fbfc8d6cd2a32ae2aa6855f1516d4bff [0,2,0,0,0,0|2,0,0]=4 8417 B13R1.369 Cc1cnc(c(c1)Br)OCCCS 649fdd06ee925e8620cdba9f0072f5f6 [0,2,0,0,0,0|2,0,0]=4 8418 B13R1.369 Cc1cnc(c(c1)C)COCCF 566c9926e7163e49dee9224217f2f75f [0,2,0,0,0,0|2,0,0]=4 8419 B13R1.369 Cc1cnc(c(c1)C)COCCS e26196d5ffb650251681baaad39591f4 [0,2,0,0,0,0|2,0,0]=4 8420 B13R1.369 Cc1cnc(c(c1)C)NCCCF 211879ac4de8ccb0827c2d827fefe045 [0,2,0,0,0,0|2,0,0]=4 8421 B13R1.369 Cc1cnc(c(c1)C)NCCCO ca780d657d480ece805175f4057bb075 [0,2,0,0,0,0|2,0,0]=4 8422 B13R1.369 Cc1cnc(c(c1)C)NCCCS 93a540c9060f33312e520d6705769ebc [0,2,0,0,0,0|2,0,0]=4 8423 B13R1.369 Cc1cnc(c(c1)Cl)CNCCF 4b9edf8b587efe3c37ea1181b913b280 [0,2,0,0,0,0|2,0,0]=4 8424 B13R1.369 Cc1cnc(c(c1)Cl)CNCCO fdd5742dac711b49b6ab2cd814581320 [0,2,0,0,0,0|2,0,0]=4 8425 B13R1.369 Cc1cnc(c(c1)Cl)CNCCS f75180f86288a653af06b41ff2d25f70 [0,2,0,0,0,0|2,0,0]=4 8426 B13R1.369 Cc1cnc(c(c1)Cl)COCCF fb67538054bb0a2f63596a310c966645 [0,2,0,0,0,0|2,0,0]=4 8427 B13R1.369 Cc1cnc(c(c1)Cl)COCCS b5a69715acf5c37f4d03c7c9144aacb7 [0,2,0,0,0,0|2,0,0]=4 8428 B13R1.369 Cc1cnc(c(c1)Cl)NCCCF f1de151cfd44ea7ed9a2c8a7a16761e4 [0,2,0,0,0,0|2,0,0]=4 8429 B13R1.369 Cc1cnc(c(c1)Cl)NCCCO 96a5ec871136bb71a74d2e56e3cd49c0 [0,2,0,0,0,0|2,0,0]=4 8430 B13R1.369 Cc1cnc(c(c1)Cl)NCCCS 4505fbff0663de7bf830efa6ce55496f [0,2,0,0,0,0|2,0,0]=4 8431 B13R1.369 Cc1cnc(c(c1)F)CNCCF e270c2753f20b73726c74298aac78a10 [0,2,0,0,0,0|2,0,0]=4 8432 B13R1.369 Cc1cnc(c(c1)F)CNCCO 058ebd938097c4c0ce3fd83bbb3aaa53 [0,2,0,0,0,0|2,0,0]=4 8433 B13R1.369 Cc1cnc(c(c1)F)CNCCS a12d680c78280d98ee6b747ca815bdce [0,2,0,0,0,0|2,0,0]=4 8434 B13R1.369 Cc1cnc(c(c1)F)NCCCF 932f72d6334765088684bf16f116f7b5 [0,2,0,0,0,0|2,0,0]=4 8435 B13R1.369 Cc1cnc(c(c1)F)NCCCO f013612a9ae96171842e65b50d7e02d5 [0,2,0,0,0,0|2,0,0]=4 8436 B13R1.369 Cc1cnc(c(c1)F)NCCCS aded0a5bd32689df705e8d937a2b864a [0,2,0,0,0,0|2,0,0]=4 8437 B13R1.369 Cc1cnc(c(c1)I)NCCCF 08c534f078d21bf2494267f5ca899b9f [0,2,0,0,0,0|2,0,0]=4 8438 B13R1.369 Cc1cnc(c(c1)I)NCCCO 7a0d824cf1d3b4606bc160f1260ca95b [0,2,0,0,0,0|2,0,0]=4 8439 B13R1.369 Cc1cnc(c(c1)I)NCCCS 9a70cf548a27e5f47cb1ff699b0eb226 [0,2,0,0,0,0|2,0,0]=4 8440 B13R1.369 Cc1cnc(c(c1)I)OCCCF 8289a15a9fd5fb01f14211502bea4e6a [0,2,0,0,0,0|2,0,0]=4 8441 B13R1.369 Cc1cnc(c(c1)I)OCCCS afafd11e0b3013f77d2536a97aa96748 [0,2,0,0,0,0|2,0,0]=4 8442 B13R1.369 Clc1cnc(c(c1)Cl)CNCCBr b3ec345987e7e80aaa955d341719f5d8 [0,2,0,0,0,0|2,0,0]=4 8443 B13R1.369 Clc1cnc(c(c1)Cl)CNCCI d4a6894a1aafdd36c6f13990147058ca [0,2,0,0,0,0|2,0,0]=4 8444 B13R1.369 FCCCNc1ncc(cc1Br)Br 0bb8cd81762ffe766fe24016cfd87e47 [0,2,0,0,0,0|2,0,0]=4 8445 B13R1.369 FCCCNc1ncc(cc1Br)Cl ad75ff21faff622fc1f2bf23de916368 [0,2,0,0,0,0|2,0,0]=4 8446 B13R1.369 FCCCNc1ncc(cc1Br)F 14bb4b57e5c85f52914c837fa6384de7 [0,2,0,0,0,0|2,0,0]=4 8447 B13R1.369 FCCCNc1ncc(cc1Br)I 58c51c91c2a21211a13fd5fc1d77a87b [0,2,0,0,0,0|2,0,0]=4 8448 B13R1.369 FCCCNc1ncc(cc1Cl)Br dd2525e5975d4429347ac1302882894a [0,2,0,0,0,0|2,0,0]=4 8449 B13R1.369 FCCCNc1ncc(cc1Cl)Cl b8a2fd90726176d3a09550318d63b65d [0,2,0,0,0,0|2,0,0]=4 8450 B13R1.369 FCCCNc1ncc(cc1Cl)F e430bee4f8dd72a6a09af0ed3702ef98 [0,2,0,0,0,0|2,0,0]=4 8451 B13R1.369 FCCCNc1ncc(cc1Cl)I 688ae6d8eb3a39f2b7d3e5936160f058 [0,2,0,0,0,0|2,0,0]=4 8452 B13R1.369 FCCCNc1ncc(cc1F)Br f05779195447f7149ba9e641344f0a3d [0,2,0,0,0,0|2,0,0]=4 8453 B13R1.369 FCCCNc1ncc(cc1F)Cl 4a41d36fe799aee9e377a841cdc713ff [0,2,0,0,0,0|2,0,0]=4 8454 B13R1.369 FCCCNc1ncc(cc1F)F b9299e6460f802901cc6bb262f47d448 [0,2,0,0,0,0|2,0,0]=4 8455 B13R1.369 FCCCNc1ncc(cc1F)I 7633e8708257ea91252ae6a6ac9a0ed5 [0,2,0,0,0,0|2,0,0]=4 8456 B13R1.369 FCCCNc1ncc(cc1I)Br d11f7c401c12247fee6da34d0f5d5fec [0,2,0,0,0,0|2,0,0]=4 8457 B13R1.369 FCCCNc1ncc(cc1I)Cl 5b97758f11b3f3273b7c49e23f34e849 [0,2,0,0,0,0|2,0,0]=4 8458 B13R1.369 FCCCNc1ncc(cc1I)F 912f48227cd27957fdf4cb57fdc2b8c4 [0,2,0,0,0,0|2,0,0]=4 8459 B13R1.369 FCCCNc1ncc(cc1I)I 484673df5c1621db38317e3c92147965 [0,2,0,0,0,0|2,0,0]=4 8460 B13R1.369 FCCCOc1ncc(cc1Br)Br 71f54e9d2ea66fecd556f02ee6d1ece1 [0,2,0,0,0,0|2,0,0]=4 8461 B13R1.369 FCCCOc1ncc(cc1Br)Cl 1e89b0a46d7195688e6651d3adf2f1f7 [0,2,0,0,0,0|2,0,0]=4 8462 B13R1.369 FCCCOc1ncc(cc1Br)F 82f68db071c4ca7eda2f55a0823f5f9c [0,2,0,0,0,0|2,0,0]=4 8463 B13R1.369 FCCCOc1ncc(cc1Br)I 4f7d714feffa7b9a4c4e7a1165e4901d [0,2,0,0,0,0|2,0,0]=4 8464 B13R1.369 FCCCOc1ncc(cc1Cl)Cl e4fab363f079b636a29c25a1da92ddf3 [0,2,0,0,0,0|2,0,0]=4 8465 B13R1.369 FCCCOc1ncc(cc1Cl)F f355a71a2e4ac04f8b72974017ff872e [0,2,0,0,0,0|2,0,0]=4 8466 B13R1.369 FCCCOc1ncc(cc1Cl)I 516a3bb4583eeaf6c7e5b2476da23c99 [0,2,0,0,0,0|2,0,0]=4 8467 B13R1.369 FCCCOc1ncc(cc1F)F 5b2cb44b6091d8347103d427283524f1 [0,2,0,0,0,0|2,0,0]=4 8468 B13R1.369 FCCCOc1ncc(cc1I)Br 27cfe3edcc832ed2cc88ea704b00c8dc [0,2,0,0,0,0|2,0,0]=4 8469 B13R1.369 FCCCOc1ncc(cc1I)Cl 5df29d488824a9b884140f4d7856085e [0,2,0,0,0,0|2,0,0]=4 8470 B13R1.369 FCCCOc1ncc(cc1I)F 750ba85d47469fdbe4e424c349eb5d2e [0,2,0,0,0,0|2,0,0]=4 8471 B13R1.369 FCCCOc1ncc(cc1I)I 7211f6df98df7ad18dce0fb0365aab9b [0,2,0,0,0,0|2,0,0]=4 8472 B13R1.369 FCCNCc1ncc(cc1Cl)Cl c144b73429b63690603a9f7c5a94de24 [0,2,0,0,0,0|2,0,0]=4 8473 B13R1.369 FCCNCc1ncc(cc1Cl)F 962ac9e556c3cef355fd78d3949910ed [0,2,0,0,0,0|2,0,0]=4 8474 B13R1.369 FCCNCc1ncc(cc1F)Br 13f211c1494a759da79901eafc35168f [0,2,0,0,0,0|2,0,0]=4 8475 B13R1.369 FCCNCc1ncc(cc1F)F f682ba080dc01b58b9c250a8f534504f [0,2,0,0,0,0|2,0,0]=4 8476 B13R1.369 FCCOCc1ncc(cc1Br)Br 80cda037cacfb3383dc347cc391aec6b [0,2,0,0,0,0|2,0,0]=4 8477 B13R1.369 FCCOCc1ncc(cc1Br)Cl 85a769ce48718f4537d1ff4e23049345 [0,2,0,0,0,0|2,0,0]=4 8478 B13R1.369 FCCOCc1ncc(cc1Br)F 87ab95195023692061f6a5db5e43c2c5 [0,2,0,0,0,0|2,0,0]=4 8479 B13R1.369 FCCOCc1ncc(cc1Cl)Br 26329e79e339c9b2484f26c6fee4ece0 [0,2,0,0,0,0|2,0,0]=4 8480 B13R1.369 FCCOCc1ncc(cc1Cl)Cl 1697b220f4cde2c2e2233ddd20d99359 [0,2,0,0,0,0|2,0,0]=4 8481 B13R1.369 FCCOCc1ncc(cc1Cl)F aad1dbcb3a72841753ed48b7127c2fe1 [0,2,0,0,0,0|2,0,0]=4 8482 B13R1.369 FCCOCc1ncc(cc1F)Br 5e4199c4047318fb7f870d907485fe05 [0,2,0,0,0,0|2,0,0]=4 8483 B13R1.369 FCCOCc1ncc(cc1F)Cl 02d067012e6bc9d599d16e55d35cf187 [0,2,0,0,0,0|2,0,0]=4 8484 B13R1.369 FCCOCc1ncc(cc1F)F 5c1248a6cdaa2939efed6c5265a6b7d3 [0,2,0,0,0,0|2,0,0]=4 8485 B13R1.369 Fc1cc(cnc1CNCCS)Br c8301bca0f421b7b0941ba557ea9f3f1 [0,2,0,0,0,0|2,0,0]=4 8486 B13R1.369 Fc1cc(cnc1COCCS)Br 3989603419248331d2af1207c3a6481d [0,2,0,0,0,0|2,0,0]=4 8487 B13R1.369 Fc1cc(cnc1COCCS)Cl ffe67a0166b8673fcedf8ac47696ff79 [0,2,0,0,0,0|2,0,0]=4 8488 B13R1.369 Fc1cc(cnc1NCCCS)Br fd7cfbce060afadaec9150f1e749d944 [0,2,0,0,0,0|2,0,0]=4 8489 B13R1.369 Fc1cc(cnc1NCCCS)Cl 0090865d1d1fe0bd713abdd641a05e08 [0,2,0,0,0,0|2,0,0]=4 8490 B13R1.369 Fc1cc(cnc1NCCCS)I 7507a50a533b3bc77d619462001b47f0 [0,2,0,0,0,0|2,0,0]=4 8491 B13R1.369 Fc1cnc(c(c1)Br)COCCS bebae9f4b23fbab002b40a993030912e [0,2,0,0,0,0|2,0,0]=4 8492 B13R1.369 Fc1cnc(c(c1)Br)NCCCS b633ce4415ca61615dee56135b8428e4 [0,2,0,0,0,0|2,0,0]=4 8493 B13R1.369 Fc1cnc(c(c1)Br)OCCCS 13ef3ce487c9e27095f7b7d40b2eb7f4 [0,2,0,0,0,0|2,0,0]=4 8494 B13R1.369 Fc1cnc(c(c1)Cl)CNCCS 2480b46178c78e282b187108f03334c3 [0,2,0,0,0,0|2,0,0]=4 8495 B13R1.369 Fc1cnc(c(c1)Cl)COCCS 50adba8086ad5c2a1572c855db654f4f [0,2,0,0,0,0|2,0,0]=4 8496 B13R1.369 Fc1cnc(c(c1)Cl)NCCCS 21a6bed87c4e3beffec3f90ed8f5b92c [0,2,0,0,0,0|2,0,0]=4 8497 B13R1.369 Fc1cnc(c(c1)Cl)OCCCS 2f8a7280d64f862a8e985f3a6fc33c5a [0,2,0,0,0,0|2,0,0]=4 8498 B13R1.369 Fc1cnc(c(c1)F)CNCCBr 70b33af185ed44b163547de4a4fe9ada [0,2,0,0,0,0|2,0,0]=4 8499 B13R1.369 Fc1cnc(c(c1)F)CNCCI 29ca8439fefce1c58769f12faae2f962 [0,2,0,0,0,0|2,0,0]=4 8500 B13R1.369 Fc1cnc(c(c1)F)CNCCS f102b9ec420b7f49bdaa697244fe69e1 [0,2,0,0,0,0|2,0,0]=4 8501 B13R1.369 Fc1cnc(c(c1)F)COCCS f915fbe81841c09f5cc27b97519274d0 [0,2,0,0,0,0|2,0,0]=4 8502 B13R1.369 Fc1cnc(c(c1)F)NCCCS 5651a21047e2c9a1fd6ebc7b0dd71a32 [0,2,0,0,0,0|2,0,0]=4 8503 B13R1.369 Fc1cnc(c(c1)F)OCCCS 7ba638e553cba95c0f8fe45c23a73d0c [0,2,0,0,0,0|2,0,0]=4 8504 B13R1.369 Fc1cnc(c(c1)I)NCCCS 3ac2d0da03485e58a5142ea3fa13ec27 [0,2,0,0,0,0|2,0,0]=4 8505 B13R1.369 Fc1cnc(c(c1)I)OCCCS 88042bea29674307431be95361da2bc3 [0,2,0,0,0,0|2,0,0]=4 8506 B13R1.369 Nc1cnc(c(c1)N)NCCCCl ca3759fe31f0c35c96dab8c8ec8af5bc [0,2,0,0,0,0|2,0,0]=4 8507 B13R1.369 Nc1cnc(c(c1)N)NCCCO 8a7803e6de466643fb53a1a2053ef048 [0,2,0,0,0,0|2,0,0]=4 8508 B13R1.369 OCCCNc1ncc(cc1Br)Br b1884dfdf3f12c00f689565599f5082b [0,2,0,0,0,0|2,0,0]=4 8509 B13R1.369 OCCCNc1ncc(cc1Br)Cl 9c62e1141fe101f87a3814181808c333 [0,2,0,0,0,0|2,0,0]=4 8510 B13R1.369 OCCCNc1ncc(cc1Br)F eccc0809a62d17bef3b9221e445d6920 [0,2,0,0,0,0|2,0,0]=4 8511 B13R1.369 OCCCNc1ncc(cc1Br)I c01cea6b496137c781cd0e097cc241f9 [0,2,0,0,0,0|2,0,0]=4 8512 B13R1.369 OCCCNc1ncc(cc1Cl)Br 77fb3aff7b38cce4cd5f85adbad3db59 [0,2,0,0,0,0|2,0,0]=4 8513 B13R1.369 OCCCNc1ncc(cc1Cl)Cl 8c6dbb52f3a5f9b26e341f9097392b63 [0,2,0,0,0,0|2,0,0]=4 8514 B13R1.369 OCCCNc1ncc(cc1Cl)F c2b37dc483069f28f74aa5c3041b7690 [0,2,0,0,0,0|2,0,0]=4 8515 B13R1.369 OCCCNc1ncc(cc1Cl)I 09a3a7920680e007d0e8ba41774236b2 [0,2,0,0,0,0|2,0,0]=4 8516 B13R1.369 OCCCNc1ncc(cc1F)Br 0c19739079ea96a20ca7a88b1ca269b3 [0,2,0,0,0,0|2,0,0]=4 8517 B13R1.369 OCCCNc1ncc(cc1F)Cl 53e76ffb7ff6c9963229c048788a9f0a [0,2,0,0,0,0|2,0,0]=4 8518 B13R1.369 OCCCNc1ncc(cc1F)F 799d7468a7e7711014b88da852e43bd8 [0,2,0,0,0,0|2,0,0]=4 8519 B13R1.369 OCCCNc1ncc(cc1F)I 4428921e5e276b150490540f3e5659e3 [0,2,0,0,0,0|2,0,0]=4 8520 B13R1.369 OCCCNc1ncc(cc1I)Br c135b8678ea31bd5c83767c82d1b6b67 [0,2,0,0,0,0|2,0,0]=4 8521 B13R1.369 OCCCNc1ncc(cc1I)Cl ba286e8da38780c8f83095eedc3fb1d1 [0,2,0,0,0,0|2,0,0]=4 8522 B13R1.369 OCCCNc1ncc(cc1I)F 2a3a213d0eea18042d976200a903b098 [0,2,0,0,0,0|2,0,0]=4 8523 B13R1.369 OCCCNc1ncc(cc1I)I bc7eacd59e583c58f150cb8258fcae6d [0,2,0,0,0,0|2,0,0]=4 8524 B13R1.369 OCCNCc1ncc(cc1Cl)Cl 397906f4c845e683e9e12485c13a1e89 [0,2,0,0,0,0|2,0,0]=4 8525 B13R1.369 OCCNCc1ncc(cc1Cl)F 39a810ce9e3f3f62cb4252738215d4a3 [0,2,0,0,0,0|2,0,0]=4 8526 B13R1.369 OCCNCc1ncc(cc1F)Br 177b074ba1907c991a9e2ea2da3fb06f [0,2,0,0,0,0|2,0,0]=4 8527 B13R1.369 OCCNCc1ncc(cc1F)F cd248928d4b689816010855dff96304a [0,2,0,0,0,0|2,0,0]=4 8528 B13R1.369 SCCCNc1ncc(cc1Br)Br 20f399b285273517b64917108151cf77 [0,2,0,0,0,0|2,0,0]=4 8529 B13R1.369 SCCCNc1ncc(cc1Br)Cl e5633a4fac5b4c7d20797cc794e484a6 [0,2,0,0,0,0|2,0,0]=4 8530 B13R1.369 SCCCNc1ncc(cc1Br)I 294f050ec8de908a10f0ce7dffac8eb7 [0,2,0,0,0,0|2,0,0]=4 8531 B13R1.369 SCCCNc1ncc(cc1Cl)Br 0fd7e998a18acd9af98ace1d512feb74 [0,2,0,0,0,0|2,0,0]=4 8532 B13R1.369 SCCCNc1ncc(cc1Cl)Cl 7fc3106089e10e31f76c51221d895f80 [0,2,0,0,0,0|2,0,0]=4 8533 B13R1.369 SCCCNc1ncc(cc1Cl)I 14d305ddf913815c750233ae1be27af1 [0,2,0,0,0,0|2,0,0]=4 8534 B13R1.369 SCCCNc1ncc(cc1I)Br 9343689093b7fc7879acf32f47b30ea6 [0,2,0,0,0,0|2,0,0]=4 8535 B13R1.369 SCCCNc1ncc(cc1I)Cl 033d05d9903fa4fbc11a2da62473c26b [0,2,0,0,0,0|2,0,0]=4 8536 B13R1.369 SCCCNc1ncc(cc1I)I d27ee269f2f1a8ecb101ab4770b54b5c [0,2,0,0,0,0|2,0,0]=4 8537 B13R1.369 SCCCOc1ncc(cc1Br)Br 8f980e41ddc02653f3f6bc9ef036608a [0,2,0,0,0,0|2,0,0]=4 8538 B13R1.369 SCCCOc1ncc(cc1Br)Cl c07976472b3e3738b5143d2c55e9bc3c [0,2,0,0,0,0|2,0,0]=4 8539 B13R1.369 SCCCOc1ncc(cc1Br)I 4110bbf94dcce3e86b5e7a48c983c1f2 [0,2,0,0,0,0|2,0,0]=4 8540 B13R1.369 SCCCOc1ncc(cc1Cl)Cl 680b53531d67c3253b2c1fb984d7216d [0,2,0,0,0,0|2,0,0]=4 8541 B13R1.369 SCCCOc1ncc(cc1Cl)I b56079a877386efee9849c6d40643c1c [0,2,0,0,0,0|2,0,0]=4 8542 B13R1.369 SCCCOc1ncc(cc1I)Br 963bbcbed843ceb22036366768304d89 [0,2,0,0,0,0|2,0,0]=4 8543 B13R1.369 SCCCOc1ncc(cc1I)Cl de868f1dc5082deccf5dc817f64f7f7d [0,2,0,0,0,0|2,0,0]=4 8544 B13R1.369 SCCCOc1ncc(cc1I)I bcbfac0d0e1c2a6efb414c7ffec7dee3 [0,2,0,0,0,0|2,0,0]=4 8545 B13R1.369 SCCNCc1ncc(cc1Cl)Cl d2888488b34716ab7d7f85bc4cfe6a77 [0,2,0,0,0,0|2,0,0]=4 8546 B13R1.369 SCCOCc1ncc(cc1Br)Br fcc01bd6a10d5f1a2ab2931c4f40fb10 [0,2,0,0,0,0|2,0,0]=4 8547 B13R1.369 SCCOCc1ncc(cc1Br)Cl 72de73b9102d6b34a9671a4f27ddedbf [0,2,0,0,0,0|2,0,0]=4 8548 B13R1.369 SCCOCc1ncc(cc1Cl)Br d0e3f3dd21462b8eb47bca6c8f877633 [0,2,0,0,0,0|2,0,0]=4 8549 B13R1.369 SCCOCc1ncc(cc1Cl)Cl e22ad396492e2e7ca7e6c48bfb149a13 [0,2,0,0,0,0|2,0,0]=4 8550 B13R1.371 C#Cc1ccc(cc1)CNCCC ded72a93e3690d356ddca24ba0c1e2e2 [0,2,0,0,0,0|2,0,0]=4 8551 B13R1.371 C#Cc1ccc(cc1)COCCC 77760a109054b2ee26ff03cfbd977785 [0,2,0,0,0,0|2,0,0]=4 8552 B13R1.371 C#Cc1ccc(cc1)NCCCC d50012988f48a5f72ef9f27c15061822 [0,2,0,0,0,0|2,0,0]=4 8553 B13R1.371 C#Cc1ccc(cc1)OCCCC 881ae4359c2190728e27fd1ff61f4ff2 [0,2,0,0,0,0|2,0,0]=4 8554 B13R1.371 C#Cc1ccc(nc1)COCCC 30f4590a86b7de29d9c2aeb75c491e38 [0,2,0,0,0,0|1,0,0]=3 8555 B13R1.371 C#Cc1ccc(nc1)COCCF d0d021bb9106decf91f52e6af4a3bc63 [0,2,0,0,0,0|2,0,0]=4 8556 B13R1.371 C#Cc1ccc(nc1)COCCS 95792bbd4774ee4e7b4f292b45c3eeda [0,2,0,0,0,0|2,0,0]=4 8557 B13R1.371 C#Cc1ccc(nc1)COCOC 32bcbe45a80ab66451638b4439f66a22 [0,2,0,0,0,0|2,0,0]=4 8558 B13R1.371 C#Cc1ccc(nc1)COCSC 19afc17dd86a4a0ba90b46981b796fd2 [0,2,0,0,0,0|2,0,0]=4 8559 B13R1.371 C#Cc1ccc(nc1)NCCCC 408322ac86185d1a59e3a6b8de434c7b [0,2,0,0,0,0|1,0,0]=3 8560 B13R1.371 C#Cc1ccc(nc1)NCCCF 23f93b04d92779647bdb2e6a75778e94 [0,2,0,0,0,0|2,0,0]=4 8561 B13R1.371 C#Cc1ccc(nc1)NCCCO acd7ff24fd6663010eeff3c3efdd84c5 [0,2,0,0,0,0|2,0,0]=4 8562 B13R1.371 C#Cc1ccc(nc1)NCCCS 7d23f85825771f33f03e9df7fda982f2 [0,2,0,0,0,0|2,0,0]=4 8563 B13R1.371 C#Cc1ccc(nc1)NCCOC 6ec882083e58097d8bfef18880b91873 [0,2,0,0,0,0|2,0,0]=4 8564 B13R1.371 C#Cc1ccc(nc1)NCCSC 03fc14ae1bebad1786d8514d1af02a28 [0,2,0,0,0,0|2,0,0]=4 8565 B13R1.371 C#Cc1ccc(nc1)OCCCC bc8a001f1d8cfcc53092ea99fe720ea1 [0,2,0,0,0,0|1,0,0]=3 8566 B13R1.371 C#Cc1ccc(nc1)OCCCF 540c3d8be47350c3a5ea3bcd0b314aa8 [0,2,0,0,0,0|2,0,0]=4 8567 B13R1.371 C#Cc1ccc(nc1)OCCCS 075d88fa725c2b80e70051d8d3eb4470 [0,2,0,0,0,0|2,0,0]=4 8568 B13R1.371 C#Cc1ccc(nc1)OCCOC 49ec8cc534c030a57da2ba022a25bb11 [0,2,0,0,0,0|2,0,0]=4 8569 B13R1.371 C#Cc1ccc(nc1)OCCSC 92bed9198957b78289f78a7d6d975d83 [0,2,0,0,0,0|2,0,0]=4 8570 B13R1.371 C#Cc1ccc(nc1)OCOCC e2d2190cb5d7522f4e11ddd96ebc4ab8 [0,2,0,0,0,0|2,0,0]=4 8571 B13R1.371 C#Cc1cnc(cn1)NCCCC cdcefad7017f5cdf20531f887aef81c4 [0,2,0,0,0,0|2,0,0]=4 8572 B13R1.371 C#Cc1cnc(nc1)NCCCC 4c892bd10fb6ffb5e09c295954340590 [0,2,0,0,0,0|2,0,0]=4 8573 B13R1.371 C=Cc1ccc(cc1)CCOCC a76bf6510b21922d5f4664e72feae61f [0,2,0,0,0,0|2,0,0]=4 8574 B13R1.371 C=Cc1ccc(cc1)CNCCC 6a86c585be5961b248fe9fc93567dd0f [0,2,0,0,0,0|2,0,0]=4 8575 B13R1.371 C=Cc1ccc(cc1)COCCC 5c0f6feeb96bd32e50cb6672d0dcf179 [0,2,0,0,0,0|2,0,0]=4 8576 B13R1.371 C=Cc1ccc(cc1)NCCCC f98ab0061afe3c1e06d94b5d29817cb2 [0,2,0,0,0,0|2,0,0]=4 8577 B13R1.371 C=Cc1ccc(cc1)OCCCC 7096c01446aacc636656243c4badcaba [0,2,0,0,0,0|2,0,0]=4 8578 B13R1.371 C=Cc1ccc(nc1)NCCCC b512233aa8f976a0cb6a9ba51ac4064f [0,2,0,0,0,0|1,0,0]=3 8579 B13R1.371 C=Cc1ccc(nc1)NCCCCl 9c1951ae232c1d61df569de9407dbd80 [0,2,0,0,0,0|2,0,0]=4 8580 B13R1.371 C=Cc1ccc(nc1)NCCCF 69c83295319643a964372a399c01ff58 [0,2,0,0,0,0|2,0,0]=4 8581 B13R1.371 C=Cc1ccc(nc1)NCCCO b71be8897f09f7d6fb087e675dfe9dd5 [0,2,0,0,0,0|2,0,0]=4 8582 B13R1.371 C=Cc1ccc(nc1)NCCCS 290f79b07b7da5729885dca605c7fb35 [0,2,0,0,0,0|2,0,0]=4 8583 B13R1.371 C=Cc1ccc(nc1)NCCOC 7094378c62c40ec619912465e107be88 [0,2,0,0,0,0|2,0,0]=4 8584 B13R1.371 C=Cc1ccc(nc1)NCCSC 29b4fb086dbf0f6d5ccf2fd80c6b512d [0,2,0,0,0,0|2,0,0]=4 8585 B13R1.371 C=Cc1ccc(nc1)NCOCC feb7d84a6838ba026e97900d20382837 [0,2,0,0,0,0|2,0,0]=4 8586 B13R1.371 C=Cc1cnc(nc1)NCCCC c9c38a6a01e0fa39807e2d5357ad3fec [0,2,0,0,0,0|2,0,0]=4 8587 B13R1.371 CCCCNc1ccc(cc1)C#N 0db673c330d27cbd7e93dd02b35afba8 [0,2,0,0,0,0|2,0,0]=4 8588 B13R1.371 CCCCNc1ccc(cc1)C=O aaa7188e90485cd193203bb10520a918 [0,2,0,0,0,0|2,0,0]=4 8589 B13R1.371 CCCCNc1ccc(cc1)CC b5fab88c0bee331c02886b94554095c2 [0,2,0,0,0,0|2,0,0]=4 8590 B13R1.371 CCCCNc1ccc(cc1)CF 23a6bdeac87e57f02c16a753a6fdf4d1 [0,2,0,0,0,0|2,0,0]=4 8591 B13R1.371 CCCCNc1ccc(cc1)CO 64d4ab8b121b5777000987e2c981b7bb [0,2,0,0,0,0|2,0,0]=4 8592 B13R1.371 CCCCNc1ccc(cc1)CS 3c1e67de5dbacc348ba601beb7f0f678 [0,2,0,0,0,0|2,0,0]=4 8593 B13R1.371 CCCCNc1ccc(cc1)NO f437851d98e6ee385b8075969d899bd0 [0,2,0,0,0,0|2,0,0]=4 8594 B13R1.371 CCCCNc1ccc(cc1)OC 4c9e081eedabd83ca3bc230f5fa36b9a [0,2,0,0,0,0|2,0,0]=4 8595 B13R1.371 CCCCNc1ccc(cc1)SC fbb3323d26fe77cc55f0788a96e2868b [0,2,0,0,0,0|2,0,0]=4 8596 B13R1.371 CCCCNc1ccc(cn1)C#N 07c711e66d4a2f34845a28a365edad31 [0,2,0,0,0,0|1,0,0]=3 8597 B13R1.371 CCCCNc1ccc(cn1)C=O 92034e1858005792a11ae4b1fa227917 [0,2,0,0,0,0|1,0,0]=3 8598 B13R1.371 CCCCNc1ccc(cn1)CC 7e6ef949e9d74a56946e60f62230309b [0,2,0,0,0,0|1,0,0]=3 8599 B13R1.371 CCCCNc1ccc(cn1)CCl 1b2581653580f3d45f7ef974cd5b05fb [0,2,0,0,0,0|1,0,0]=3 8600 B13R1.371 CCCCNc1ccc(cn1)CO 01612ca23149523f3347cb4d4ac9e96a [0,2,0,0,0,0|1,0,0]=3 8601 B13R1.371 CCCCNc1ccc(cn1)OC e24d8a9f92bcbc9399802b7bc9600797 [0,2,0,0,0,0|1,0,0]=3 8602 B13R1.371 CCCCNc1ccc(cn1)SC 994f99a9eca27a14a0981010be9fe669 [0,2,0,0,0,0|1,0,0]=3 8603 B13R1.371 CCCCNc1ccc(nn1)C#N c5fb7292aa03dc371f92d5c621d7870b [0,2,0,0,0,0|2,0,0]=4 8604 B13R1.371 CCCCNc1ccc(nn1)C=O a2c88ce16647142155e31da88742881f [0,2,0,0,0,0|2,0,0]=4 8605 B13R1.371 CCCCNc1ccc(nn1)CC 1ff0e49acc1e3cc61e3cb6ef9b08671b [0,2,0,0,0,0|2,0,0]=4 8606 B13R1.371 CCCCNc1ccc(nn1)CO ce7e9b56b0f7597100b2671f2cdf3de1 [0,2,0,0,0,0|2,0,0]=4 8607 B13R1.371 CCCCNc1ccc(nn1)OC 297c6979545b1a350cf877e98143e136 [0,2,0,0,0,0|2,0,0]=4 8608 B13R1.371 CCCCNc1ccc(nn1)SC ac905be47dd6de1863012857d54f45fd [0,2,0,0,0,0|2,0,0]=4 8609 B13R1.371 CCCCNc1cnc(cn1)C#N 359abe8c2819de4b213b1cf21b977de6 [0,2,0,0,0,0|2,0,0]=4 8610 B13R1.371 CCCCNc1cnc(cn1)C=O 397968afec50e720db1e0ff398562255 [0,2,0,0,0,0|2,0,0]=4 8611 B13R1.371 CCCCNc1cnc(cn1)CC 5a18742cae4702a4b55e23f1170864bd [0,2,0,0,0,0|2,0,0]=4 8612 B13R1.371 CCCCNc1cnc(cn1)CO c14a0994f2342c8281dee296012c32ed [0,2,0,0,0,0|2,0,0]=4 8613 B13R1.371 CCCCNc1cnc(cn1)OC e1479da6807a7fa14cb2ff0fa533fb65 [0,2,0,0,0,0|2,0,0]=4 8614 B13R1.371 CCCCNc1cnc(cn1)SC c087336c8ecdbc59804cbef885979f31 [0,2,0,0,0,0|2,0,0]=4 8615 B13R1.371 CCCCNc1ncc(cn1)C#N 39251f9fbb2da5f3a73cd24003c13a07 [0,2,0,0,0,0|2,0,0]=4 8616 B13R1.371 CCCCNc1ncc(cn1)C=O a201899fac49dd5ba6429a201454ad0b [0,2,0,0,0,0|2,0,0]=4 8617 B13R1.371 CCCCNc1ncc(cn1)CC 69b27daf2153f1c498e4835dca7b76ec [0,2,0,0,0,0|2,0,0]=4 8618 B13R1.371 CCCCNc1ncc(cn1)CO 315002462d667560cd16d64ab2e0dc78 [0,2,0,0,0,0|2,0,0]=4 8619 B13R1.371 CCCCNc1ncc(cn1)OC 01a1bce1743b4159ac24bcce491a35b5 [0,2,0,0,0,0|2,0,0]=4 8620 B13R1.371 CCCCOc1ccc(cc1)C#N 6b7c9bbade4256018b069106a22a8e32 [0,2,0,0,0,0|2,0,0]=4 8621 B13R1.371 CCCCOc1ccc(cc1)C=O 22d5303bcf6ff78a696008d4b1bb0459 [0,2,0,0,0,0|2,0,0]=4 8622 B13R1.371 CCCCOc1ccc(cc1)CC ab59b73c46cf2c5eeeceb4e3c01c96e3 [0,2,0,0,0,0|2,0,0]=4 8623 B13R1.371 CCCCOc1ccc(cc1)N=O 32ed9bc06139f59105273813ff47aefe [0,2,0,0,0,0|2,0,0]=4 8624 B13R1.371 CCCCOc1ccc(cc1)OC 52400da5c0e7bccc480c16cdbb9df2b2 [0,2,0,0,0,0|2,0,0]=4 8625 B13R1.371 CCCCOc1ccc(cc1)SC 7a923f0313520610a9308cdd51c0727a [0,2,0,0,0,0|2,0,0]=4 8626 B13R1.371 CCCCOc1ccc(cn1)C#N 43ef695133dcbd08e4c60ef30f3b739a [0,2,0,0,0,0|1,0,0]=3 8627 B13R1.371 CCCCOc1ccc(cn1)C=O 268028fcbc571578deec883eda5b5644 [0,2,0,0,0,0|1,0,0]=3 8628 B13R1.371 CCCCOc1ccc(cn1)CC d0fb1f51f2528da640899782208346fb [0,2,0,0,0,0|1,0,0]=3 8629 B13R1.371 CCCCOc1ccc(cn1)OC c9d87a4156858dd5d98e3d897b7aa747 [0,2,0,0,0,0|1,0,0]=3 8630 B13R1.371 CCCCOc1ccc(nn1)C=O 36012e1aeaecf0ab18335a6cedded57c [0,2,0,0,0,0|2,0,0]=4 8631 B13R1.371 CCCCOc1cnc(cn1)CC cf192fa3183d4882821d11b50ac4a76c [0,2,0,0,0,0|2,0,0]=4 8632 B13R1.371 CCCCOc1ncc(cn1)C#N 94d1fb7e9ba2759a33b3a68d3f1cf351 [0,2,0,0,0,0|2,0,0]=4 8633 B13R1.371 CCCCOc1ncc(cn1)C=O 2e9af1fae6b3e8ba9086ce432afdc9c1 [0,2,0,0,0,0|2,0,0]=4 8634 B13R1.371 CCCNCc1ccc(cc1)C#N 73e1e3ef371b92531e2233709e1d6e42 [0,2,0,0,0,0|2,0,0]=4 8635 B13R1.371 CCCNCc1ccc(cc1)C=O 25d1984269b6d63d3de874a36afc62ba [0,2,0,0,0,0|2,0,0]=4 8636 B13R1.371 CCCNCc1ccc(cc1)CBr 6c75f8b5ad907791c0176a726f27cd54 [0,2,0,0,0,0|2,0,0]=4 8637 B13R1.371 CCCNCc1ccc(cc1)CC f817fd76814ddc4ff393d02a336efb1a [0,2,0,0,0,0|2,0,0]=4 8638 B13R1.371 CCCNCc1ccc(cc1)CO 94562ebd1374a52cee56b865c85892f9 [0,2,0,0,0,0|2,0,0]=4 8639 B13R1.371 CCCNCc1ccc(cc1)OC 8f3d294b1bdf463b123dba3a4ef2703a [0,2,0,0,0,0|2,0,0]=4 8640 B13R1.371 CCCNCc1ccc(cc1)SC 783a6d5a813944c5c4e01d302dd3f76b [0,2,0,0,0,0|2,0,0]=4 8641 B13R1.371 CCCNCc1ccc(cn1)C#N e15738650b418083432f0151d1e705f3 [0,2,0,0,0,0|1,0,0]=3 8642 B13R1.371 CCCNCc1ccc(cn1)OC 9274e3056d9da675873fd52ce57f23cb [0,2,0,0,0,0|1,0,0]=3 8643 B13R1.371 CCCNCc1ccc(nn1)OC a2052df2a0cbff505b2879fd9b45b81b [0,2,0,0,0,0|2,0,0]=4 8644 B13R1.371 CCCNCc1cnc(cn1)OC 284fa66137fa2d41c3d994165fb0d788 [0,2,0,0,0,0|2,0,0]=4 8645 B13R1.371 CCCNCc1ncc(cn1)C#N 514cdca55416076467931120ff03c292 [0,2,0,0,0,0|2,0,0]=4 8646 B13R1.371 CCCNCc1ncc(cn1)OC ee7f8a0e8158c7e56f5ae8a1b9df62af [0,2,0,0,0,0|2,0,0]=4 8647 B13R1.371 CCCOCc1ccc(cc1)C#N d84cb44f5a0594e81985632ad73b4e67 [0,2,0,0,0,0|2,0,0]=4 8648 B13R1.371 CCCOCc1ccc(cc1)C=O 1ddd83e6f131c4321de92c0554aad1bd [0,2,0,0,0,0|2,0,0]=4 8649 B13R1.371 CCCOCc1ccc(cc1)CC 35e951057d7f611a6b7014c8dcd39250 [0,2,0,0,0,0|2,0,0]=4 8650 B13R1.371 CCCOCc1ccc(cc1)OC 606a55e8f1c25ebc8acf7a643c0903b2 [0,2,0,0,0,0|2,0,0]=4 8651 B13R1.371 CCCOCc1ccc(cc1)SC 977aaefeb76807ff34c4ea7f810cfce0 [0,2,0,0,0,0|2,0,0]=4 8652 B13R1.371 CCCOCc1ccc(cn1)C#N c7ed3ad54f33cf922295bc06852cabbb [0,2,0,0,0,0|1,0,0]=3 8653 B13R1.371 CCCOCc1ccc(cn1)CC a424dd87e7838b92f9d2f9d942e37717 [0,2,0,0,0,0|1,0,0]=3 8654 B13R1.371 CCCOCc1ccc(cn1)OC 7d634001f10c62078130d07949d8cbab [0,2,0,0,0,0|1,0,0]=3 8655 B13R1.371 CCCOCc1ccc(nn1)OC 8e5ba3f066efdae47dc8828a11a76d71 [0,2,0,0,0,0|2,0,0]=4 8656 B13R1.371 CCCOCc1cnc(cn1)OC 196f9a132fd2efb65e3caede0d8db353 [0,2,0,0,0,0|2,0,0]=4 8657 B13R1.371 CCCOCc1ncc(cn1)C#N a2746479f85800cd84c4dec9aca878d8 [0,2,0,0,0,0|2,0,0]=4 8658 B13R1.371 CCCOCc1ncc(cn1)C=O 97109e42b1e4a19b59ea437ea62bb5a2 [0,2,0,0,0,0|2,0,0]=4 8659 B13R1.371 CCCOCc1ncc(cn1)OC b2fd84fefefcec4169329d89b308c997 [0,2,0,0,0,0|2,0,0]=4 8660 B13R1.371 CCNCCc1ccc(cc1)C#N 08cf51bab55284f07c0ba82a029b2b6d [0,2,0,0,0,0|2,0,0]=4 8661 B13R1.371 CCNCCc1ccc(cc1)CC 7e874791e233273d413be7285a8d2edf [0,2,0,0,0,0|2,0,0]=4 8662 B13R1.371 CCNCCc1ccc(cc1)CO 106f0e7ade95f23cfa0b7c21f920c6ca [0,2,0,0,0,0|2,0,0]=4 8663 B13R1.371 CCNCCc1ccc(cc1)OC 7695aaace8339270489524332b2c5bd7 [0,2,0,0,0,0|2,0,0]=4 8664 B13R1.371 CCOCCc1ccc(cc1)C#N e511651edfcbcdbc55d70546c892afe4 [0,2,0,0,0,0|2,0,0]=4 8665 B13R1.371 CCOCCc1ccc(cc1)C=O d52a3858e2c994c30247ed242c17ba7b [0,2,0,0,0,0|2,0,0]=4 8666 B13R1.371 CCOCCc1ccc(cc1)OC 8a11d2af9f0deaf1e16b62be209b1bc6 [0,2,0,0,0,0|2,0,0]=4 8667 B13R1.371 CCOCCc1ccc(cn1)CC c4d0c9ed4e601356df67c20732c42bc8 [0,2,0,0,0,0|1,0,0]=3 8668 B13R1.371 CCOCNc1ccc(cn1)C=O f8ef2c245be9f879b7302f91a57fa395 [0,2,0,0,0,0|2,0,0]=4 8669 B13R1.371 CCOCNc1ccc(cn1)CC 7b99c85e32da73d8dc7423867f8b5038 [0,2,0,0,0,0|2,0,0]=4 8670 B13R1.371 CCOCNc1ccc(cn1)CCl 886aea2cee5d9b7c5c6e6b1b1601c557 [0,2,0,0,0,0|2,0,0]=4 8671 B13R1.371 CCOCNc1ccc(cn1)CO 8d55a89b9b0f93dd40b4d6d885105c5a [0,2,0,0,0,0|2,0,0]=4 8672 B13R1.371 CCOCNc1ccc(cn1)OC 6d0c48eac01d8f82fb1a9eb9c519af6f [0,2,0,0,0,0|2,0,0]=4 8673 B13R1.371 CCOCOc1ccc(cn1)C=O 97a8f38868ed28eca7e15fa62e2a42d6 [0,2,0,0,0,0|2,0,0]=4 8674 B13R1.371 CCOCOc1ccc(cn1)OC daf6deb85234e75742cce5749087fa44 [0,2,0,0,0,0|2,0,0]=4 8675 B13R1.371 CCc1ccc(nc1)CCOCF 27c783aed898d321791cd4cf16562dd2 [0,2,0,0,0,0|2,0,0]=4 8676 B13R1.371 CCc1ccc(nc1)COCCF 1c0c80536dca468c796e879af567f475 [0,2,0,0,0,0|2,0,0]=4 8677 B13R1.371 CCc1ccc(nc1)COCCS ba3d63f964360c410a8da8326831fad2 [0,2,0,0,0,0|2,0,0]=4 8678 B13R1.371 CCc1ccc(nc1)COCOC 23ebfe9e7689fdd5f7b1265e4de3e5bb [0,2,0,0,0,0|2,0,0]=4 8679 B13R1.371 CCc1ccc(nc1)COCSC 6eb34fafeb5aa1dcfbd5cb5332d7cd6a [0,2,0,0,0,0|2,0,0]=4 8680 B13R1.371 CCc1ccc(nc1)NCCCCl 8876ddd58fba058bc12146c5c404f01f [0,2,0,0,0,0|2,0,0]=4 8681 B13R1.371 CCc1ccc(nc1)NCCCF cf22a5493a02c1e3e0c7de7bee3981da [0,2,0,0,0,0|2,0,0]=4 8682 B13R1.371 CCc1ccc(nc1)NCCCO 050f7a13ab1ee1dc01db77b0a52ec46e [0,2,0,0,0,0|2,0,0]=4 8683 B13R1.371 CCc1ccc(nc1)NCCCS 60c04a49f2a1e610e98a4028a6f39baa [0,2,0,0,0,0|2,0,0]=4 8684 B13R1.371 CCc1ccc(nc1)NCCOC 94484abc09e3290aacf4a58541ec7048 [0,2,0,0,0,0|2,0,0]=4 8685 B13R1.371 CCc1ccc(nc1)NCCSC ef29a7ca839b2ab26799e4553689be45 [0,2,0,0,0,0|2,0,0]=4 8686 B13R1.371 CCc1ccc(nc1)OCCCF c7a12b29ef6c2bbc5a5d0a43ffbd8c1e [0,2,0,0,0,0|2,0,0]=4 8687 B13R1.371 CCc1ccc(nc1)OCCCS 38ae40c8c83b14320e0e4430f4b804c8 [0,2,0,0,0,0|2,0,0]=4 8688 B13R1.371 CCc1ccc(nc1)OCCOC 417dd00821e473a72499486bd8975de5 [0,2,0,0,0,0|2,0,0]=4 8689 B13R1.371 CCc1ccc(nc1)OCCSC 49fa5984014fbedd6dcd782de2b2f2bb [0,2,0,0,0,0|2,0,0]=4 8690 B13R1.371 COCCNc1ccc(cn1)C#N 3916b06cedde168241176687ba5934b7 [0,2,0,0,0,0|2,0,0]=4 8691 B13R1.371 COCCNc1ccc(cn1)C=O 561c436c95eae0b3493bec9e96ff73b0 [0,2,0,0,0,0|2,0,0]=4 8692 B13R1.371 COCCNc1ccc(cn1)CCl 7cc7fd463410abd426e709a7e970f8fb [0,2,0,0,0,0|2,0,0]=4 8693 B13R1.371 COCCNc1ccc(cn1)CO dde42e2c294844f82b9554262036b49f [0,2,0,0,0,0|2,0,0]=4 8694 B13R1.371 COCCNc1ccc(cn1)OC 310d3273260ffa75dd4c9e34c2568710 [0,2,0,0,0,0|2,0,0]=4 8695 B13R1.371 COCCNc1ccc(cn1)SC 3e79a2b6f748f25df33a706f06c54aff [0,2,0,0,0,0|2,0,0]=4 8696 B13R1.371 COCCOc1ccc(cn1)C#N 3c6966d4d33cfa3e04c1069b9e9568d9 [0,2,0,0,0,0|2,0,0]=4 8697 B13R1.371 COCCOc1ccc(cn1)C=O c365e08549d026101299229f5bd641d9 [0,2,0,0,0,0|2,0,0]=4 8698 B13R1.371 COCCOc1ccc(cn1)OC e7e88510c3d9a6b0d5cb0eeac50520b6 [0,2,0,0,0,0|2,0,0]=4 8699 B13R1.371 COCNCc1ccc(cn1)OC 7c7ec1aee136674842f397ce53fa521b [0,2,0,0,0,0|2,0,0]=4 8700 B13R1.371 COCOCc1ccc(cn1)C#N 3959764083c50070a326c30ab4b0d39d [0,2,0,0,0,0|2,0,0]=4 8701 B13R1.371 COCOCc1ccc(cn1)OC 9572dcbe0b8ebf5c91a1924b06850518 [0,2,0,0,0,0|2,0,0]=4 8702 B13R1.371 COc1ccc(nc1)CNCCBr 48149e81586fdf90b5d8a0357bb60c69 [0,2,0,0,0,0|2,0,0]=4 8703 B13R1.371 COc1ccc(nc1)CNCCF 3228bd17a053b1e47d5e0668433b830d [0,2,0,0,0,0|2,0,0]=4 8704 B13R1.371 COc1ccc(nc1)CNCCI ce356c831244cf0b01c8e4121160c235 [0,2,0,0,0,0|2,0,0]=4 8705 B13R1.371 COc1ccc(nc1)CNCCO e08e1b93615896e3260656129bb03a67 [0,2,0,0,0,0|2,0,0]=4 8706 B13R1.371 COc1ccc(nc1)CNCCS b26a18009d640bd1c964c4f3fa43ed1f [0,2,0,0,0,0|2,0,0]=4 8707 B13R1.371 COc1ccc(nc1)CNCSC 0e0c66d37c5d3ee68f25ed9df2bfb4f5 [0,2,0,0,0,0|2,0,0]=4 8708 B13R1.371 COc1ccc(nc1)COCCF a980fbabcba066fa57a44e5bdd89e6b2 [0,2,0,0,0,0|2,0,0]=4 8709 B13R1.371 COc1ccc(nc1)COCCS 458d9d71a5ebb345c74058016f6b0096 [0,2,0,0,0,0|2,0,0]=4 8710 B13R1.371 COc1ccc(nc1)COCSC 22d0ddb5bbd3609eba7cfd0bb8673c56 [0,2,0,0,0,0|2,0,0]=4 8711 B13R1.371 COc1ccc(nc1)NCCCCl 720d35768b21b4b03e03b45481dbf643 [0,2,0,0,0,0|2,0,0]=4 8712 B13R1.371 COc1ccc(nc1)NCCCF a379660ce1fec41e88f318d605b7919f [0,2,0,0,0,0|2,0,0]=4 8713 B13R1.371 COc1ccc(nc1)NCCCO 8a376442829758aa38253299fb2c9fcf [0,2,0,0,0,0|2,0,0]=4 8714 B13R1.371 COc1ccc(nc1)NCCCS fa8a589d1dd89243204da0353e675918 [0,2,0,0,0,0|2,0,0]=4 8715 B13R1.371 COc1ccc(nc1)NCCSC 99b1709ff2cfcb8bb6d4854d5ecfc745 [0,2,0,0,0,0|2,0,0]=4 8716 B13R1.371 COc1ccc(nc1)OCCCF 44f282a83b4d183f20d4d5b23761fc8f [0,2,0,0,0,0|2,0,0]=4 8717 B13R1.371 COc1ccc(nc1)OCCCS 0ac4067d36c6e8258d1e70f23e3bce94 [0,2,0,0,0,0|2,0,0]=4 8718 B13R1.371 COc1ccc(nc1)OCCSC 69ff589dd7f156390ebb391cc58d41db [0,2,0,0,0,0|2,0,0]=4 8719 B13R1.371 CSCCNc1ccc(cn1)C#N 3da241f6bccfe75ecc1fe467697c58dd [0,2,0,0,0,0|2,0,0]=4 8720 B13R1.371 CSCCNc1ccc(cn1)C=O e7c8c15c55cda84482f060864dd3bced [0,2,0,0,0,0|2,0,0]=4 8721 B13R1.371 CSCCNc1ccc(cn1)CCl 6c3dc05c4ecb32d1fdb3d842049076e4 [0,2,0,0,0,0|2,0,0]=4 8722 B13R1.371 CSCCNc1ccc(cn1)CO c9dcde642e9f641975b0d6dd1049034a [0,2,0,0,0,0|2,0,0]=4 8723 B13R1.371 CSCCNc1ccc(cn1)SC 2a92d4a76eb08c5093d8cc1859f2bead [0,2,0,0,0,0|2,0,0]=4 8724 B13R1.371 CSCCOc1ccc(cn1)C#N 8132e37e747c9e51a0b4f140fb3a7fbe [0,2,0,0,0,0|2,0,0]=4 8725 B13R1.371 CSCCOc1ccc(cn1)C=O 5150f3cf5d350a6a1db6f62b239fcc72 [0,2,0,0,0,0|2,0,0]=4 8726 B13R1.371 CSCOCc1ccc(cn1)C#N 4b9021d947593856eb68ab94e1eb7e3a [0,2,0,0,0,0|2,0,0]=4 8727 B13R1.371 CSc1ccc(nc1)NCCCF 65c3cf4a15387f63c997563148a8266e [0,2,0,0,0,0|2,0,0]=4 8728 B13R1.371 CSc1ccc(nc1)NCCCO e5a68afd3085b29f30563699474d1bc0 [0,2,0,0,0,0|2,0,0]=4 8729 B13R1.371 CSc1ccc(nc1)NCCCS e3bce54414699a3d7f9297527613e41c [0,2,0,0,0,0|2,0,0]=4 8730 B13R1.371 FCCCNc1ccc(cn1)CCl 5ab5da095ec2b42c20033812e66a34e9 [0,2,0,0,0,0|2,0,0]=4 8731 B13R1.371 N#Cc1ccc(nc1)CNCCBr d0141cf060b3e70db4744633d04fe463 [0,2,0,0,0,0|2,0,0]=4 8732 B13R1.371 N#Cc1ccc(nc1)CNCCF 2e88a1a7dfdb9c889952351848f53839 [0,2,0,0,0,0|2,0,0]=4 8733 B13R1.371 N#Cc1ccc(nc1)CNCCI 8440def09b15f6f65723613cebd7bd25 [0,2,0,0,0,0|2,0,0]=4 8734 B13R1.371 N#Cc1ccc(nc1)CNCCO 17a7535b20c2beb4d043a7c6aaa05292 [0,2,0,0,0,0|2,0,0]=4 8735 B13R1.371 N#Cc1ccc(nc1)CNCCS 6daa9a24d65ad046183f86294e5ff48b [0,2,0,0,0,0|2,0,0]=4 8736 B13R1.371 N#Cc1ccc(nc1)COCCF 8ce32595cf661eb9001acb054eec2fe6 [0,2,0,0,0,0|2,0,0]=4 8737 B13R1.371 N#Cc1ccc(nc1)COCCS 4b01834becb85846bc038ad9347c6419 [0,2,0,0,0,0|2,0,0]=4 8738 B13R1.371 N#Cc1ccc(nc1)NCCCCl efa7e15ee01e4065bb3d24135efdff88 [0,2,0,0,0,0|2,0,0]=4 8739 B13R1.371 N#Cc1ccc(nc1)NCCCF b4d9e2ae7f4b03d7c2d590eb2d65693b [0,2,0,0,0,0|2,0,0]=4 8740 B13R1.371 N#Cc1ccc(nc1)NCCCO 090e3e88fb62ad524934a462b07425cf [0,2,0,0,0,0|2,0,0]=4 8741 B13R1.371 N#Cc1ccc(nc1)NCCCS 65371fd70d0625626299fed39069f9b3 [0,2,0,0,0,0|2,0,0]=4 8742 B13R1.371 N#Cc1ccc(nc1)OCCCF 15a57025bb729fe76cd29c4c76406659 [0,2,0,0,0,0|2,0,0]=4 8743 B13R1.371 N#Cc1ccc(nc1)OCCCS c5fc792acfa3948bf5dcb523aa4df051 [0,2,0,0,0,0|2,0,0]=4 8744 B13R1.371 O=Cc1ccc(nc1)NCCCCl abce9cdd652393864c0c474f46e9bf99 [0,2,0,0,0,0|2,0,0]=4 8745 B13R1.371 O=Cc1ccc(nc1)NCCCF 7556185b25df3876e7b4c406a718d5dd [0,2,0,0,0,0|2,0,0]=4 8746 B13R1.371 O=Cc1ccc(nc1)NCCCO 45dff6379cfb93178d7ef987bfab1011 [0,2,0,0,0,0|2,0,0]=4 8747 B13R1.371 O=Cc1ccc(nc1)NCCCS b3961e3fdad99db1c9d8225a8bbb9562 [0,2,0,0,0,0|2,0,0]=4 8748 B13R1.371 O=Cc1ccc(nc1)OCCCF 66284920aad71d578b09d6727fbc9688 [0,2,0,0,0,0|2,0,0]=4 8749 B13R1.371 O=Cc1ccc(nc1)OCCCS a4f77b5482e6190f1b99ad3d91d68056 [0,2,0,0,0,0|2,0,0]=4 8750 B13R1.371 OCCCNc1ccc(cn1)CCl 8593afcb88d5df6cea1dc09a5f30d4a1 [0,2,0,0,0,0|2,0,0]=4 8751 B13R1.371 OCCCNc1ccc(cn1)CO 519d531ea0c5653e244f842a63913c04 [0,2,0,0,0,0|2,0,0]=4 8752 B13R1.371 OCc1ccc(nc1)NCCCCl a122ac8fddf24df9d551714434887615 [0,2,0,0,0,0|2,0,0]=4 8753 B13R1.371 OCc1ccc(nc1)NCCCF 4f823f4dcdd6b8aa0fb0476b365f5dbb [0,2,0,0,0,0|2,0,0]=4 8754 B13R1.371 OCc1ccc(nc1)NCCCS 21a1fc8348966e9e1c0547fd0c9f64cd [0,2,0,0,0,0|2,0,0]=4 8755 B13R1.371 SCCCNc1ccc(cn1)CCl 6b91a12928e82f2105e787be166c3a74 [0,2,0,0,0,0|2,0,0]=4 8756 B13R1.513 C=C(C)CCNc1ccc(cn1)Br 367e15be8194c7c1ab00d001aea8d229 [0,2,0,0,0,0|1,0,1]=4 8757 B13R1.513 C=C(C)CCNc1ccc(cn1)C f7de1a543673e4af6cd73b1bcaa39231 [0,2,0,0,0,0|1,0,1]=4 8758 B13R1.513 C=C(C)CCNc1ccc(cn1)Cl 9491efce0bd692c5c430b5e2a2096ba3 [0,2,0,0,0,0|1,0,1]=4 8759 B13R1.513 C=C(C)CCNc1ccc(cn1)F ea064962678db9e0046dc8e8dc3a8b3c [0,2,0,0,0,0|1,0,1]=4 8760 B13R1.513 C=C(C)CCNc1ccc(cn1)I df56eda89fe8d7dc7cea2b8aa5b372da [0,2,0,0,0,0|1,0,1]=4 8761 B13R1.513 C=C(C)CCOc1ccc(cn1)C c410b224fdb68569019565e44336c78f [0,2,0,0,0,0|1,0,1]=4 8762 B13R1.513 C=C(C)CCOc1ccc(cn1)Cl 042465a01a8f47c236bdb6cdd10b37cb [0,2,0,0,0,0|1,0,1]=4 8763 B13R1.513 C=C(C)CCOc1ccc(cn1)F 715196d3437e71829b5a9d2215541f55 [0,2,0,0,0,0|1,0,1]=4 8764 B13R1.513 C=C(C)CCOc1ccc(cn1)I c181546e053f297c0ab20c2e7d8fe001 [0,2,0,0,0,0|1,0,1]=4 8765 B13R1.513 C=C(C)CNCc1ccc(cn1)Br 94446110779636c1340b329defc0a485 [0,2,0,0,0,0|1,0,1]=4 8766 B13R1.513 C=C(C)CNCc1ccc(cn1)C 19e80c150be79510b291a183fd987261 [0,2,0,0,0,0|1,0,1]=4 8767 B13R1.513 C=C(C)CNCc1ccc(cn1)Cl 8f2f932ba2bad390e27e51eb05a048a5 [0,2,0,0,0,0|1,0,1]=4 8768 B13R1.513 C=C(C)CNCc1ccc(cn1)F 8dfeb98861e1835fa0e9fe11a139bca9 [0,2,0,0,0,0|1,0,1]=4 8769 B13R1.513 C=C(C)COCc1ccc(cn1)Br e1d35d916bba2ca3c576987d98ade73d [0,2,0,0,0,0|1,0,1]=4 8770 B13R1.513 C=C(C)COCc1ccc(cn1)C 6c14f9ad06876196cf59bab0686be176 [0,2,0,0,0,0|1,0,1]=4 8771 B13R1.513 C=C(C)COCc1ccc(cn1)Cl 210fd0d75de57e2a9f598ef4fc7e698a [0,2,0,0,0,0|1,0,1]=4 8772 B13R1.513 C=C(C)COCc1ccc(cn1)F 2ee96166e6504e1f624fca1da3ca9c41 [0,2,0,0,0,0|1,0,1]=4 8773 B13R1.513 C=C(C)COCc1ccc(cn1)I dc4e1aea4157af3e3d2d84702f01fefc [0,2,0,0,0,0|1,0,1]=4 8774 B13R1.513 CC(=O)CCNc1ccc(cn1)Br 554bbf62c1d09c041e7208f08083045f [0,2,0,0,0,0|1,0,1]=4 8775 B13R1.513 CC(=O)CCNc1ccc(cn1)C 34633a4a008aa3e2218ba3ec1e03653b [0,2,0,0,0,0|1,0,1]=4 8776 B13R1.513 CC(=O)CCNc1ccc(cn1)Cl e46c0a19d4052eef25372728192360e8 [0,2,0,0,0,0|1,0,1]=4 8777 B13R1.513 CC(=O)CCNc1ccc(cn1)F d5a1509f2324572eb0b9070931a4f022 [0,2,0,0,0,0|1,0,1]=4 8778 B13R1.513 CC(=O)CCNc1ccc(cn1)I 7ed24023bb12b0a8d3687f4231ac100a [0,2,0,0,0,0|1,0,1]=4 8779 B13R1.513 CC(=O)CCOc1ccc(cn1)C 0300acc1bb4cc1813af8296217a509ee [0,2,0,0,0,0|1,0,1]=4 8780 B13R1.513 CC(=O)CCOc1ccc(cn1)Cl 2ff81fabf8cce7e015efa6fd12740da6 [0,2,0,0,0,0|1,0,1]=4 8781 B13R1.513 CC(=O)CCOc1ccc(cn1)I 7f2297d8c152749dcfb99a8b401aca7c [0,2,0,0,0,0|1,0,1]=4 8782 B13R1.513 CC(=O)CNCc1ccc(cn1)Br 56dbc19f4e865be7089b5cdb95028287 [0,2,0,0,0,0|1,0,1]=4 8783 B13R1.513 CC(=O)CNCc1ccc(cn1)C 2cca81583a256180cab93afa89e98fae [0,2,0,0,0,0|1,0,1]=4 8784 B13R1.513 CC(=O)CNCc1ccc(cn1)Cl b46a21e826946cacef91e2340fc9b038 [0,2,0,0,0,0|1,0,1]=4 8785 B13R1.513 CC(=O)CNCc1ccc(cn1)F 9971309d92e52f3bb137d2a1f5248c39 [0,2,0,0,0,0|1,0,1]=4 8786 B13R1.513 CC(=O)COCc1ccc(cn1)Br 47d1667c1d47478dbab090937705f5cb [0,2,0,0,0,0|1,0,1]=4 8787 B13R1.513 CC(=O)COCc1ccc(cn1)C 75bbb7e871849893cc0094fd91b184b1 [0,2,0,0,0,0|1,0,1]=4 8788 B13R1.513 CC(=O)COCc1ccc(cn1)Cl 61ff8d914656fafa741e32eea4837940 [0,2,0,0,0,0|1,0,1]=4 8789 B13R1.513 CC(=O)COCc1ccc(cn1)F a0e0c278cef55a32f67058006be5f3e7 [0,2,0,0,0,0|1,0,1]=4 8790 B13R1.513 CC(=O)NCCc1ccc(cn1)Br 9b6a81fde97541582fcc907062ae8e65 [0,2,0,0,0,0|1,0,1]=4 8791 B13R1.513 CC(C)CCNc1c[nH]c(=S)cn1 8c9061c0a0bc4813326a15fb4a121cf9 [0,2,0,0,0,0|2,0,0]=4 8792 B13R1.513 CC(C)CCNc1ccc(cc1)Br b9d478e16e0c9591a48e2e778436e95a [0,2,0,0,0,0|2,0,0]=4 8793 B13R1.513 CC(C)CCNc1ccc(cc1)Cl ab1f6c20c6e339323c9b3e84cbf33cdc [0,2,0,0,0,0|2,0,0]=4 8794 B13R1.513 CC(C)CCNc1ccc(cc1)F c3a2e5864ae46f839c7ae7eda94be207 [0,2,0,0,0,0|2,0,0]=4 8795 B13R1.513 CC(C)CCNc1ccc(cc1)I c7644c05061d3be9d75a365a6aa78820 [0,2,0,0,0,0|2,0,0]=4 8796 B13R1.513 CC(C)CCNc1ccc(cc1)S 061af0a0b43a9fe8931d1dcabeb7a5fd [0,2,0,0,0,0|2,0,0]=4 8797 B13R1.513 CC(C)CCNc1ccc(cn1)Br 8f1e968871ba4621f03cc252d8dad0a0 [0,2,0,0,0,0|1,0,0]=3 8798 B13R1.513 CC(C)CCNc1ccc(cn1)Cl afb9feb9f885e27562d41057222bc3ce [0,2,0,0,0,0|1,0,0]=3 8799 B13R1.513 CC(C)CCNc1ccc(cn1)F fd67ca4b766af9b93931ec01e72676ab [0,2,0,0,0,0|1,0,0]=3 8800 B13R1.513 CC(C)CCNc1ccc(cn1)I e58526295d90798f7ec7fc4a8a234125 [0,2,0,0,0,0|1,0,0]=3 8801 B13R1.513 CC(C)CCNc1ccc(nn1)Br 126b364110620f621ae6ffa7e8b877b7 [0,2,0,0,0,0|2,0,0]=4 8802 B13R1.513 CC(C)CCNc1ccc(nn1)Cl 4621e246546d19816bce663df2ff1ac3 [0,2,0,0,0,0|2,0,0]=4 8803 B13R1.513 CC(C)CCNc1ccc(nn1)F eb50e19bc4f1c424f383a94feb6a4db8 [0,2,0,0,0,0|2,0,0]=4 8804 B13R1.513 CC(C)CCNc1ccc(nn1)I 4756f1988976cb3a18142d23ba894313 [0,2,0,0,0,0|2,0,0]=4 8805 B13R1.513 CC(C)CCNc1cnc(cn1)Br ba3f8ce55a057e0edf7de5d6dc0ba147 [0,2,0,0,0,0|2,0,0]=4 8806 B13R1.513 CC(C)CCNc1cnc(cn1)Cl b5bef7724fd4fad5e2218a3b8ad46553 [0,2,0,0,0,0|2,0,0]=4 8807 B13R1.513 CC(C)CCNc1cnc(cn1)I 9cc4c69510cf4a353561131a31e4fe4c [0,2,0,0,0,0|2,0,0]=4 8808 B13R1.513 CC(C)CCNc1ncc(cn1)Br 61e7d3bbbb8f749ded2c260d408a80be [0,2,0,0,0,0|2,0,0]=4 8809 B13R1.513 CC(C)CCNc1ncc(cn1)Cl bae0e0f831ac88071e2dc5d92d933443 [0,2,0,0,0,0|2,0,0]=4 8810 B13R1.513 CC(C)CCNc1ncc(cn1)F 6ea8e13fc05c0df8d3d65a302d8042af [0,2,0,0,0,0|2,0,0]=4 8811 B13R1.513 CC(C)CCNc1ncc(cn1)I fc4393e9d7fa7bc65dba7c9605a4234a [0,2,0,0,0,0|2,0,0]=4 8812 B13R1.513 CC(C)CCOc1ccc(cc1)Br c4342ae9547e3f12c4d4a0953284cf60 [0,2,0,0,0,0|2,0,0]=4 8813 B13R1.513 CC(C)CCOc1ccc(cc1)Cl c05c27d1b7e2e730f237104804f2df54 [0,2,0,0,0,0|2,0,0]=4 8814 B13R1.513 CC(C)CCOc1ccc(cc1)F b941fdf1e5349100fcf244fc8808675a [0,2,0,0,0,0|2,0,0]=4 8815 B13R1.513 CC(C)CCOc1ccc(cc1)I 245de7d1a15f3415b0170d894f62fb2b [0,2,0,0,0,0|2,0,0]=4 8816 B13R1.513 CC(C)CCOc1ccc(cc1)S cc19ecd3039b9a780b4d9fd52c0e771a [0,2,0,0,0,0|2,0,0]=4 8817 B13R1.513 CC(C)CCOc1ccc(cn1)Cl c8002e24bc61b2ad688416df63a58346 [0,2,0,0,0,0|1,0,0]=3 8818 B13R1.513 CC(C)CCOc1ccc(cn1)F 9e12bb2ea34294c43df4d76bd04a7822 [0,2,0,0,0,0|1,0,0]=3 8819 B13R1.513 CC(C)CCOc1ccc(cn1)I 46a90349ebc1dd788e087f2518a0df04 [0,2,0,0,0,0|1,0,0]=3 8820 B13R1.513 CC(C)CCOc1ccc(nn1)Br 3bc5fce20dfada5476fef2dd0a28714e [0,2,0,0,0,0|2,0,0]=4 8821 B13R1.513 CC(C)CCOc1ccc(nn1)Cl 94b511a3e00f7cbbf5e6a3de0a1e05f1 [0,2,0,0,0,0|2,0,0]=4 8822 B13R1.513 CC(C)CCOc1cnc(cn1)Br 50d7ac0861e8ec44d86cfbf7c24b1406 [0,2,0,0,0,0|2,0,0]=4 8823 B13R1.513 CC(C)CCOc1cnc(cn1)Cl e0360d0d67d5477756e0376634f756db [0,2,0,0,0,0|2,0,0]=4 8824 B13R1.513 CC(C)CCOc1cnc(cn1)I da84db075be18d79ea88cd05764c7dc9 [0,2,0,0,0,0|2,0,0]=4 8825 B13R1.513 CC(C)CCOc1ncc(cn1)Br ddcfbc0837292fc32289f9aff7c25ad4 [0,2,0,0,0,0|2,0,0]=4 8826 B13R1.513 CC(C)CCOc1ncc(cn1)F 819b03c5b04cf7255b407c97ae18f74f [0,2,0,0,0,0|2,0,0]=4 8827 B13R1.513 CC(C)CCOc1ncc(cn1)I 7045d181a751a9ce43921679f7ed085d [0,2,0,0,0,0|2,0,0]=4 8828 B13R1.513 CC(C)CNCc1ccc(cc1)Br ffbc0ba0e3da9728c8905d12325e28ad [0,2,0,0,0,0|2,0,0]=4 8829 B13R1.513 CC(C)CNCc1ccc(cc1)Cl f4fcf42389d4544dabeeb94c99838d94 [0,2,0,0,0,0|2,0,0]=4 8830 B13R1.513 CC(C)CNCc1ccc(cc1)F 3ea1377f35efa31543a2643a1fcca42d [0,2,0,0,0,0|2,0,0]=4 8831 B13R1.513 CC(C)CNCc1ccc(cc1)I ad25e97404f08826c6c3adb70d764949 [0,2,0,0,0,0|2,0,0]=4 8832 B13R1.513 CC(C)CNCc1ccc(cn1)Br cf1396fdbef16ea6de4b0242e29bb30b [0,2,0,0,0,0|1,0,0]=3 8833 B13R1.513 CC(C)CNCc1ccc(cn1)Cl 5013d4d50c75c83f63788b1acad6b408 [0,2,0,0,0,0|1,0,0]=3 8834 B13R1.513 CC(C)CNCc1ccc(cn1)F 431c2d57b78987562f4f7cab5eb8c6ad [0,2,0,0,0,0|1,0,0]=3 8835 B13R1.513 CC(C)CNCc1ccc(nn1)Cl 70f113ac471492f6b769b7340d90912f [0,2,0,0,0,0|2,0,0]=4 8836 B13R1.513 CC(C)CNCc1cnc(cn1)Br bedf52e7e009b1c04ddb3dc253a2a2c3 [0,2,0,0,0,0|2,0,0]=4 8837 B13R1.513 CC(C)CNCc1cnc(cn1)Cl dad5294e3cbdef2532d032342b329fd0 [0,2,0,0,0,0|2,0,0]=4 8838 B13R1.513 CC(C)CNCc1ncc(cn1)Br be4ca56ad17b23cc33ca16a0c970f428 [0,2,0,0,0,0|2,0,0]=4 8839 B13R1.513 CC(C)CNCc1ncc(cn1)Cl 399e9c143ea0e63191d8ddd5827e412e [0,2,0,0,0,0|2,0,0]=4 8840 B13R1.513 CC(C)CNCc1ncc(cn1)F c7758c406db7a50221e10e929af85f6c [0,2,0,0,0,0|2,0,0]=4 8841 B13R1.513 CC(C)COCc1ccc(cc1)Br 5292a1ed3b18b3308556bceb3d791fb2 [0,2,0,0,0,0|2,0,0]=4 8842 B13R1.513 CC(C)COCc1ccc(cc1)Cl f0da682204338127387f280dbf8942bd [0,2,0,0,0,0|2,0,0]=4 8843 B13R1.513 CC(C)COCc1ccc(cc1)F 540dcbd5e2b913754559aac4ec30900c [0,2,0,0,0,0|2,0,0]=4 8844 B13R1.513 CC(C)COCc1ccc(cc1)I ca3bb0ea17020b83af103d87fe2c8226 [0,2,0,0,0,0|2,0,0]=4 8845 B13R1.513 CC(C)COCc1ccc(cc1)S faccb702cd35f180d2ab3310f670a637 [0,2,0,0,0,0|2,0,0]=4 8846 B13R1.513 CC(C)COCc1ccc(cn1)Br a83b9de7c29b92c37d4d61b1fe54fe9d [0,2,0,0,0,0|1,0,0]=3 8847 B13R1.513 CC(C)COCc1ccc(cn1)Cl f4a8a510519725c40b1dfafa76da7370 [0,2,0,0,0,0|1,0,0]=3 8848 B13R1.513 CC(C)COCc1ccc(cn1)F 78272c2f0e23f4b74b2f10e15d20643b [0,2,0,0,0,0|1,0,0]=3 8849 B13R1.513 CC(C)COCc1ccc(cn1)I 96143d9d4d22ef294a19ecb967564534 [0,2,0,0,0,0|1,0,0]=3 8850 B13R1.513 CC(C)COCc1ccc(nn1)Cl 5cfc283f6e54b7f9954a6632ef5ca348 [0,2,0,0,0,0|2,0,0]=4 8851 B13R1.513 CC(C)COCc1cnc(cn1)Br 04aba7ff8ea3a9a719fb19d57e734bf6 [0,2,0,0,0,0|2,0,0]=4 8852 B13R1.513 CC(C)COCc1cnc(cn1)Cl a2c1ae614f528028229178ee5ff000f6 [0,2,0,0,0,0|2,0,0]=4 8853 B13R1.513 CC(C)COCc1ncc(cn1)Br 6f6d55d6c40df99e9ae6ae9c5d1df7d0 [0,2,0,0,0,0|2,0,0]=4 8854 B13R1.513 CC(C)COCc1ncc(cn1)Cl a94de328eb30cae1fa4b2341bbeefde5 [0,2,0,0,0,0|2,0,0]=4 8855 B13R1.513 CC(C)COCc1ncc(cn1)F dcff6d9dd0e1c6e8dfda9fbeada10d78 [0,2,0,0,0,0|2,0,0]=4 8856 B13R1.513 CC(C)NCCc1ccc(cc1)Br a48e23de4df3aa87820071362adb7752 [0,2,0,0,0,0|2,0,0]=4 8857 B13R1.513 CC(C)NCCc1ccc(cc1)Cl bdce26351bc992298480ef03ec035650 [0,2,0,0,0,0|2,0,0]=4 8858 B13R1.513 CC(C)NCCc1ccc(cc1)F f334e36d76e8f18c25a81d0150102d35 [0,2,0,0,0,0|2,0,0]=4 8859 B13R1.513 CC(C)NCCc1ccc(cc1)I 40eb0326fe9e650a40c6b0fd3d6d1f49 [0,2,0,0,0,0|2,0,0]=4 8860 B13R1.513 CC(C)OCCc1ccc(cc1)Br 92a42330d270226f0b8f4626448d178b [0,2,0,0,0,0|2,0,0]=4 8861 B13R1.513 CC(C)OCCc1ccc(cc1)Cl b94c8ec303b49e24587b748aa577bb0e [0,2,0,0,0,0|2,0,0]=4 8862 B13R1.513 CC(C)OCCc1ccc(cc1)F 15d66cf2e354de75444d479316bab16c [0,2,0,0,0,0|2,0,0]=4 8863 B13R1.513 CC(C)OCCc1ccc(cc1)I ee80cb34d61e98f964db4839113a235d [0,2,0,0,0,0|2,0,0]=4 8864 B13R1.513 CC(C)OCCc1ccc(cn1)F fbcb393091cdaa537d7dc269955532ca [0,2,0,0,0,0|1,0,0]=3 8865 B13R1.513 CC(C)OCCc1ncc(cn1)Br f71f3e41c436f738ebb399eb4b6071b9 [0,2,0,0,0,0|2,0,0]=4 8866 B13R1.513 CC(C)OCNc1ccc(cn1)Br bab28fb56e49c50aaa709705c756a77b [0,2,0,0,0,0|2,0,0]=4 8867 B13R1.513 CC(C)OCNc1ccc(cn1)Cl 7408599cbe798dbdd267e08ed5fb48b0 [0,2,0,0,0,0|2,0,0]=4 8868 B13R1.513 CC(C)OCNc1ccc(cn1)F 580a121f457dfbab36361c1b712a188c [0,2,0,0,0,0|2,0,0]=4 8869 B13R1.513 CC(C)OCNc1ccc(cn1)I efec18060b517548c9a8c48b259e53b3 [0,2,0,0,0,0|2,0,0]=4 8870 B13R1.513 CC(C)OCOc1ccc(cn1)Cl 84d3df1b3244dff2807c51089155736f [0,2,0,0,0,0|2,0,0]=4 8871 B13R1.513 CC(C)OCOc1ccc(cn1)F 1e665f9f2cf4fbf7f361b1a6ccfdeee2 [0,2,0,0,0,0|2,0,0]=4 8872 B13R1.513 CC(C)OCOc1ccc(cn1)I 46584909aad93f2d8250929e9d442454 [0,2,0,0,0,0|2,0,0]=4 8873 B13R1.513 CC(F)COCc1ccc(cc1)Br 5f508bacf1198b0073459e754b43b84d [0,2,0,0,0,0|2,0,0]=4 8874 B13R1.513 CC(F)COCc1ccc(cc1)Cl 7b7d7f12cbe8112cf9538bd1912c6583 [0,2,0,0,0,0|2,0,0]=4 8875 B13R1.513 CC(F)COCc1ccc(cc1)F 0e818147af5381c33dbb24e191f0611d [0,2,0,0,0,0|2,0,0]=4 8876 B13R1.513 CC(F)COCc1ccc(cc1)I 7c26b10bea866f7c9fe5ab3a6b4e7afd [0,2,0,0,0,0|2,0,0]=4 8877 B13R1.513 CC(F)COCc1ccc(cn1)Br d6beb6129ebe8ae2b3d4706fba643103 [0,2,0,0,0,0|1,0,0]=3 8878 B13R1.513 CC(F)COCc1ccc(cn1)Cl b9dcc5fea3c8e6e49a0fbe195c3fe34e [0,2,0,0,0,0|1,0,0]=3 8879 B13R1.513 CC(F)COCc1ccc(cn1)F 822be92c2c79d294b8cabfe475079fa8 [0,2,0,0,0,0|1,0,0]=3 8880 B13R1.513 CC(F)COCc1cnc(cn1)Br b55d99bf1fb953a9c27bee9ea1fb68b6 [0,2,0,0,0,0|2,0,0]=4 8881 B13R1.513 CC(F)COCc1ncc(cn1)Br 014fa4eae2f99cda5a718870e3de8a18 [0,2,0,0,0,0|2,0,0]=4 8882 B13R1.513 CC(F)COCc1ncc(cn1)Cl a4403a0300c5873433be328c50a86692 [0,2,0,0,0,0|2,0,0]=4 8883 B13R1.513 CC(F)COCc1ncc(cn1)F 0b5d81c8d079600f9b3990c37ece0239 [0,2,0,0,0,0|2,0,0]=4 8884 B13R1.513 CC(O)CCNc1c[nH]c(=S)cn1 3892f90f134104b7854c7096462625d8 [0,2,0,0,0,0|2,0,0]=4 8885 B13R1.513 CC(O)CCNc1ccc(cc1)Br 1442e47fd064eb5543d195289f3d1903 [0,2,0,0,0,0|2,0,0]=4 8886 B13R1.513 CC(O)CCNc1ccc(cc1)Cl 2dc30cde19b31ab789c1c8ccaee179b0 [0,2,0,0,0,0|2,0,0]=4 8887 B13R1.513 CC(O)CCNc1ccc(cc1)F 61b6ecdf1393e175e301982512131b7e [0,2,0,0,0,0|2,0,0]=4 8888 B13R1.513 CC(O)CCNc1ccc(cc1)I a76f9b96360d2a58239c236f579053c5 [0,2,0,0,0,0|2,0,0]=4 8889 B13R1.513 CC(O)CCNc1ccc(cc1)S 733d0e80ec30c111c98df0cd09620503 [0,2,0,0,0,0|2,0,0]=4 8890 B13R1.513 CC(O)CCNc1ccc(cn1)Br fba51313af36e838b6fac9ae620457a0 [0,2,0,0,0,0|1,0,0]=3 8891 B13R1.513 CC(O)CCNc1ccc(cn1)Cl 81ee7fbae2ad31b2b6fbf215b366a99c [0,2,0,0,0,0|1,0,0]=3 8892 B13R1.513 CC(O)CCNc1ccc(cn1)F 56b5b7eb3ac2e5e0ce86ac7096d51912 [0,2,0,0,0,0|1,0,0]=3 8893 B13R1.513 CC(O)CCNc1ccc(cn1)I 8d492bc362faf97a7ca5334dada58c26 [0,2,0,0,0,0|1,0,0]=3 8894 B13R1.513 CC(O)CCNc1ccc(nn1)Br 942eb66e363448aa7c8e6f26606b4dbf [0,2,0,0,0,0|2,0,0]=4 8895 B13R1.513 CC(O)CCNc1ccc(nn1)Cl b539bcbc8376b847dba42917b83c6f3b [0,2,0,0,0,0|2,0,0]=4 8896 B13R1.513 CC(O)CCNc1ccc(nn1)F 974bf4077804a01b7669e715eb9ef692 [0,2,0,0,0,0|2,0,0]=4 8897 B13R1.513 CC(O)CCNc1ccc(nn1)I 8a5d67bc40161b4103af4541ede62e45 [0,2,0,0,0,0|2,0,0]=4 8898 B13R1.513 CC(O)CCNc1cnc(cn1)Br 857481dd3d7a3e9f000fa58846027fb8 [0,2,0,0,0,0|2,0,0]=4 8899 B13R1.513 CC(O)CCNc1cnc(cn1)Cl 16afe8d8079664d552239040a162926a [0,2,0,0,0,0|2,0,0]=4 8900 B13R1.513 CC(O)CCNc1cnc(cn1)I 9536e66d777dce44a26607eeb41e1047 [0,2,0,0,0,0|2,0,0]=4 8901 B13R1.513 CC(O)CCNc1ncc(cn1)Br 5cda27bc63b9882bd2bd01db4001c3a2 [0,2,0,0,0,0|2,0,0]=4 8902 B13R1.513 CC(O)CCNc1ncc(cn1)Cl 2768b42ce2b2f0979194424d83d56cbb [0,2,0,0,0,0|2,0,0]=4 8903 B13R1.513 CC(O)CCNc1ncc(cn1)F a015f9a457bcaf0374ebcfe01efd030e [0,2,0,0,0,0|2,0,0]=4 8904 B13R1.513 CC(O)CCNc1ncc(cn1)I 4d18c350ab30fe9abea99f3560fce98b [0,2,0,0,0,0|2,0,0]=4 8905 B13R1.513 CC(O)CNCc1ccc(cc1)Br 6014f2501e287750b2918f60d68b19d8 [0,2,0,0,0,0|2,0,0]=4 8906 B13R1.513 CC(O)CNCc1ccc(cc1)Cl 45af81d8e1ac236ee5c26d9cbdbe5fa5 [0,2,0,0,0,0|2,0,0]=4 8907 B13R1.513 CC(O)CNCc1ccc(cc1)F bd60b73c7d567ebe8807120d9ac91269 [0,2,0,0,0,0|2,0,0]=4 8908 B13R1.513 CC(O)CNCc1ccc(cc1)I 6e15796e35153de1ed966d5fb1cfa05a [0,2,0,0,0,0|2,0,0]=4 8909 B13R1.513 CC(O)CNCc1ccc(cn1)Br a0f9af82825ddb0ca52a1cffc8bbda97 [0,2,0,0,0,0|1,0,0]=3 8910 B13R1.513 CC(O)CNCc1ccc(cn1)Cl 8a44950de603c82ca0a17b1b173f6644 [0,2,0,0,0,0|1,0,0]=3 8911 B13R1.513 CC(O)CNCc1ccc(cn1)F 384add95c05de3f3795858e266535251 [0,2,0,0,0,0|1,0,0]=3 8912 B13R1.513 CC(O)CNCc1ccc(nn1)Cl d1165f6702ff4cf4cb8c96ed23cf14db [0,2,0,0,0,0|2,0,0]=4 8913 B13R1.513 CC(O)CNCc1cnc(cn1)Br d448fa392656888044d450aea002252c [0,2,0,0,0,0|2,0,0]=4 8914 B13R1.513 CC(O)CNCc1cnc(cn1)Cl c92eff655f206244bc14750849b88b9d [0,2,0,0,0,0|2,0,0]=4 8915 B13R1.513 CC(O)CNCc1ncc(cn1)Br 8c46c2d61ce48dd1da4387d5d393343d [0,2,0,0,0,0|2,0,0]=4 8916 B13R1.513 CC(O)CNCc1ncc(cn1)Cl 718f1d43753eca695f71dab0960c65db [0,2,0,0,0,0|2,0,0]=4 8917 B13R1.513 CC(O)CNCc1ncc(cn1)F 9d4d529d424f441286e22d03fdfe852c [0,2,0,0,0,0|2,0,0]=4 8918 B13R1.513 CC(S)COCc1ccc(cc1)Br 4d36a0d25e6bdf21126cd5f2bf61601b [0,2,0,0,0,0|2,0,0]=4 8919 B13R1.513 CC(S)COCc1ccc(cc1)Cl dfbdc7f6dcea0d256995f8993ac74a66 [0,2,0,0,0,0|2,0,0]=4 8920 B13R1.513 CC(S)COCc1ccc(cc1)F 1c704cb404e5c7176daabcf94cce0deb [0,2,0,0,0,0|2,0,0]=4 8921 B13R1.513 CC(S)COCc1ccc(cc1)I b891d5c46729ed8d98de866894c35c26 [0,2,0,0,0,0|2,0,0]=4 8922 B13R1.513 CC(S)COCc1ccc(cn1)Br 6d46c4df007e4b64bd00a52571ac55a6 [0,2,0,0,0,0|1,0,0]=3 8923 B13R1.513 CC(S)COCc1ccc(cn1)Cl 96c3f6a58b3b25c1cd4605ec6a3db273 [0,2,0,0,0,0|1,0,0]=3 8924 B13R1.513 CC(S)COCc1ccc(cn1)F 7be52581ed371e7ca2e8b401a9c38a5e [0,2,0,0,0,0|1,0,0]=3 8925 B13R1.513 CC(S)COCc1cnc(cn1)Br 66971ecf3b0a34784743b66cb18d4320 [0,2,0,0,0,0|2,0,0]=4 8926 B13R1.513 CC(S)COCc1ncc(cn1)Br db70f88a037095faeac0b394499f0344 [0,2,0,0,0,0|2,0,0]=4 8927 B13R1.513 CC(S)COCc1ncc(cn1)Cl b8d92c3e0ff132171d4a34e747a58bc9 [0,2,0,0,0,0|2,0,0]=4 8928 B13R1.513 CC(S)COCc1ncc(cn1)F d2a114f8da24b2a61b23f04aaa2d21e5 [0,2,0,0,0,0|2,0,0]=4 8929 B13R1.513 CN(C)CCNc1ccc(cn1)Br e1c32018e43284895aa77d4861764855 [0,2,0,0,0,0|2,0,0]=4 8930 B13R1.513 CN(C)CCNc1ccc(cn1)Cl fbf26e6b201a3514ceece5f548c70a91 [0,2,0,0,0,0|2,0,0]=4 8931 B13R1.513 CN(C)CCNc1ccc(cn1)F 7a63e3e46fcdc82fa510b0bfc578ba8f [0,2,0,0,0,0|2,0,0]=4 8932 B13R1.513 CN(C)CCNc1ccc(cn1)I c85a3078b67723d177cab4e714dfd745 [0,2,0,0,0,0|2,0,0]=4 8933 B13R1.513 CN(C)CCOc1ccc(cn1)Cl a34b787b01c448f61e687660deb60dbf [0,2,0,0,0,0|2,0,0]=4 8934 B13R1.513 CN(C)CCOc1ccc(cn1)F d5b614d887f47ea1c2362fe2a70a9bac [0,2,0,0,0,0|2,0,0]=4 8935 B13R1.513 CN(C)CCOc1ccc(cn1)I f37102891ade5fab0c74b8fb6cf3c68d [0,2,0,0,0,0|2,0,0]=4 8936 B13R1.513 CN(C)CNCc1ccc(cn1)Cl 3e171a6e36f51a09b51655dae2c0173a [0,2,0,0,0,0|2,0,0]=4 8937 B13R1.513 CN(C)CNCc1ccc(cn1)F 7adc7446c9bfa580b519a2877db8c2a4 [0,2,0,0,0,0|2,0,0]=4 8938 B13R1.513 CN(C)COCc1ccc(cn1)Cl 18124218a1b69adc9e0e6d481c1df55a [0,2,0,0,0,0|2,0,0]=4 8939 B13R1.513 CN(C)COCc1ccc(cn1)F fd2ce485d7ba2626b7bf79dec36173fc [0,2,0,0,0,0|2,0,0]=4 8940 B13R1.513 CN(C)COCc1ccc(cn1)I e5055c823ebe9aac2351659e35091d53 [0,2,0,0,0,0|2,0,0]=4 8941 B13R1.513 CS(=O)CCNc1ccc(cn1)Br 8ef4b1e3eecfdf65685a4372eb635bd3 [0,2,0,0,0,0|2,0,0]=4 8942 B13R1.513 CS(=O)CCNc1ccc(cn1)Cl c8301b2298648f2f5fffdf8467bfb392 [0,2,0,0,0,0|2,0,0]=4 8943 B13R1.513 CS(=O)CCNc1ccc(cn1)F 160954dd7ee366d3269ab56bdbbdde4c [0,2,0,0,0,0|2,0,0]=4 8944 B13R1.513 CS(=O)CCNc1ccc(cn1)I bed436054917281bacd7eb05a0e03440 [0,2,0,0,0,0|2,0,0]=4 8945 B13R1.513 CS(=O)CCOc1ccc(cn1)Cl 59b225b413453eda71fc661baad91095 [0,2,0,0,0,0|2,0,0]=4 8946 B13R1.513 CS(=O)CCOc1ccc(cn1)F 3af49e21719e0e978361689990499457 [0,2,0,0,0,0|2,0,0]=4 8947 B13R1.513 CS(=O)CCOc1ccc(cn1)I 48357302b078073e6025a4c37a8142d3 [0,2,0,0,0,0|2,0,0]=4 8948 B13R1.513 C[C@@H](F)COCc1ccc(cc1)Br ab4a6d0128969159c3cb57587eb2de16 [0,2,0,0,0,0|2,0,0]=4 8949 B13R1.513 C[C@@H](F)COCc1ccc(cc1)Cl f34dffc1f8fcacb5a6f0a0048410b236 [0,2,0,0,0,0|2,0,0]=4 8950 B13R1.513 C[C@@H](F)COCc1ccc(cc1)F 782ce892e1e04b19896fe1aa34894dcd [0,2,0,0,0,0|2,0,0]=4 8951 B13R1.513 C[C@@H](F)COCc1ccc(cc1)I 4709dd820f228da437d65729804fa311 [0,2,0,0,0,0|2,0,0]=4 8952 B13R1.513 C[C@@H](F)COCc1ccc(cn1)Br 8c0f1e7497fe72cf047c925c9926dd5f [0,2,0,0,0,0|1,0,0]=3 8953 B13R1.513 C[C@@H](F)COCc1ccc(cn1)Cl f73059196256851e520781df2dc35244 [0,2,0,0,0,0|1,0,0]=3 8954 B13R1.513 C[C@@H](F)COCc1ccc(cn1)F f917f302b41986976a2fac452bc4c493 [0,2,0,0,0,0|1,0,0]=3 8955 B13R1.513 C[C@@H](F)COCc1cnc(cn1)Br 6e8d1b18fbb762e765a7dd1c93816d72 [0,2,0,0,0,0|2,0,0]=4 8956 B13R1.513 C[C@@H](F)COCc1ncc(cn1)Br 59879c0ca088bc0f0bed2cf5f5cad7b6 [0,2,0,0,0,0|2,0,0]=4 8957 B13R1.513 C[C@@H](F)COCc1ncc(cn1)Cl 8753cc6648d7fac303924521cc4f66bc [0,2,0,0,0,0|2,0,0]=4 8958 B13R1.513 C[C@@H](F)COCc1ncc(cn1)F 562b86dcf4270fb8943a9422a053c96a [0,2,0,0,0,0|2,0,0]=4 8959 B13R1.513 C[C@@H](O)CCNc1c[nH]c(=S)cn1 a5012d34a3fa56e5ab8df724a36de8cc [0,2,0,0,0,0|2,0,0]=4 8960 B13R1.513 C[C@@H](O)CCNc1ccc(cc1)S c7275fc0231a05c7795a14d258a546d6 [0,2,0,0,0,0|2,0,0]=4 8961 B13R1.513 C[C@@H](O)CCNc1ncc(cn1)F 40983e7cb1c5057489239fea10e129b3 [0,2,0,0,0,0|2,0,0]=4 8962 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)Br 60b8b6c62e2e2aa0eb51be7df1b02616 [0,2,0,0,0,0|2,0,0]=4 8963 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)Cl dbd91e287f48eea4ac9af185c4d54533 [0,2,0,0,0,0|2,0,0]=4 8964 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)F c00494c3b2da864cd2e7d87821ce8d36 [0,2,0,0,0,0|2,0,0]=4 8965 B13R1.513 C[C@@H](O)CNCc1ccc(cc1)I fec06ec0830490f80cc803a69a1384d0 [0,2,0,0,0,0|2,0,0]=4 8966 B13R1.513 C[C@@H](O)CNCc1ccc(cn1)Br 3e2e67a4da2574b58b6167cec19d7d1c [0,2,0,0,0,0|1,0,0]=3 8967 B13R1.513 C[C@@H](O)CNCc1ccc(cn1)Cl 3fe1192fcb215e9965ff3f2266fb5503 [0,2,0,0,0,0|1,0,0]=3 8968 B13R1.513 C[C@@H](O)CNCc1ccc(cn1)F c8477ac2ce9cdb8fc6c787d3c9526469 [0,2,0,0,0,0|1,0,0]=3 8969 B13R1.513 C[C@@H](O)CNCc1ccc(nn1)Cl fcf75e7820db7840a51c94154f687089 [0,2,0,0,0,0|2,0,0]=4 8970 B13R1.513 C[C@@H](O)CNCc1cnc(cn1)Br 3556d7008a2637862178323d564e8c9c [0,2,0,0,0,0|2,0,0]=4 8971 B13R1.513 C[C@@H](O)CNCc1cnc(cn1)Cl 17b595efc7d4d29d6b4b661d90a89d60 [0,2,0,0,0,0|2,0,0]=4 8972 B13R1.513 C[C@@H](O)CNCc1ncc(cn1)Br 508882a2cfe3e3aa46223b1bb04924b8 [0,2,0,0,0,0|2,0,0]=4 8973 B13R1.513 C[C@@H](O)CNCc1ncc(cn1)Cl 5a8b73735b2b704328eb4ad40c2b5310 [0,2,0,0,0,0|2,0,0]=4 8974 B13R1.513 C[C@@H](O)CNCc1ncc(cn1)F d8359465372a6bb0cfdabf797f9a09c7 [0,2,0,0,0,0|2,0,0]=4 8975 B13R1.513 C[C@H](F)COCc1ccc(cc1)Br 3713a3ced03092cace31c97540af9c05 [0,2,0,0,0,0|2,0,0]=4 8976 B13R1.513 C[C@H](F)COCc1ccc(cc1)Cl 1bcec87017c0f95b87b1f4d9a266618a [0,2,0,0,0,0|2,0,0]=4 8977 B13R1.513 C[C@H](F)COCc1ccc(cc1)F 706ab049bab5d17f3828bca88b1ef17f [0,2,0,0,0,0|2,0,0]=4 8978 B13R1.513 C[C@H](F)COCc1ccc(cc1)I 334df28f957db9e7e1995579c14f59db [0,2,0,0,0,0|2,0,0]=4 8979 B13R1.513 C[C@H](F)COCc1ccc(cn1)Br 2c0ba8afde1fcc2f6b2003abdaa71469 [0,2,0,0,0,0|1,0,0]=3 8980 B13R1.513 C[C@H](F)COCc1ccc(cn1)Cl 23fd44ea1ae53a68258dc6837ce13e4f [0,2,0,0,0,0|1,0,0]=3 8981 B13R1.513 C[C@H](F)COCc1ccc(cn1)F 39db880d7d275f2532876ed29e68f8ba [0,2,0,0,0,0|1,0,0]=3 8982 B13R1.513 C[C@H](F)COCc1cnc(cn1)Br 0b4e9dcec29213a010e37c615f054aeb [0,2,0,0,0,0|2,0,0]=4 8983 B13R1.513 C[C@H](F)COCc1ncc(cn1)Br c9156623788c8cc4963fe69784ba29bb [0,2,0,0,0,0|2,0,0]=4 8984 B13R1.513 C[C@H](F)COCc1ncc(cn1)Cl 55750ed01639db2df608cb6eb419f6f8 [0,2,0,0,0,0|2,0,0]=4 8985 B13R1.513 C[C@H](F)COCc1ncc(cn1)F 36e06b0847c148935187aa51a5d88631 [0,2,0,0,0,0|2,0,0]=4 8986 B13R1.513 C[C@H](O)CCNc1c[nH]c(=S)cn1 f46c87b61dc30112281f3cfacb63bb3c [0,2,0,0,0,0|2,0,0]=4 8987 B13R1.513 C[C@H](O)CCNc1ccc(cc1)S 0009e3240ab4172d8cc838f7ae8b0a4e [0,2,0,0,0,0|2,0,0]=4 8988 B13R1.513 C[C@H](O)CCNc1ncc(cn1)F 39974f365f000aa7256dfdbf24922e2d [0,2,0,0,0,0|2,0,0]=4 8989 B13R1.513 C[C@H](O)CNCc1ccc(cc1)Br 8b5a3e07b63f385f1253805025829f61 [0,2,0,0,0,0|2,0,0]=4 8990 B13R1.513 C[C@H](O)CNCc1ccc(cc1)Cl a807b1188b0e036b83306086b654fbf1 [0,2,0,0,0,0|2,0,0]=4 8991 B13R1.513 C[C@H](O)CNCc1ccc(cc1)F 856d877eb26ba8c25e36011c9943cd64 [0,2,0,0,0,0|2,0,0]=4 8992 B13R1.513 C[C@H](O)CNCc1ccc(cc1)I d843bf5949de18be607cd3b8d1acf729 [0,2,0,0,0,0|2,0,0]=4 8993 B13R1.513 C[C@H](O)CNCc1ccc(cn1)Br a6400e5c8296c72453c6d5d61ee7fbf1 [0,2,0,0,0,0|1,0,0]=3 8994 B13R1.513 C[C@H](O)CNCc1ccc(cn1)Cl c973a842a65e8f7efedf457856caa4db [0,2,0,0,0,0|1,0,0]=3 8995 B13R1.513 C[C@H](O)CNCc1ccc(cn1)F 49d52babb8179c0b86c7f76a6660d94b [0,2,0,0,0,0|1,0,0]=3 8996 B13R1.513 C[C@H](O)CNCc1ccc(nn1)Cl 320667035874b6f4df0a60f6f6d6bac1 [0,2,0,0,0,0|2,0,0]=4 8997 B13R1.513 C[C@H](O)CNCc1cnc(cn1)Br bc876970697e017f9c6361ee09011a4a [0,2,0,0,0,0|2,0,0]=4 8998 B13R1.513 C[C@H](O)CNCc1cnc(cn1)Cl 2f20490fa0a80d362c88f5ea75dc4f56 [0,2,0,0,0,0|2,0,0]=4 8999 B13R1.513 C[C@H](O)CNCc1ncc(cn1)Br 8de2892c64ec21530231d1f797fe247a [0,2,0,0,0,0|2,0,0]=4 9000 B13R1.513 C[C@H](O)CNCc1ncc(cn1)Cl 8877193ce6d4c6c722310808687ed1bb [0,2,0,0,0,0|2,0,0]=4 9001 B13R1.513 C[C@H](O)CNCc1ncc(cn1)F 145b1151177ecefa86aac00f128dda58 [0,2,0,0,0,0|2,0,0]=4 9002 B13R1.513 Cc1ccc(cc1)CCNC(C)C dcb33f8e3a3328245bb1e315273e2474 [0,2,0,0,0,0|2,0,0]=4 9003 B13R1.513 Cc1ccc(cc1)CCOC(C)C c40e0f5ec2a785e1448a9d4bbbda7223 [0,2,0,0,0,0|2,0,0]=4 9004 B13R1.513 Cc1ccc(cc1)CNCC(C)C 8007373e36ed399b3c91ab60c1eddd1e [0,2,0,0,0,0|2,0,0]=4 9005 B13R1.513 Cc1ccc(cc1)CNCC(C)O 4850723ba861dc5e09f536a03090346b [0,2,0,0,0,0|2,0,0]=4 9006 B13R1.513 Cc1ccc(cc1)CNC[C@@H](C)O 7b28e33f9a7e2556c34b07317877c47d [0,2,0,0,0,0|2,0,0]=4 9007 B13R1.513 Cc1ccc(cc1)CNC[C@H](C)O f439c46b5159844a576401007fd2b3b4 [0,2,0,0,0,0|2,0,0]=4 9008 B13R1.513 Cc1ccc(cc1)COCC(C)C fef2e1b898316f09dabe51f30ed565c5 [0,2,0,0,0,0|2,0,0]=4 9009 B13R1.513 Cc1ccc(cc1)COCC(C)F aa0e37c5a5420893838d9eadb51e26d3 [0,2,0,0,0,0|2,0,0]=4 9010 B13R1.513 Cc1ccc(cc1)COCC(C)S 3fa9881d4f8749958676822017cc12ee [0,2,0,0,0,0|2,0,0]=4 9011 B13R1.513 Cc1ccc(cc1)COC[C@@H](C)F 4f72db0ccfb0de1aaa15e2932ddb45f6 [0,2,0,0,0,0|2,0,0]=4 9012 B13R1.513 Cc1ccc(cc1)COC[C@H](C)F 1d45633efe4ea071353d30816f23db7d [0,2,0,0,0,0|2,0,0]=4 9013 B13R1.513 Cc1ccc(cc1)NCCC(C)C f6c18c3803c1c770f7d1606f4a35adbc [0,2,0,0,0,0|2,0,0]=4 9014 B13R1.513 Cc1ccc(cc1)NCCC(C)O 162c440e82e2ad8ba1870e40632031ad [0,2,0,0,0,0|2,0,0]=4 9015 B13R1.513 Cc1ccc(cc1)NCC[C@@H](C)O 7ffa52480a33aa7d77fa22728757bcfd [0,2,0,0,0,0|2,0,0]=4 9016 B13R1.513 Cc1ccc(cc1)NCC[C@H](C)O 27ac2dea21e6f5dcefbf2a9361ded200 [0,2,0,0,0,0|2,0,0]=4 9017 B13R1.513 Cc1ccc(cc1)OCCC(C)C 24d657586e73773d451964ccd9d82a09 [0,2,0,0,0,0|2,0,0]=4 9018 B13R1.513 Cc1ccc(nc1)CCOC(C)C ebe6a28c9c93b938cf9193135c229670 [0,2,0,0,0,0|1,0,0]=3 9019 B13R1.513 Cc1ccc(nc1)CNCC(C)C 0a9767d5cd79587a391c8c52e373666b [0,2,0,0,0,0|1,0,0]=3 9020 B13R1.513 Cc1ccc(nc1)CNCC(C)O 07750fa85b0cf12b949c50e4de3c6e38 [0,2,0,0,0,0|1,0,0]=3 9021 B13R1.513 Cc1ccc(nc1)CNCC(F)F 516ec89f0856df2221395bf034245361 [0,2,0,0,0,0|2,0,0]=4 9022 B13R1.513 Cc1ccc(nc1)CNCN(C)C e7d699c2016f5d28d9a3b4ba10efc250 [0,2,0,0,0,0|2,0,0]=4 9023 B13R1.513 Cc1ccc(nc1)CNC[C@@H](C)O 14f473976f36516c93902eff6d86e2c1 [0,2,0,0,0,0|1,0,0]=3 9024 B13R1.513 Cc1ccc(nc1)CNC[C@H](C)O 3d66ad78fdd3d86050c4f2282dac2fad [0,2,0,0,0,0|1,0,0]=3 9025 B13R1.513 Cc1ccc(nc1)COCC(C)C 0092d6d52e863756f85726cd722ea68b [0,2,0,0,0,0|1,0,0]=3 9026 B13R1.513 Cc1ccc(nc1)COCC(C)F 553b9a97bbc1050603b68e56d0fbf8fa [0,2,0,0,0,0|1,0,0]=3 9027 B13R1.513 Cc1ccc(nc1)COCC(C)S 6f4d5d3a36660deb6673622e003d037e [0,2,0,0,0,0|1,0,0]=3 9028 B13R1.513 Cc1ccc(nc1)COCC(F)F de300418fdd731d17c65c849cef992f8 [0,2,0,0,0,0|2,0,0]=4 9029 B13R1.513 Cc1ccc(nc1)COC[C@@H](C)F 80bca922787a9b224cc429e5b9a8947e [0,2,0,0,0,0|1,0,0]=3 9030 B13R1.513 Cc1ccc(nc1)COC[C@H](C)F 0267868343069263bf2dde5a789b1b4e [0,2,0,0,0,0|1,0,0]=3 9031 B13R1.513 Cc1ccc(nc1)NCCC(C)C db5538cdcc27716208a4ae531ea33599 [0,2,0,0,0,0|1,0,0]=3 9032 B13R1.513 Cc1ccc(nc1)NCCC(C)O b417b978d3435de1bd310855911a11b5 [0,2,0,0,0,0|1,0,0]=3 9033 B13R1.513 Cc1ccc(nc1)NCCN(C)C 1cad5272392dc49beab61f7c45ec265c [0,2,0,0,0,0|2,0,0]=4 9034 B13R1.513 Cc1ccc(nc1)NCCS(=O)C 6ded5c062759050b3cfaf5e4c46efb3d [0,2,0,0,0,0|2,0,0]=4 9035 B13R1.513 Cc1ccc(nc1)NCOC(C)C 73eab9e2aeaffef28e8eef04fc603556 [0,2,0,0,0,0|2,0,0]=4 9036 B13R1.513 Cc1ccc(nc1)OCCC(C)C a9c4b079c0a1396cd9445a30a1f308bc [0,2,0,0,0,0|1,0,0]=3 9037 B13R1.513 Cc1ccc(nc1)OCCN(C)C 753e1f950dda49e1c7008d76a7eeabc9 [0,2,0,0,0,0|2,0,0]=4 9038 B13R1.513 Cc1ccc(nc1)OCCS(=O)C b2299486f854930a8119ca618798fb3b [0,2,0,0,0,0|2,0,0]=4 9039 B13R1.513 Cc1ccc(nc1)OCOC(C)C e5d6bef8f3c19abd7d6f0db4ce7280d3 [0,2,0,0,0,0|2,0,0]=4 9040 B13R1.513 Cc1ccc(nn1)CNCC(C)C 2a39882d5a6d2d958e52c317ce3a8ed0 [0,2,0,0,0,0|2,0,0]=4 9041 B13R1.513 Cc1ccc(nn1)CNCC(C)O 51fe124f08abe606bfe1af425c2607de [0,2,0,0,0,0|2,0,0]=4 9042 B13R1.513 Cc1ccc(nn1)CNC[C@@H](C)O 2f8e516703d09fc33b280ed9b0c99154 [0,2,0,0,0,0|2,0,0]=4 9043 B13R1.513 Cc1ccc(nn1)CNC[C@H](C)O 19a1b1e358a1a0ac0a708ae705f2e033 [0,2,0,0,0,0|2,0,0]=4 9044 B13R1.513 Cc1ccc(nn1)COCC(C)C ca43d8ef296d7c3b439d478178b536af [0,2,0,0,0,0|2,0,0]=4 9045 B13R1.513 Cc1ccc(nn1)NCCC(C)C 3f03d8ba577fa7c1e82d5ee2ad4c25dd [0,2,0,0,0,0|2,0,0]=4 9046 B13R1.513 Cc1ccc(nn1)NCCC(C)O cd9586009f542d1361fd9cb54bf82708 [0,2,0,0,0,0|2,0,0]=4 9047 B13R1.513 Cc1ccc(nn1)NCC[C@@H](C)O 1c49405002585b027ad7aded13b35320 [0,2,0,0,0,0|2,0,0]=4 9048 B13R1.513 Cc1ccc(nn1)NCC[C@H](C)O f05bfd15d59303fa87a362feebf29962 [0,2,0,0,0,0|2,0,0]=4 9049 B13R1.513 Cc1ccc(nn1)OCCC(C)C 8d3d4fba72e0f6f3bfad582c4ecac140 [0,2,0,0,0,0|2,0,0]=4 9050 B13R1.513 Cc1cnc(cn1)CNCC(C)C 3f025dfde1e65218b02a432b87040b71 [0,2,0,0,0,0|2,0,0]=4 9051 B13R1.513 Cc1cnc(cn1)CNCC(C)O d75f0e5674c9d0248f2bafa6e313aab0 [0,2,0,0,0,0|2,0,0]=4 9052 B13R1.513 Cc1cnc(cn1)CNC[C@H](C)O 41a8bb0ecd69aaab10da2f4fa20c2cb1 [0,2,0,0,0,0|2,0,0]=4 9053 B13R1.513 Cc1cnc(cn1)COCC(C)C 5971f71c0cd5e1b523961dada2939ed5 [0,2,0,0,0,0|2,0,0]=4 9054 B13R1.513 Cc1cnc(cn1)NCCC(C)C eff6c90b153880d5da38011c24dd0073 [0,2,0,0,0,0|2,0,0]=4 9055 B13R1.513 Cc1cnc(cn1)NCCC(C)O 8563657ae1de0ade422831f12de2c23d [0,2,0,0,0,0|2,0,0]=4 9056 B13R1.513 Cc1cnc(cn1)OCCC(C)C fda9c662c8a010102cd7132adb624666 [0,2,0,0,0,0|2,0,0]=4 9057 B13R1.513 Cc1cnc(nc1)CNCC(C)C 801c06fb3774a2a1bce9bc3a1c38c6c9 [0,2,0,0,0,0|2,0,0]=4 9058 B13R1.513 Cc1cnc(nc1)CNCC(C)O 01777e0f120cbc9a2a94990c97bbe689 [0,2,0,0,0,0|2,0,0]=4 9059 B13R1.513 Cc1cnc(nc1)CNC[C@@H](C)O 00db1a70ab9fb76b00840c3b1897fe52 [0,2,0,0,0,0|2,0,0]=4 9060 B13R1.513 Cc1cnc(nc1)CNC[C@H](C)O 93ab3e050d880447385d1ba43210cbc2 [0,2,0,0,0,0|2,0,0]=4 9061 B13R1.513 Cc1cnc(nc1)COCC(C)C ad243a7b2f8664024a3d3c5b46dc5bf4 [0,2,0,0,0,0|2,0,0]=4 9062 B13R1.513 Cc1cnc(nc1)COCC(C)F 93e8226b92d0b19b38da4130f323bcf4 [0,2,0,0,0,0|2,0,0]=4 9063 B13R1.513 Cc1cnc(nc1)COCC(C)S a354e190b01681fe85d9dd81c283c4d0 [0,2,0,0,0,0|2,0,0]=4 9064 B13R1.513 Cc1cnc(nc1)COC[C@@H](C)F 3fc8b955146575666a1539ddb4f02efa [0,2,0,0,0,0|2,0,0]=4 9065 B13R1.513 Cc1cnc(nc1)COC[C@H](C)F 56213e8a7c437b2cfac8ce5ba5556e8c [0,2,0,0,0,0|2,0,0]=4 9066 B13R1.513 Cc1cnc(nc1)NCCC(C)C 970b6e7d9fe4630c85eb5e5346732a9c [0,2,0,0,0,0|2,0,0]=4 9067 B13R1.513 Cc1cnc(nc1)NCCC(C)O 6d7069b5c919e28a7c5a56c0c911f042 [0,2,0,0,0,0|2,0,0]=4 9068 B13R1.513 Cc1cnc(nc1)OCCC(C)C 2c1868044d530c18f48624f7df40ea0b [0,2,0,0,0,0|2,0,0]=4 9069 B13R1.513 FC(F)CNCc1ccc(cn1)Br 5f77bb6866c24902cdfea88b81afd7e8 [0,2,0,0,0,0|2,0,0]=4 9070 B13R1.513 FC(F)CNCc1ccc(cn1)Cl 6becfc4333423d7cb90fa09a48674695 [0,2,0,0,0,0|2,0,0]=4 9071 B13R1.513 FC(F)COCc1ccc(cn1)Br e14856af1cffa066f50b9c833abb5908 [0,2,0,0,0,0|2,0,0]=4 9072 B13R1.513 FC(F)COCc1ccc(cn1)Cl 1f46cf1556ad3e1de2ef22c0aaa6f7e1 [0,2,0,0,0,0|2,0,0]=4 9073 B13R1.513 FC(F)COCc1ccc(cn1)I 6c289ac12f8a6c84776f2f86a89d62d1 [0,2,0,0,0,0|2,0,0]=4 9074 B13R1.513 Fc1ccc(nc1)CNCC(F)F ac12450cb682f659d6221647ba39abc0 [0,2,0,0,0,0|2,0,0]=4 9075 B13R1.513 Fc1ccc(nc1)COCC(F)F 5c6d48fba4608938c8efe32228f23066 [0,2,0,0,0,0|2,0,0]=4 9076 B13R1.669 CCCCNc1c[nH]c(=O)c(n1)C 286f95641b8d326d80d8fdb5fd627881 [0,2,0,0,0,0|2,0,0]=4 9077 B13R1.669 CCCCNc1cc(=O)n(cn1)C 897c82b063ab33d207dec02b7e8a5f4b [0,2,0,0,0,0|2,0,0]=4 9078 B13R1.669 CCCCNc1cc(c(cn1)Br)Br b7880c89d9fa615140df6df0ef423d9a [0,2,0,0,0,0|1,0,0]=3 9079 B13R1.669 CCCCNc1cc(c(cn1)Br)C 715361f361c523c0cfd728be331394a1 [0,2,0,0,0,0|1,0,0]=3 9080 B13R1.669 CCCCNc1cc(c(cn1)Br)Cl 7c86796f436a223f85dd967b4fa1e656 [0,2,0,0,0,0|1,0,0]=3 9081 B13R1.669 CCCCNc1cc(c(cn1)Br)F ba8f197dbe575ae254b99d4dc622e735 [0,2,0,0,0,0|1,0,0]=3 9082 B13R1.669 CCCCNc1cc(c(cn1)C)Br 5661e85c0c9011f74e626e2ddec95855 [0,2,0,0,0,0|1,0,0]=3 9083 B13R1.669 CCCCNc1cc(c(cn1)C)C 75225a9c888a85fc112476b2ac0c37ca [0,2,0,0,0,0|1,0,0]=3 9084 B13R1.669 CCCCNc1cc(c(cn1)C)Cl cf7d99c8472c20e6064165be62351a79 [0,2,0,0,0,0|1,0,0]=3 9085 B13R1.669 CCCCNc1cc(c(cn1)C)F 3f2c259e1d0fe5a2ba15f0a37e4e214b [0,2,0,0,0,0|1,0,0]=3 9086 B13R1.669 CCCCNc1cc(c(cn1)C)I 4045cd9c52cf5ae22905042e0482db6b [0,2,0,0,0,0|1,0,0]=3 9087 B13R1.669 CCCCNc1cc(c(cn1)Cl)Br f1bcbcf50bc1d077374bb293ff747896 [0,2,0,0,0,0|1,0,0]=3 9088 B13R1.669 CCCCNc1cc(c(cn1)Cl)C b0e3d54aef17035417c64d6a9a3b6895 [0,2,0,0,0,0|1,0,0]=3 9089 B13R1.669 CCCCNc1cc(c(cn1)Cl)Cl af2442224f49d514fcba16716f6f224d [0,2,0,0,0,0|1,0,0]=3 9090 B13R1.669 CCCCNc1cc(c(cn1)Cl)F 0b7beb9a5175dfa367745db8461589ef [0,2,0,0,0,0|1,0,0]=3 9091 B13R1.669 CCCCNc1cc(c(cn1)Cl)I 2b84a013f462ffa04f94ae3c32763ced [0,2,0,0,0,0|1,0,0]=3 9092 B13R1.669 CCCCNc1cc(c(cn1)F)Br 17ba801eae4f458fe89a67c705928d31 [0,2,0,0,0,0|1,0,0]=3 9093 B13R1.669 CCCCNc1cc(c(cn1)F)C d44fceb1e64c3b37ca44728831d3ef16 [0,2,0,0,0,0|1,0,0]=3 9094 B13R1.669 CCCCNc1cc(c(cn1)F)Cl 4fe008247f51c3920ce6f50a81a6f2ec [0,2,0,0,0,0|1,0,0]=3 9095 B13R1.669 CCCCNc1cc(c(cn1)F)F 655c24bc740fa0544101aa082abef605 [0,2,0,0,0,0|1,0,0]=3 9096 B13R1.669 CCCCNc1cc(c(cn1)F)I 0d70a0f2405df2fb23b483462d6a7f63 [0,2,0,0,0,0|1,0,0]=3 9097 B13R1.669 CCCCNc1cc(c(cn1)I)Br cdb63ef1461ebb5a4dc07d4251264a00 [0,2,0,0,0,0|1,0,0]=3 9098 B13R1.669 CCCCNc1cc(c(cn1)I)C 8e3887279ea7d5afb527039d3d8fbda1 [0,2,0,0,0,0|1,0,0]=3 9099 B13R1.669 CCCCNc1cc(c(cn1)I)Cl bc9845556e1a6d51cc474aa2ab058012 [0,2,0,0,0,0|1,0,0]=3 9100 B13R1.669 CCCCNc1cc(c(cn1)I)F 695ea07138979ffd636dd193690238fd [0,2,0,0,0,0|1,0,0]=3 9101 B13R1.669 CCCCNc1cc(c(cn1)N)N c8bc40f0da34ece68270eed6d3dfb691 [0,2,0,0,0,0|1,0,0]=3 9102 B13R1.669 CCCCNc1cc(c(nn1)Cl)C 2d89e90e687e31205eabbbcef1cc8db0 [0,2,0,0,0,0|2,0,0]=4 9103 B13R1.669 CCCCNc1cc(c(nn1)N)N 67e1a93d44a925c0f6240c6202a4cd9b [0,2,0,0,0,0|2,0,0]=4 9104 B13R1.669 CCCCNc1ccc(=O)n(n1)C f2863dad83f64419e11a3fdee3166c97 [0,2,0,0,0,0|2,0,0]=4 9105 B13R1.669 CCCCNc1ccc(c(=O)[nH]1)C 13333b00c050eae0808404f2e7c76d4f [0,2,0,0,0,0|1,0,1]=4 9106 B13R1.669 CCCCNc1ccc(c(c1)Br)Br 39d88fa7b2b7a2cd5b48ea7ef2bcf3c8 [0,2,0,0,0,0|2,0,0]=4 9107 B13R1.669 CCCCNc1ccc(c(c1)Br)C b8b839d8d3580bf95baae27767771db0 [0,2,0,0,0,0|2,0,0]=4 9108 B13R1.669 CCCCNc1ccc(c(c1)Br)Cl b7271d66b1306a298f04ba98597df8b4 [0,2,0,0,0,0|2,0,0]=4 9109 B13R1.669 CCCCNc1ccc(c(c1)Br)F 9b6eb210acaa4e1f7a72a356b2d989a4 [0,2,0,0,0,0|2,0,0]=4 9110 B13R1.669 CCCCNc1ccc(c(c1)Br)I a7d1dec7ad145e76a6443d3dfaa58e3f [0,2,0,0,0,0|2,0,0]=4 9111 B13R1.669 CCCCNc1ccc(c(c1)C)Br 8ec5005f2df1a14638fdfcc58d8a74a6 [0,2,0,0,0,0|2,0,0]=4 9112 B13R1.669 CCCCNc1ccc(c(c1)C)C 3334cd24413fca5fd1e758430deb97a5 [0,2,0,0,0,0|2,0,0]=4 9113 B13R1.669 CCCCNc1ccc(c(c1)C)Cl cf9bb8d42b0b391e3589507c3f0e1f6d [0,2,0,0,0,0|2,0,0]=4 9114 B13R1.669 CCCCNc1ccc(c(c1)C)F 6f92f867c771bbcdf09515ce64030b8f [0,2,0,0,0,0|2,0,0]=4 9115 B13R1.669 CCCCNc1ccc(c(c1)C)I 52f0ed04608cdcd097fdd0cb1f563285 [0,2,0,0,0,0|2,0,0]=4 9116 B13R1.669 CCCCNc1ccc(c(c1)Cl)Br c3370936c6b017b867a558e0bffb8e1a [0,2,0,0,0,0|2,0,0]=4 9117 B13R1.669 CCCCNc1ccc(c(c1)Cl)C 74d961180d2fba63212bc689af6ea74b [0,2,0,0,0,0|2,0,0]=4 9118 B13R1.669 CCCCNc1ccc(c(c1)Cl)Cl 82cc418795d2bf4b3d34ad7a2c9c18d6 [0,2,0,0,0,0|2,0,0]=4 9119 B13R1.669 CCCCNc1ccc(c(c1)Cl)F b67064ec0cd31b1a353763c833fc517c [0,2,0,0,0,0|2,0,0]=4 9120 B13R1.669 CCCCNc1ccc(c(c1)Cl)I 7bc3ca24b28ec9152a3b98d09ebb0da9 [0,2,0,0,0,0|2,0,0]=4 9121 B13R1.669 CCCCNc1ccc(c(c1)F)Br 790a907e2dd974c134cfa5c34ec86032 [0,2,0,0,0,0|2,0,0]=4 9122 B13R1.669 CCCCNc1ccc(c(c1)F)C e1af4364b859b6752ee79cdc219ac455 [0,2,0,0,0,0|2,0,0]=4 9123 B13R1.669 CCCCNc1ccc(c(c1)F)Cl a4dfdf11057b24354ccebfaa33cb4fac [0,2,0,0,0,0|2,0,0]=4 9124 B13R1.669 CCCCNc1ccc(c(c1)F)F 8e585816f2cda698779f6a2eef030604 [0,2,0,0,0,0|2,0,0]=4 9125 B13R1.669 CCCCNc1ccc(c(c1)F)I 398af0dbfe46001e0a0002af21ca72c7 [0,2,0,0,0,0|2,0,0]=4 9126 B13R1.669 CCCCNc1ccc(c(c1)I)Br cebd55b3653c7cec2386005f31a7374c [0,2,0,0,0,0|2,0,0]=4 9127 B13R1.669 CCCCNc1ccc(c(c1)I)C 74a139b7caee45c5feb31c8cd4923f29 [0,2,0,0,0,0|2,0,0]=4 9128 B13R1.669 CCCCNc1ccc(c(c1)I)Cl c3ec5bd3b744c985bf41aa1209073271 [0,2,0,0,0,0|2,0,0]=4 9129 B13R1.669 CCCCNc1ccc(c(c1)I)F 7fe4928e88265bb4ac345bfd59c27417 [0,2,0,0,0,0|2,0,0]=4 9130 B13R1.669 CCCCNc1ccc(c(c1)N)N 8b2f757526fef8dc0eb47de7ac673ae3 [0,2,0,0,0,0|2,0,0]=4 9131 B13R1.669 CCCCNc1ccc(c(c1)O)C e47c1e4276a332a45cfc6c47b74e0fbb [0,2,0,0,0,0|2,0,0]=4 9132 B13R1.669 CCCCNc1ccc(c(c1)O)F f76e05977b0cd4e6e39729c39dea86b2 [0,2,0,0,0,0|2,0,0]=4 9133 B13R1.669 CCCCNc1ccc(c(c1)O)O deb8d7711339243195fd273015acd44b [0,2,0,0,0,0|2,0,0]=4 9134 B13R1.669 CCCCNc1ccc(c(n1)Br)Br fe4168d59239f6572a770741a491bb99 [0,2,0,0,0,0|1,0,0]=3 9135 B13R1.669 CCCCNc1ccc(c(n1)Br)C 41c7296d3c0f2344644ad6044d76084e [0,2,0,0,0,0|1,0,0]=3 9136 B13R1.669 CCCCNc1ccc(c(n1)Br)Cl 248aaf39e170e9901eacc81f0cba62fb [0,2,0,0,0,0|1,0,0]=3 9137 B13R1.669 CCCCNc1ccc(c(n1)Br)F 8e940ca33471ec1930a7bc0f34247c66 [0,2,0,0,0,0|1,0,0]=3 9138 B13R1.669 CCCCNc1ccc(c(n1)Br)I e44511181276e2b4a7b69d802dc3f9d9 [0,2,0,0,0,0|1,0,0]=3 9139 B13R1.669 CCCCNc1ccc(c(n1)C)Br 14bde52bd3fc828848820b443f24497b [0,2,0,0,0,0|1,0,0]=3 9140 B13R1.669 CCCCNc1ccc(c(n1)C)C b3e183e22ab639e446ac8d2f1d5ccb83 [0,2,0,0,0,0|1,0,0]=3 9141 B13R1.669 CCCCNc1ccc(c(n1)C)Cl 2cc933bc58878946fe6d1acc3d2c7fc4 [0,2,0,0,0,0|1,0,0]=3 9142 B13R1.669 CCCCNc1ccc(c(n1)C)F db9a179eea20251e1b7213b8fbbe2d67 [0,2,0,0,0,0|1,0,0]=3 9143 B13R1.669 CCCCNc1ccc(c(n1)C)I 133e7fcd9896630f37e53f1f25d9a415 [0,2,0,0,0,0|1,0,0]=3 9144 B13R1.669 CCCCNc1ccc(c(n1)Cl)Br b752ca8ab80af0c2a652cad99b63c90a [0,2,0,0,0,0|1,0,0]=3 9145 B13R1.669 CCCCNc1ccc(c(n1)Cl)C ae014eba4e303675d9878eaa54c5ed81 [0,2,0,0,0,0|1,0,0]=3 9146 B13R1.669 CCCCNc1ccc(c(n1)Cl)Cl 2e1c223f6819b82ffd212ff622957a91 [0,2,0,0,0,0|1,0,0]=3 9147 B13R1.669 CCCCNc1ccc(c(n1)Cl)F 2bf4c4b1c1c8758f66d3edbc49fccc92 [0,2,0,0,0,0|1,0,0]=3 9148 B13R1.669 CCCCNc1ccc(c(n1)Cl)I 3c821e43b1358b88116ccd7987134595 [0,2,0,0,0,0|1,0,0]=3 9149 B13R1.669 CCCCNc1ccc(c(n1)F)Br 8610b96a6296d6b1caaff22ab39a0d6a [0,2,0,0,0,0|1,0,0]=3 9150 B13R1.669 CCCCNc1ccc(c(n1)F)C 7588f11a4e36187ba19bd3426501f126 [0,2,0,0,0,0|1,0,0]=3 9151 B13R1.669 CCCCNc1ccc(c(n1)F)Cl 716bfa2824d32602ca861aee6f6ae0a8 [0,2,0,0,0,0|1,0,0]=3 9152 B13R1.669 CCCCNc1ccc(c(n1)F)F 97249dd14aab49e8e9e1ba402d4aad81 [0,2,0,0,0,0|1,0,0]=3 9153 B13R1.669 CCCCNc1ccc(c(n1)F)I 901a1758fa47f788b6b8eb64284243bd [0,2,0,0,0,0|1,0,0]=3 9154 B13R1.669 CCCCNc1ccc(c(n1)I)Br 06f085099ae9c128876b742eafbcce1b [0,2,0,0,0,0|1,0,0]=3 9155 B13R1.669 CCCCNc1ccc(c(n1)I)F 9626533f4a399ec30f932ed34109be7f [0,2,0,0,0,0|1,0,0]=3 9156 B13R1.669 CCCCNc1ccc(c(n1)N)N 42401166947ec2458bbd8efc6ebc4bcc [0,2,0,0,0,0|1,0,0]=3 9157 B13R1.669 CCCCNc1ccn(c(=O)n1)C 44aad5b4e7350e438db57a17dda63240 [0,2,0,0,0,0|2,0,0]=4 9158 B13R1.669 CCCCNc1cnc(c(n1)Br)Br 58c8d5165e80140a4049bf4d31961f79 [0,2,0,0,0,0|2,0,0]=4 9159 B13R1.669 CCCCNc1cnc(c(n1)Br)C 9ca297a09d437702c096b15e24ddfa67 [0,2,0,0,0,0|2,0,0]=4 9160 B13R1.669 CCCCNc1cnc(c(n1)Br)Cl d355055cf822efc2dc395f54f659eafc [0,2,0,0,0,0|2,0,0]=4 9161 B13R1.669 CCCCNc1cnc(c(n1)C)Br b181027dc010e8374bdc4f2c78b7c3b2 [0,2,0,0,0,0|2,0,0]=4 9162 B13R1.669 CCCCNc1cnc(c(n1)C)C cd61c417ddf46f28b241401f956706af [0,2,0,0,0,0|2,0,0]=4 9163 B13R1.669 CCCCNc1cnc(c(n1)C)Cl 8f8cf3302fc0d525584933ce27248f96 [0,2,0,0,0,0|2,0,0]=4 9164 B13R1.669 CCCCNc1cnc(c(n1)Cl)Br 89ed1a3f6fcd11bb92f3c243598400d3 [0,2,0,0,0,0|2,0,0]=4 9165 B13R1.669 CCCCNc1cnc(c(n1)Cl)Cl 6df86907fe168268bd05b4870b8394b9 [0,2,0,0,0,0|2,0,0]=4 9166 B13R1.669 CCCCNc1cnc(c(n1)Cl)F e164d65de8b27a3877120e659444f5e1 [0,2,0,0,0,0|2,0,0]=4 9167 B13R1.669 CCCCNc1cnc(c(n1)Cl)I 0be6457a4a2a152d428f5b02e8e0f31b [0,2,0,0,0,0|2,0,0]=4 9168 B13R1.669 CCCCNc1cnc(c(n1)N)N 90178d8c0b8360c79ae7de5f1232dc12 [0,2,0,0,0,0|2,0,0]=4 9169 B13R1.669 CCCCNc1ncc(c(=O)[nH]1)I 034c91190205833b032595aa81975ac2 [0,2,0,0,0,0|2,0,0]=4 9170 B13R1.669 CCCCNc1ncc(c(n1)Br)C 9dcea42a496dd81b149031cedad41bf8 [0,2,0,0,0,0|2,0,0]=4 9171 B13R1.669 CCCCNc1ncc(c(n1)C)Br 5c9cf25398e3ccf471f1fbaf94992922 [0,2,0,0,0,0|2,0,0]=4 9172 B13R1.669 CCCCNc1ncc(c(n1)C)C 9d2415ea657a0fade7aeab263ed4eb84 [0,2,0,0,0,0|2,0,0]=4 9173 B13R1.669 CCCCNc1ncc(c(n1)C)Cl 32322b84863bc87b7065e83ab49cb304 [0,2,0,0,0,0|2,0,0]=4 9174 B13R1.669 CCCCNc1ncc(c(n1)C)F c61607f992aa9ef75b354582c0952af6 [0,2,0,0,0,0|2,0,0]=4 9175 B13R1.669 CCCCNc1ncc(c(n1)C)I 52ac506cf8fa80e5b64e64ce49da9e7c [0,2,0,0,0,0|2,0,0]=4 9176 B13R1.669 CCCCNc1ncc(c(n1)Cl)Br e2fa04db5f70126080c80a54068dceda [0,2,0,0,0,0|2,0,0]=4 9177 B13R1.669 CCCCNc1ncc(c(n1)Cl)C 21e3a3ee66c0e6be2c82ac4a3b3a860c [0,2,0,0,0,0|2,0,0]=4 9178 B13R1.669 CCCCNc1ncc(c(n1)Cl)Cl fab2a9a3aebfd3d91d2df93e16b18a3b [0,2,0,0,0,0|2,0,0]=4 9179 B13R1.669 CCCCNc1ncc(c(n1)Cl)F 9aea9f400de83bd4b4d201a716d83804 [0,2,0,0,0,0|2,0,0]=4 9180 B13R1.669 CCCCNc1ncc(c(n1)Cl)I be80b06a9a9eb29b10e8641576cfb690 [0,2,0,0,0,0|2,0,0]=4 9181 B13R1.669 CCCCNc1ncc(c(n1)F)Br 9d074e2fb5a3220ba981ea88773463b8 [0,2,0,0,0,0|2,0,0]=4 9182 B13R1.669 CCCCNc1ncc(c(n1)I)Cl fad55f754607a0da14132299464766c5 [0,2,0,0,0,0|2,0,0]=4 9183 B13R1.669 CCCCOc1cc(c(cn1)Br)Br 61383e7d7f7f493a16d2f5d8da49da00 [0,2,0,0,0,0|1,0,0]=3 9184 B13R1.669 CCCCOc1cc(c(cn1)Br)C 7feed7c402954310bdb629b05f21d7e9 [0,2,0,0,0,0|1,0,0]=3 9185 B13R1.669 CCCCOc1cc(c(cn1)Br)Cl 29dde91d72adc143e27ad221d3387919 [0,2,0,0,0,0|1,0,0]=3 9186 B13R1.669 CCCCOc1cc(c(cn1)Br)F b9a169904b5c5119b53747fbfd056050 [0,2,0,0,0,0|1,0,0]=3 9187 B13R1.669 CCCCOc1cc(c(cn1)C)Br e7bdf679ca76466b2783b4fe23fb4960 [0,2,0,0,0,0|1,0,0]=3 9188 B13R1.669 CCCCOc1cc(c(cn1)C)C f0375680a2847802423d799eb8f25ab4 [0,2,0,0,0,0|1,0,0]=3 9189 B13R1.669 CCCCOc1cc(c(cn1)C)I aed6a6e3641626decc19b4e5be2ed475 [0,2,0,0,0,0|1,0,0]=3 9190 B13R1.669 CCCCOc1cc(c(cn1)Cl)Br 715561a60183bd599ed2153aebe9ec0b [0,2,0,0,0,0|1,0,0]=3 9191 B13R1.669 CCCCOc1cc(c(cn1)Cl)C 932686ce1f6d376da14de5c4bf1f7d9e [0,2,0,0,0,0|1,0,0]=3 9192 B13R1.669 CCCCOc1cc(c(cn1)F)Br a98c3a0e7afe7cb41310bd6765b6ec7e [0,2,0,0,0,0|1,0,0]=3 9193 B13R1.669 CCCCOc1cc(c(cn1)F)C e46b70a696b78315ccb655d170110870 [0,2,0,0,0,0|1,0,0]=3 9194 B13R1.669 CCCCOc1cc(c(cn1)F)I 7e91acf7448b85be0453207708221ddf [0,2,0,0,0,0|1,0,0]=3 9195 B13R1.669 CCCCOc1cc(c(cn1)I)C aeb0725ca1034b3658beb617313fc3cc [0,2,0,0,0,0|1,0,0]=3 9196 B13R1.669 CCCCOc1cc(c(cn1)I)Cl f1059296cb97983412838af6ac439e08 [0,2,0,0,0,0|1,0,0]=3 9197 B13R1.669 CCCCOc1ccc(=O)n(n1)C a510ccc12cee0f6cde26f9737baac513 [0,2,0,0,0,0|2,0,0]=4 9198 B13R1.669 CCCCOc1ccc(c(c1)Br)Br ef293b06aaebc033f4f8d17e36dbc96b [0,2,0,0,0,0|2,0,0]=4 9199 B13R1.669 CCCCOc1ccc(c(c1)Br)C b0b1e1eb1222323e549bfd9665dbad63 [0,2,0,0,0,0|2,0,0]=4 9200 B13R1.669 CCCCOc1ccc(c(c1)Br)Cl 069007f5fe4620fec5589ac648512037 [0,2,0,0,0,0|2,0,0]=4 9201 B13R1.669 CCCCOc1ccc(c(c1)Br)F f2fc843a0018ce430448a6ac780c7e51 [0,2,0,0,0,0|2,0,0]=4 9202 B13R1.669 CCCCOc1ccc(c(c1)Br)I 487eb5144760a37b85b59314ea803204 [0,2,0,0,0,0|2,0,0]=4 9203 B13R1.669 CCCCOc1ccc(c(c1)C)Br e4eddf5a98cbff35f2ad11f9a10ddb7b [0,2,0,0,0,0|2,0,0]=4 9204 B13R1.669 CCCCOc1ccc(c(c1)C)C 458f0a7d307b4ce42ea8e402821e7e07 [0,2,0,0,0,0|2,0,0]=4 9205 B13R1.669 CCCCOc1ccc(c(c1)C)Cl f424caa1489e78997f0bc3cb1a256b8e [0,2,0,0,0,0|2,0,0]=4 9206 B13R1.669 CCCCOc1ccc(c(c1)C)F 9ea1ef6b94cb42fcd35d89439f98d52f [0,2,0,0,0,0|2,0,0]=4 9207 B13R1.669 CCCCOc1ccc(c(c1)C)I dba1bb91d511f2e77268dad3a6ff9889 [0,2,0,0,0,0|2,0,0]=4 9208 B13R1.669 CCCCOc1ccc(c(c1)Cl)Br cf7914879bfea4f38b937f76203e2929 [0,2,0,0,0,0|2,0,0]=4 9209 B13R1.669 CCCCOc1ccc(c(c1)Cl)C cafd0f7abe094da7b7a728878d23ab39 [0,2,0,0,0,0|2,0,0]=4 9210 B13R1.669 CCCCOc1ccc(c(c1)Cl)Cl eef6ab8a3b805f6d27eabe0ddc55a583 [0,2,0,0,0,0|2,0,0]=4 9211 B13R1.669 CCCCOc1ccc(c(c1)Cl)F 49fadb2d10acd22ed0fe7582df288562 [0,2,0,0,0,0|2,0,0]=4 9212 B13R1.669 CCCCOc1ccc(c(c1)Cl)I b4c2d10aef4625e6e0bd091a348a957d [0,2,0,0,0,0|2,0,0]=4 9213 B13R1.669 CCCCOc1ccc(c(c1)F)Br 11c9ab1a5350e21aef20e936ef37f6c6 [0,2,0,0,0,0|2,0,0]=4 9214 B13R1.669 CCCCOc1ccc(c(c1)F)C 21c45f0d4777216f35cb495251d594c3 [0,2,0,0,0,0|2,0,0]=4 9215 B13R1.669 CCCCOc1ccc(c(c1)F)Cl 18fdef812cd3c77820730b33690239b7 [0,2,0,0,0,0|2,0,0]=4 9216 B13R1.669 CCCCOc1ccc(c(c1)F)F 480b7dc01125f7a4dc30ef32c4f2a4a7 [0,2,0,0,0,0|2,0,0]=4 9217 B13R1.669 CCCCOc1ccc(c(c1)F)I 3ae70ef57f289cdef83729bc4f11c28d [0,2,0,0,0,0|2,0,0]=4 9218 B13R1.669 CCCCOc1ccc(c(c1)I)Br a2b8402da550cf132e4c79cfacd1f7e2 [0,2,0,0,0,0|2,0,0]=4 9219 B13R1.669 CCCCOc1ccc(c(c1)I)C 9828ebb115d80fe01d24f0e9dab5a062 [0,2,0,0,0,0|2,0,0]=4 9220 B13R1.669 CCCCOc1ccc(c(c1)I)Cl c3085c9062fb0f7557dbc54fb30eb009 [0,2,0,0,0,0|2,0,0]=4 9221 B13R1.669 CCCCOc1ccc(c(c1)I)F 355a52409b05239d0733f219576a2079 [0,2,0,0,0,0|2,0,0]=4 9222 B13R1.669 CCCCOc1ccc(c(n1)Br)C d190cc751521dd17c520585263603688 [0,2,0,0,0,0|1,0,0]=3 9223 B13R1.669 CCCCOc1ccc(c(n1)Br)Cl d93c2f68172f2a8faf8ffb184c4663f0 [0,2,0,0,0,0|1,0,0]=3 9224 B13R1.669 CCCCOc1ccc(c(n1)Br)F 12c528884ac85e8f97196df3b37bc929 [0,2,0,0,0,0|1,0,0]=3 9225 B13R1.669 CCCCOc1ccc(c(n1)C)Br dc265fb7a21f3f759a3c40bcd30d66cb [0,2,0,0,0,0|1,0,0]=3 9226 B13R1.669 CCCCOc1ccc(c(n1)C)Cl c366005dfd029cc3d52142f55b406829 [0,2,0,0,0,0|1,0,0]=3 9227 B13R1.669 CCCCOc1ccc(c(n1)Cl)Br 95f6a12b7f0059244663ccd933da0d9b [0,2,0,0,0,0|1,0,0]=3 9228 B13R1.669 CCCCOc1ccc(c(n1)Cl)Cl 782061f6fa2485504e6224e4215dd00e [0,2,0,0,0,0|1,0,0]=3 9229 B13R1.669 CCCCOc1ccc(c(n1)F)Br 54ade05b5bf9927004e87b1ed9e74a19 [0,2,0,0,0,0|1,0,0]=3 9230 B13R1.669 CCCCOc1ccc(c(n1)F)I c5bc5705d656d67e6aa0bd2d313e18ec [0,2,0,0,0,0|1,0,0]=3 9231 B13R1.669 CCCCOc1cnc(c(n1)C)Br 6400e90bf86bfd96caf5f5eb388355c3 [0,2,0,0,0,0|2,0,0]=4 9232 B13R1.669 CCCCOc1cnc(c(n1)C)C 64016ee5407993ff1dca738c8151d953 [0,2,0,0,0,0|2,0,0]=4 9233 B13R1.669 CCCCOc1cnc(c(n1)Cl)Br 839e2e99549c1f89263546075e52cd43 [0,2,0,0,0,0|2,0,0]=4 9234 B13R1.669 CCCCOc1ncc(c(n1)C)Br 00cc312e2b053274d4a092aab929076d [0,2,0,0,0,0|2,0,0]=4 9235 B13R1.669 CCCNCc1ccc(c(c1)Br)Br 53cb9b7126190ec752fdbe7f41f31e4b [0,2,0,0,0,0|2,0,0]=4 9236 B13R1.669 CCCNCc1ccc(c(c1)Br)C a5e21ae90c3b42d6fe3784bd338ba9f9 [0,2,0,0,0,0|2,0,0]=4 9237 B13R1.669 CCCNCc1ccc(c(c1)Br)Cl 61309abd3d8b3bf68983bd1733c4817a [0,2,0,0,0,0|2,0,0]=4 9238 B13R1.669 CCCNCc1ccc(c(c1)Br)F 9ddbed24b0cfebcad7c600b727a914ac [0,2,0,0,0,0|2,0,0]=4 9239 B13R1.669 CCCNCc1ccc(c(c1)Br)I e701f8edbdea62dbdf99c220dcfe3deb [0,2,0,0,0,0|2,0,0]=4 9240 B13R1.669 CCCNCc1ccc(c(c1)C)Br 3b83819d377dc5038e06193573f23ec8 [0,2,0,0,0,0|2,0,0]=4 9241 B13R1.669 CCCNCc1ccc(c(c1)C)C 12392712e9d7cc41026ec5b19504b4eb [0,2,0,0,0,0|2,0,0]=4 9242 B13R1.669 CCCNCc1ccc(c(c1)C)Cl 8036db6c40df1ad6109e8fa1ad3c91ce [0,2,0,0,0,0|2,0,0]=4 9243 B13R1.669 CCCNCc1ccc(c(c1)C)F aa086e4d1fe5a404606eb9381ba145fb [0,2,0,0,0,0|2,0,0]=4 9244 B13R1.669 CCCNCc1ccc(c(c1)C)I fd83fbf585301402ae434adde031919c [0,2,0,0,0,0|2,0,0]=4 9245 B13R1.669 CCCNCc1ccc(c(c1)Cl)Br c5a5d3695d7016291bf89f499432efb5 [0,2,0,0,0,0|2,0,0]=4 9246 B13R1.669 CCCNCc1ccc(c(c1)Cl)C b9f67d377d49a16cc90e5f1c63b55bdd [0,2,0,0,0,0|2,0,0]=4 9247 B13R1.669 CCCNCc1ccc(c(c1)Cl)Cl d07d294c275399d124aa042fa64db980 [0,2,0,0,0,0|2,0,0]=4 9248 B13R1.669 CCCNCc1ccc(c(c1)Cl)F df34154d1c5887022c9a9880fa5fb8a8 [0,2,0,0,0,0|2,0,0]=4 9249 B13R1.669 CCCNCc1ccc(c(c1)Cl)I 5112ec3cc508506b16279f5ccb52f7c2 [0,2,0,0,0,0|2,0,0]=4 9250 B13R1.669 CCCNCc1ccc(c(c1)F)Br ff870e5408409996363a85122ccdc7e8 [0,2,0,0,0,0|2,0,0]=4 9251 B13R1.669 CCCNCc1ccc(c(c1)F)C b268eaa23e1282048ac8e390ccdcb886 [0,2,0,0,0,0|2,0,0]=4 9252 B13R1.669 CCCNCc1ccc(c(c1)F)Cl b1fbf05a71d54aab68d54afc0e7da3f7 [0,2,0,0,0,0|2,0,0]=4 9253 B13R1.669 CCCNCc1ccc(c(c1)F)F df231031af87557336c160743b037eec [0,2,0,0,0,0|2,0,0]=4 9254 B13R1.669 CCCNCc1ccc(c(c1)F)I 427f1f04fe81de0cd8d3f0af73b4b19c [0,2,0,0,0,0|2,0,0]=4 9255 B13R1.669 CCCNCc1ccc(c(c1)I)Br 531640a988ef4f2c675504ed82535a3f [0,2,0,0,0,0|2,0,0]=4 9256 B13R1.669 CCCNCc1ccc(c(c1)I)C 28e0ce2bd3f3a7856c10dee146878da8 [0,2,0,0,0,0|2,0,0]=4 9257 B13R1.669 CCCNCc1ccc(c(c1)I)Cl 169998a932ea3587da9d31914f373fca [0,2,0,0,0,0|2,0,0]=4 9258 B13R1.669 CCCNCc1ccc(c(c1)I)F 06d336b0e1c993489be1e83112b15349 [0,2,0,0,0,0|2,0,0]=4 9259 B13R1.669 CCCNCc1ccc(c(n1)Br)F d1099be85686787b0695fe74473b2cbb [0,2,0,0,0,0|1,0,0]=3 9260 B13R1.669 CCCNCc1ccc(c(n1)Cl)Cl a23dce04d37e3b15d5c3bf2c5dd9e93a [0,2,0,0,0,0|1,0,0]=3 9261 B13R1.669 CCCNCc1cnc(c(n1)C)C 31716bfa58e2dcb2c64d8a84366380de [0,2,0,0,0,0|2,0,0]=4 9262 B13R1.669 CCCNCc1cnc(c(n1)C)Cl b36a365c1319f54c83989b7cded7ae62 [0,2,0,0,0,0|2,0,0]=4 9263 B13R1.669 CCCNCc1ncc(c(n1)Cl)C 87a304b036c83cfa9f6f419b2b3fb235 [0,2,0,0,0,0|2,0,0]=4 9264 B13R1.669 CCCNCc1ncc(c(n1)Cl)F 2262d435b7e61318995e486c0fc9fafb [0,2,0,0,0,0|2,0,0]=4 9265 B13R1.669 CCCOCc1cc(c(cn1)Br)Br 09633bda5f8baf8831126e16e13723cd [0,2,0,0,0,0|1,0,0]=3 9266 B13R1.669 CCCOCc1cc(c(cn1)Br)C f7b5c11c9911248b543678bcaad4d460 [0,2,0,0,0,0|1,0,0]=3 9267 B13R1.669 CCCOCc1cc(c(cn1)Br)Cl 72890cd37ab37b8044d606617fc4b555 [0,2,0,0,0,0|1,0,0]=3 9268 B13R1.669 CCCOCc1cc(c(cn1)C)Br 181efbc519da2d594e4d8aec780c0208 [0,2,0,0,0,0|1,0,0]=3 9269 B13R1.669 CCCOCc1cc(c(cn1)C)C d50114f15ec14b29538d35d6bd23c5c1 [0,2,0,0,0,0|1,0,0]=3 9270 B13R1.669 CCCOCc1cc(c(cn1)C)Cl 72da4e8d64cdd1b8134cea2c7664382f [0,2,0,0,0,0|1,0,0]=3 9271 B13R1.669 CCCOCc1cc(c(cn1)Cl)Cl 9e3c4b03753f5c02f7d0dfb66c9ee107 [0,2,0,0,0,0|1,0,0]=3 9272 B13R1.669 CCCOCc1cc(c(cn1)F)Br ca901cd6422b288b0328f40698322c92 [0,2,0,0,0,0|1,0,0]=3 9273 B13R1.669 CCCOCc1cc(c(cn1)F)C c6835219881c6b913ee3982fd730249b [0,2,0,0,0,0|1,0,0]=3 9274 B13R1.669 CCCOCc1cc(c(cn1)F)Cl 71ee96fa350f05a5a9678fc023de2e11 [0,2,0,0,0,0|1,0,0]=3 9275 B13R1.669 CCCOCc1ccc(c(c1)Br)Br c2ab296d85745b3135d5a503bd66e716 [0,2,0,0,0,0|2,0,0]=4 9276 B13R1.669 CCCOCc1ccc(c(c1)Br)C b09107a1e21b08d427ffa6b8df969947 [0,2,0,0,0,0|2,0,0]=4 9277 B13R1.669 CCCOCc1ccc(c(c1)Br)Cl fa9abcafc47e47784ad140a2e1ca3e29 [0,2,0,0,0,0|2,0,0]=4 9278 B13R1.669 CCCOCc1ccc(c(c1)Br)F f1f606c4e58617e834fd3ebc6c8f4052 [0,2,0,0,0,0|2,0,0]=4 9279 B13R1.669 CCCOCc1ccc(c(c1)Br)I e943599e8b83bfb15a770cc83fa0b312 [0,2,0,0,0,0|2,0,0]=4 9280 B13R1.669 CCCOCc1ccc(c(c1)C)Br e0a8f83ee3d8883e40bf67f5c38dce15 [0,2,0,0,0,0|2,0,0]=4 9281 B13R1.669 CCCOCc1ccc(c(c1)C)C beb03a9604f87d45dd61d123204e3dc2 [0,2,0,0,0,0|2,0,0]=4 9282 B13R1.669 CCCOCc1ccc(c(c1)C)Cl aa82541f9c3bbf1df2639dd1d424e930 [0,2,0,0,0,0|2,0,0]=4 9283 B13R1.669 CCCOCc1ccc(c(c1)C)F e7bd3fcab27cab835d701f9f99f013d1 [0,2,0,0,0,0|2,0,0]=4 9284 B13R1.669 CCCOCc1ccc(c(c1)C)I 483ba17e1fe72a15e2a0c15057fe3c05 [0,2,0,0,0,0|2,0,0]=4 9285 B13R1.669 CCCOCc1ccc(c(c1)Cl)Br 8826c13df3263e7b2504e57facd5dfaf [0,2,0,0,0,0|2,0,0]=4 9286 B13R1.669 CCCOCc1ccc(c(c1)Cl)C 5e208e4454747a82cf2ac8b5dc941ac3 [0,2,0,0,0,0|2,0,0]=4 9287 B13R1.669 CCCOCc1ccc(c(c1)Cl)Cl 202b3d6590f130ca6e47936a2a4c01e1 [0,2,0,0,0,0|2,0,0]=4 9288 B13R1.669 CCCOCc1ccc(c(c1)Cl)F fe4338ee04b5b540e8a276f099aff051 [0,2,0,0,0,0|2,0,0]=4 9289 B13R1.669 CCCOCc1ccc(c(c1)Cl)I 9269f2273d9d3a02519c49de5b2a5288 [0,2,0,0,0,0|2,0,0]=4 9290 B13R1.669 CCCOCc1ccc(c(c1)F)Br 606126a2ba61c6dcf4f99772303fc4b2 [0,2,0,0,0,0|2,0,0]=4 9291 B13R1.669 CCCOCc1ccc(c(c1)F)C 49b20381ac08a92c4ca543f676a54f8c [0,2,0,0,0,0|2,0,0]=4 9292 B13R1.669 CCCOCc1ccc(c(c1)F)Cl db276aca74dcd1ff0c09cb843823ba64 [0,2,0,0,0,0|2,0,0]=4 9293 B13R1.669 CCCOCc1ccc(c(c1)F)F 25e69e13067f21bc13abcdbf1501493b [0,2,0,0,0,0|2,0,0]=4 9294 B13R1.669 CCCOCc1ccc(c(c1)F)I bf1820804f0131a2c1522079a642e88d [0,2,0,0,0,0|2,0,0]=4 9295 B13R1.669 CCCOCc1ccc(c(c1)I)Br 8fb82744c2cf9bb1dc4ad326500d1769 [0,2,0,0,0,0|2,0,0]=4 9296 B13R1.669 CCCOCc1ccc(c(c1)I)C 50a7b90b9ea0e2f8205c715126f378df [0,2,0,0,0,0|2,0,0]=4 9297 B13R1.669 CCCOCc1ccc(c(c1)I)Cl 098407904f7dbdc7b918f4b67ac811bf [0,2,0,0,0,0|2,0,0]=4 9298 B13R1.669 CCCOCc1ccc(c(c1)I)F 10bd70f84a01edb0ac67a26986d6d277 [0,2,0,0,0,0|2,0,0]=4 9299 B13R1.669 CCCOCc1ccc(c(n1)Br)Cl 6289bc1e600ea984f4a3e71d2ba471ca [0,2,0,0,0,0|1,0,0]=3 9300 B13R1.669 CCCOCc1ccc(c(n1)Br)F 3e94c3a56eb236c9a3b4396b3db2ad95 [0,2,0,0,0,0|1,0,0]=3 9301 B13R1.669 CCCOCc1ccc(c(n1)C)Cl aa1796cc708ba62f8b4e3adef82382cb [0,2,0,0,0,0|1,0,0]=3 9302 B13R1.669 CCCOCc1ccc(c(n1)C)F c5621aac6a8dd4564143aa553ff1d380 [0,2,0,0,0,0|1,0,0]=3 9303 B13R1.669 CCCOCc1ccc(c(n1)Cl)Cl 1191a4a956a16c176bfc6ae42a100638 [0,2,0,0,0,0|1,0,0]=3 9304 B13R1.669 CCCOCc1cnc(c(n1)C)C f2c55f95632b94c6a4eaa9c55db6468c [0,2,0,0,0,0|2,0,0]=4 9305 B13R1.669 CCCOCc1ncc(c(n1)Cl)F 0a605b4e0197880f04dfa67076c7fa95 [0,2,0,0,0,0|2,0,0]=4 9306 B13R1.669 CCNCCc1ccc(c(c1)C)Br c3363ceb852cf1bf416e7f25db5945b1 [0,2,0,0,0,0|2,0,0]=4 9307 B13R1.669 CCNCCc1ccc(c(c1)C)C 0c03e593303143e1a43af5e886017b0d [0,2,0,0,0,0|2,0,0]=4 9308 B13R1.669 CCNCCc1ccc(c(c1)Cl)Cl e70724ecd505b049612e8fcd4398e873 [0,2,0,0,0,0|2,0,0]=4 9309 B13R1.669 CCNCCc1ccc(c(c1)Cl)F 754bd52d552483ddcf492629c0337bb8 [0,2,0,0,0,0|2,0,0]=4 9310 B13R1.669 CCNCCc1ccc(c(c1)F)Cl 536dd901f96aba03b1ba87e9cd490fa8 [0,2,0,0,0,0|2,0,0]=4 9311 B13R1.669 CCNCCc1ccc(c(c1)F)F b11ff4f56221cadc729e3f028696c2ce [0,2,0,0,0,0|2,0,0]=4 9312 B13R1.669 CCOCCc1ccc(c(c1)Br)F 76ea6edf2180eef168708d915e179fc7 [0,2,0,0,0,0|2,0,0]=4 9313 B13R1.669 CCOCCc1ccc(c(c1)C)Br f1e982beb09f3c26082eec1c9d4dc9c5 [0,2,0,0,0,0|2,0,0]=4 9314 B13R1.669 CCOCCc1ccc(c(c1)C)C d7d772964bc7e77b1695a4830403f7bc [0,2,0,0,0,0|2,0,0]=4 9315 B13R1.669 CCOCCc1ccc(c(c1)Cl)Cl 8ee3b6077a4ac66f03a2f7ae1a61d4fb [0,2,0,0,0,0|2,0,0]=4 9316 B13R1.669 CCOCCc1ccc(c(c1)Cl)F 0649ef561b4d2bc599100f4f478981da [0,2,0,0,0,0|2,0,0]=4 9317 B13R1.669 CCOCCc1ccc(c(c1)F)Br 325fdb5789cccbe9f180c07fafbfba20 [0,2,0,0,0,0|2,0,0]=4 9318 B13R1.669 CCOCCc1ccc(c(c1)F)Cl 8c4f148e55ec994e7c6a2981fd3abdda [0,2,0,0,0,0|2,0,0]=4 9319 B13R1.669 CCOCCc1ccc(c(c1)F)F cfcc8da5b7f155cb2133bbbea55100de [0,2,0,0,0,0|2,0,0]=4 9320 B13R1.669 CCOCCc1ccc(c(n1)C)F 2563c0f4749eb85d1142ca50d972dafb [0,2,0,0,0,0|1,0,0]=3 9321 B13R1.669 CCOCNc1cc(c(cn1)Br)Cl 67fe41c6b9414a110538c4eca85b01d7 [0,2,0,0,0,0|2,0,0]=4 9322 B13R1.669 CCOCNc1cc(c(cn1)C)Cl 9077443d3780868d49ec11c03c519348 [0,2,0,0,0,0|2,0,0]=4 9323 B13R1.669 CCOCNc1cc(c(cn1)C)F 06310f9b225b2b41025ac8e08c4d1943 [0,2,0,0,0,0|2,0,0]=4 9324 B13R1.669 CCOCNc1cc(c(cn1)C)I d54b697489e56b08efaffbff650f674f [0,2,0,0,0,0|2,0,0]=4 9325 B13R1.669 CCOCNc1cc(c(cn1)Cl)Cl a991a392be73377ecc73751f1004b6b0 [0,2,0,0,0,0|2,0,0]=4 9326 B13R1.669 CCOCNc1cc(c(cn1)Cl)I 5f0bb376035f8dccf1dcbc516f317a82 [0,2,0,0,0,0|2,0,0]=4 9327 B13R1.669 CCOCNc1cc(c(cn1)F)Cl 80ff087e5b8bc27dbfa916dc32af6df9 [0,2,0,0,0,0|2,0,0]=4 9328 B13R1.669 CCOCNc1cc(c(cn1)F)F ae96b5fc55ffec20e0879660681fb562 [0,2,0,0,0,0|2,0,0]=4 9329 B13R1.669 CCOCNc1cc(c(cn1)F)I 6fadecfb8d9c46ff559132fe65646365 [0,2,0,0,0,0|2,0,0]=4 9330 B13R1.669 CCOCNc1ccc(c(n1)Br)Cl 680c1a53d34f1cfefd92f081c96527cd [0,2,0,0,0,0|2,0,0]=4 9331 B13R1.669 CCOCNc1ccc(c(n1)Cl)C c5889989cb4ffffa0d65f7f949d7921b [0,2,0,0,0,0|2,0,0]=4 9332 B13R1.669 CCOCNc1ccc(c(n1)Cl)Cl 6d5d4e54388b8872ef689029a40dfb56 [0,2,0,0,0,0|2,0,0]=4 9333 B13R1.669 CCOCNc1ccc(c(n1)F)C ef6d0103217905532f07bc4da30fca18 [0,2,0,0,0,0|2,0,0]=4 9334 B13R1.669 CCOCOc1cc(c(cn1)Br)Cl 0c82868d657b50729f87f05f1c903284 [0,2,0,0,0,0|2,0,0]=4 9335 B13R1.669 CCOCOc1cc(c(cn1)F)C 3956fadca736ccc609dc79fa3b464733 [0,2,0,0,0,0|2,0,0]=4 9336 B13R1.669 CCOCOc1cc(c(cn1)F)I d96c4e7ac4d05b08bfbb93893791a1b0 [0,2,0,0,0,0|2,0,0]=4 9337 B13R1.669 COCCNc1cc(c(cn1)Br)Br 29cd63ad1785eb01d8297cd47c96858c [0,2,0,0,0,0|2,0,0]=4 9338 B13R1.669 COCCNc1cc(c(cn1)Br)C 88bd800ffad8cc86515e0c6b87f71e3e [0,2,0,0,0,0|2,0,0]=4 9339 B13R1.669 COCCNc1cc(c(cn1)Br)Cl 5698160a3af6a7a593b081fcfc76f45f [0,2,0,0,0,0|2,0,0]=4 9340 B13R1.669 COCCNc1cc(c(cn1)Br)F ba292f2a9f049f705c7628df678d80e8 [0,2,0,0,0,0|2,0,0]=4 9341 B13R1.669 COCCNc1cc(c(cn1)C)Br 84d617130e49a57c2e6ab3a07fad8c6e [0,2,0,0,0,0|2,0,0]=4 9342 B13R1.669 COCCNc1cc(c(cn1)C)C b7d71fe629c3e4e1338e629988c6e2cb [0,2,0,0,0,0|2,0,0]=4 9343 B13R1.669 COCCNc1cc(c(cn1)C)Cl a67e653b2ba2d309a42a442088324265 [0,2,0,0,0,0|2,0,0]=4 9344 B13R1.669 COCCNc1cc(c(cn1)C)F b03394cffc82dc807f1595feb028e471 [0,2,0,0,0,0|2,0,0]=4 9345 B13R1.669 COCCNc1cc(c(cn1)C)I 649a09c40734ae554f024ec1835410a5 [0,2,0,0,0,0|2,0,0]=4 9346 B13R1.669 COCCNc1cc(c(cn1)Cl)Br 18a420fdb0ccec35093a8338328ad780 [0,2,0,0,0,0|2,0,0]=4 9347 B13R1.669 COCCNc1cc(c(cn1)Cl)C c95a2752d94e5ceb7c4d2709279eedff [0,2,0,0,0,0|2,0,0]=4 9348 B13R1.669 COCCNc1cc(c(cn1)Cl)Cl c3b290f710bb73f7d6757c57064b1592 [0,2,0,0,0,0|2,0,0]=4 9349 B13R1.669 COCCNc1cc(c(cn1)Cl)F ba87a2c6248e39a4257264d57593f83a [0,2,0,0,0,0|2,0,0]=4 9350 B13R1.669 COCCNc1cc(c(cn1)Cl)I 0b2ed959eb32e7e2d42c636adaf90715 [0,2,0,0,0,0|2,0,0]=4 9351 B13R1.669 COCCNc1cc(c(cn1)F)Br da63e4dbf1c1e09f051c9c4a3504e685 [0,2,0,0,0,0|2,0,0]=4 9352 B13R1.669 COCCNc1cc(c(cn1)F)C d2af21417d052420499fb2ef23ed8096 [0,2,0,0,0,0|2,0,0]=4 9353 B13R1.669 COCCNc1cc(c(cn1)F)Cl 1a21c6718f8a98afdb4c419afc6f09c5 [0,2,0,0,0,0|2,0,0]=4 9354 B13R1.669 COCCNc1cc(c(cn1)F)F 1a1eb94ccbacdf3daef46adff87f9241 [0,2,0,0,0,0|2,0,0]=4 9355 B13R1.669 COCCNc1cc(c(cn1)F)I 4aa8671560d9bb389f33d14b72204bd0 [0,2,0,0,0,0|2,0,0]=4 9356 B13R1.669 COCCNc1cc(c(cn1)I)Br 04eb56b225e7064e0fc6eb4a6339a483 [0,2,0,0,0,0|2,0,0]=4 9357 B13R1.669 COCCNc1cc(c(cn1)I)C 0f8f5a394a2f7b1967356e8247e88bea [0,2,0,0,0,0|2,0,0]=4 9358 B13R1.669 COCCNc1cc(c(cn1)I)Cl 929d75d958e4a96664ace3ac4a254019 [0,2,0,0,0,0|2,0,0]=4 9359 B13R1.669 COCCNc1cc(c(cn1)I)F 5e682ddbf3c62b19da13d71816cab130 [0,2,0,0,0,0|2,0,0]=4 9360 B13R1.669 COCCNc1cc(c(cn1)N)N 5f53acccd5d0b949592652eca78568a4 [0,2,0,0,0,0|2,0,0]=4 9361 B13R1.669 COCCNc1ccc(c(n1)Br)Br bb505a58c44a1df76e9067a5b344c01e [0,2,0,0,0,0|2,0,0]=4 9362 B13R1.669 COCCNc1ccc(c(n1)Br)C 7baf28d7bb07cbc7527cc7f64db35e68 [0,2,0,0,0,0|2,0,0]=4 9363 B13R1.669 COCCNc1ccc(c(n1)Br)Cl d7cffd2d21dfea84348e68501bd2785e [0,2,0,0,0,0|2,0,0]=4 9364 B13R1.669 COCCNc1ccc(c(n1)Br)F 6375017c7c817f1ca701c60c306a951a [0,2,0,0,0,0|2,0,0]=4 9365 B13R1.669 COCCNc1ccc(c(n1)Br)I d1ea10797a7b13c5605a6049590b8510 [0,2,0,0,0,0|2,0,0]=4 9366 B13R1.669 COCCNc1ccc(c(n1)C)Br ce6f932979eb5635edb5d274269a2b36 [0,2,0,0,0,0|2,0,0]=4 9367 B13R1.669 COCCNc1ccc(c(n1)C)C b8241bf8ef390b42b7f4a8de3e4cbb9b [0,2,0,0,0,0|2,0,0]=4 9368 B13R1.669 COCCNc1ccc(c(n1)C)Cl ea7e4c8f8c1496e2cb25b6d2816cb159 [0,2,0,0,0,0|2,0,0]=4 9369 B13R1.669 COCCNc1ccc(c(n1)C)F 829e900ebf3a0c211729cd21be37f359 [0,2,0,0,0,0|2,0,0]=4 9370 B13R1.669 COCCNc1ccc(c(n1)C)I ab736d5930f0ef9ac7114ea041e87529 [0,2,0,0,0,0|2,0,0]=4 9371 B13R1.669 COCCNc1ccc(c(n1)Cl)Br 06cc9560768815c82494b6f43312fa3f [0,2,0,0,0,0|2,0,0]=4 9372 B13R1.669 COCCNc1ccc(c(n1)Cl)C b6e08c1f4665e837e0a5a502534af57d [0,2,0,0,0,0|2,0,0]=4 9373 B13R1.669 COCCNc1ccc(c(n1)Cl)Cl d5f8bf42b7c2a81d2e52902c79d37de1 [0,2,0,0,0,0|2,0,0]=4 9374 B13R1.669 COCCNc1ccc(c(n1)Cl)F d09ea628e15e5638748e6b09ebb19c65 [0,2,0,0,0,0|2,0,0]=4 9375 B13R1.669 COCCNc1ccc(c(n1)Cl)I deac167e50178ae1397961c5ea66631f [0,2,0,0,0,0|2,0,0]=4 9376 B13R1.669 COCCNc1ccc(c(n1)F)Br efd047c507b89b57278ccbc63d27ab4d [0,2,0,0,0,0|2,0,0]=4 9377 B13R1.669 COCCNc1ccc(c(n1)F)C 5d62d7feb245f2635b9148bad85b19a7 [0,2,0,0,0,0|2,0,0]=4 9378 B13R1.669 COCCNc1ccc(c(n1)F)Cl c18efa81792ec2425c4c885ce4c78e66 [0,2,0,0,0,0|2,0,0]=4 9379 B13R1.669 COCCNc1ccc(c(n1)F)F 854e36928237930c3bf25f7403b26d81 [0,2,0,0,0,0|2,0,0]=4 9380 B13R1.669 COCCNc1ccc(c(n1)F)I 9feb34cac1edc921fc8ce85a7e148277 [0,2,0,0,0,0|2,0,0]=4 9381 B13R1.669 COCCNc1ccc(c(n1)I)Br 3008c13c0f93bdf29ab6a11ecd5ce6c5 [0,2,0,0,0,0|2,0,0]=4 9382 B13R1.669 COCCNc1ccc(c(n1)I)F f015809f0d7526973b0197ae2d8d8008 [0,2,0,0,0,0|2,0,0]=4 9383 B13R1.669 COCCNc1ccc(c(n1)N)N ffe193f9efe10175824f5f5cc50c1e7e [0,2,0,0,0,0|2,0,0]=4 9384 B13R1.669 COCCOc1cc(c(cn1)Br)Br 267789086a2580cb17a0149204dd49f8 [0,2,0,0,0,0|2,0,0]=4 9385 B13R1.669 COCCOc1cc(c(cn1)Br)C 1e20933527dc4d2a424022f7c4526e00 [0,2,0,0,0,0|2,0,0]=4 9386 B13R1.669 COCCOc1cc(c(cn1)Br)Cl f3a9f3ba70c701d3f4a662c3f2f7f8dc [0,2,0,0,0,0|2,0,0]=4 9387 B13R1.669 COCCOc1cc(c(cn1)Br)F 53d53957f75d8398547e30354ff20920 [0,2,0,0,0,0|2,0,0]=4 9388 B13R1.669 COCCOc1cc(c(cn1)C)Br fd8fd54b89fe42a470a44bcea6ff2873 [0,2,0,0,0,0|2,0,0]=4 9389 B13R1.669 COCCOc1cc(c(cn1)C)C 7b1dbe352b7e7d08dd471e2cce46c17e [0,2,0,0,0,0|2,0,0]=4 9390 B13R1.669 COCCOc1cc(c(cn1)C)I af7fca412a836c6746b679042f2030fd [0,2,0,0,0,0|2,0,0]=4 9391 B13R1.669 COCCOc1cc(c(cn1)Cl)Br 28b45616d9402991333be94778f8da2e [0,2,0,0,0,0|2,0,0]=4 9392 B13R1.669 COCCOc1cc(c(cn1)Cl)C 8026ffcea8d38c56633b4a388adb0175 [0,2,0,0,0,0|2,0,0]=4 9393 B13R1.669 COCCOc1cc(c(cn1)F)Br 922488b12e83cc37ca8fa34ed3e9b146 [0,2,0,0,0,0|2,0,0]=4 9394 B13R1.669 COCCOc1cc(c(cn1)F)C 740f4f3a0d04e6e5fbe8489e63455b27 [0,2,0,0,0,0|2,0,0]=4 9395 B13R1.669 COCCOc1cc(c(cn1)F)I 82e3cc86b2757f0f4ae9afcdf7b359f7 [0,2,0,0,0,0|2,0,0]=4 9396 B13R1.669 COCCOc1cc(c(cn1)I)C 35e5667f6ebc57a503598c86ecda24d3 [0,2,0,0,0,0|2,0,0]=4 9397 B13R1.669 COCCOc1cc(c(cn1)I)Cl 8d70ce11c4748835be1721d75ea573c3 [0,2,0,0,0,0|2,0,0]=4 9398 B13R1.669 COCCOc1ccc(c(n1)Br)Br 93273c60c9e7d160ad5a8d2568f34e0d [0,2,0,0,0,0|2,0,0]=4 9399 B13R1.669 COCCOc1ccc(c(n1)Br)C b076835f351ce90ebe161b963c3171f6 [0,2,0,0,0,0|2,0,0]=4 9400 B13R1.669 COCCOc1ccc(c(n1)Br)Cl 01e0d5c50cec6e4f63401181bca421f0 [0,2,0,0,0,0|2,0,0]=4 9401 B13R1.669 COCCOc1ccc(c(n1)Br)F b6018d51729bde4ec659875e8b90d0fc [0,2,0,0,0,0|2,0,0]=4 9402 B13R1.669 COCCOc1ccc(c(n1)C)Br 355b20562ba636e4a9cee47f22a02ae0 [0,2,0,0,0,0|2,0,0]=4 9403 B13R1.669 COCCOc1ccc(c(n1)C)Cl 6dfba1aec24ee513a47c8ff7ca13d55f [0,2,0,0,0,0|2,0,0]=4 9404 B13R1.669 COCCOc1ccc(c(n1)Cl)Br 81478280050509a7036b377c17aede63 [0,2,0,0,0,0|2,0,0]=4 9405 B13R1.669 COCCOc1ccc(c(n1)Cl)Cl df9bb3b686ace33eba50f5439e5a0dda [0,2,0,0,0,0|2,0,0]=4 9406 B13R1.669 COCCOc1ccc(c(n1)F)Br 72096474035b2c83b709b4bee6438278 [0,2,0,0,0,0|2,0,0]=4 9407 B13R1.669 COCCOc1ccc(c(n1)F)I 5d9044d16f8ae3cf455b4f9f5fbe5c09 [0,2,0,0,0,0|2,0,0]=4 9408 B13R1.669 COCNCc1ccc(c(n1)Cl)Cl 6f20dd5ab163791c2234802b20b3d021 [0,2,0,0,0,0|2,0,0]=4 9409 B13R1.669 COCOCc1cc(c(cn1)Br)Br 1b3f0ccb9c0f328f2845e08112b35ce3 [0,2,0,0,0,0|2,0,0]=4 9410 B13R1.669 COCOCc1cc(c(cn1)Br)C fae71d60061df8a4abbc90cafeff3bb7 [0,2,0,0,0,0|2,0,0]=4 9411 B13R1.669 COCOCc1cc(c(cn1)Br)Cl fa3c7a2ca0565a2569262cd3ebb28845 [0,2,0,0,0,0|2,0,0]=4 9412 B13R1.669 COCOCc1cc(c(cn1)C)Br d86f0100c14971f40e51de2d1b42e96f [0,2,0,0,0,0|2,0,0]=4 9413 B13R1.669 COCOCc1cc(c(cn1)C)C 7e76980aac7defa2cc8fe3c5ef6e4a0b [0,2,0,0,0,0|2,0,0]=4 9414 B13R1.669 COCOCc1cc(c(cn1)C)Cl b9c58364bba851f1019caa5e93e3879a [0,2,0,0,0,0|2,0,0]=4 9415 B13R1.669 COCOCc1cc(c(cn1)Cl)Cl 5da6e4fc5069e0cc4d62ddf75cd3211f [0,2,0,0,0,0|2,0,0]=4 9416 B13R1.669 COCOCc1cc(c(cn1)F)Br 76fc28b20ac772401f1e18c79cd93c0f [0,2,0,0,0,0|2,0,0]=4 9417 B13R1.669 COCOCc1cc(c(cn1)F)C a172991790f597a6cbeb2f297e5971ba [0,2,0,0,0,0|2,0,0]=4 9418 B13R1.669 COCOCc1cc(c(cn1)F)Cl a8904ca632acebe5998f0512c4ad52d3 [0,2,0,0,0,0|2,0,0]=4 9419 B13R1.669 COCOCc1ccc(c(n1)Br)Cl 2562900147db5889e20b23060353ff1d [0,2,0,0,0,0|2,0,0]=4 9420 B13R1.669 COCOCc1ccc(c(n1)Br)F 8bd6c9bb0df34b8dfeb5936328ef6d23 [0,2,0,0,0,0|2,0,0]=4 9421 B13R1.669 COCOCc1ccc(c(n1)C)Br 45ef3f64f0f0fd7732acfd509dc989c0 [0,2,0,0,0,0|2,0,0]=4 9422 B13R1.669 COCOCc1ccc(c(n1)C)Cl c9efab5236615843b6cf235de3b0dc70 [0,2,0,0,0,0|2,0,0]=4 9423 B13R1.669 COCOCc1ccc(c(n1)C)F 4fa4e8d25ef02c20dc1157dae7b50e66 [0,2,0,0,0,0|2,0,0]=4 9424 B13R1.669 COCOCc1ccc(c(n1)Cl)Br 01fc13a9cf83cfd99d5dba69ed519da4 [0,2,0,0,0,0|2,0,0]=4 9425 B13R1.669 COCOCc1ccc(c(n1)Cl)Cl 4e35e6151df0bea0ad82226b942991c7 [0,2,0,0,0,0|2,0,0]=4 9426 B13R1.669 CSCCNc1cc(c(cn1)Br)Br 95f132e5952f00d6d8df067dcc8ea8d6 [0,2,0,0,0,0|2,0,0]=4 9427 B13R1.669 CSCCNc1cc(c(cn1)Br)C 1e018b83bba9bd323b888b71cbde385a [0,2,0,0,0,0|2,0,0]=4 9428 B13R1.669 CSCCNc1cc(c(cn1)Br)Cl ec3ec9d13ff398c6b7d5009afc996d31 [0,2,0,0,0,0|2,0,0]=4 9429 B13R1.669 CSCCNc1cc(c(cn1)Br)F 54dd3191bd61be7a583f042b32055e47 [0,2,0,0,0,0|2,0,0]=4 9430 B13R1.669 CSCCNc1cc(c(cn1)C)Br 25416baeb593c08e8d1a95f8f2bb9431 [0,2,0,0,0,0|2,0,0]=4 9431 B13R1.669 CSCCNc1cc(c(cn1)C)C 3bc4f5d62eaafc11ab57a10fe65a9127 [0,2,0,0,0,0|2,0,0]=4 9432 B13R1.669 CSCCNc1cc(c(cn1)C)Cl 0b35301e77730ed5f2b93ecd6c2c91c1 [0,2,0,0,0,0|2,0,0]=4 9433 B13R1.669 CSCCNc1cc(c(cn1)C)F e4dc5bd34fbbc6d21f7d1fbbb0c6f737 [0,2,0,0,0,0|2,0,0]=4 9434 B13R1.669 CSCCNc1cc(c(cn1)C)I 035cb4ba1a18e11462ed5b5cee02fa31 [0,2,0,0,0,0|2,0,0]=4 9435 B13R1.669 CSCCNc1cc(c(cn1)Cl)Br b0fc2618d6cdd2edc344afd58546d155 [0,2,0,0,0,0|2,0,0]=4 9436 B13R1.669 CSCCNc1cc(c(cn1)Cl)C 55e38f53d5afd3188e50ec816519bc65 [0,2,0,0,0,0|2,0,0]=4 9437 B13R1.669 CSCCNc1cc(c(cn1)Cl)Cl 7f3667307fd968f29fcf60a76d9d2f40 [0,2,0,0,0,0|2,0,0]=4 9438 B13R1.669 CSCCNc1cc(c(cn1)Cl)F 2c79ad2ae43534ee15a4ff490a9a74c3 [0,2,0,0,0,0|2,0,0]=4 9439 B13R1.669 CSCCNc1cc(c(cn1)Cl)I 7d83b6d88b01edad2156cf1be0eaac01 [0,2,0,0,0,0|2,0,0]=4 9440 B13R1.669 CSCCNc1cc(c(cn1)F)Br a0dfbae59f599e989ee7bd1b949c68a9 [0,2,0,0,0,0|2,0,0]=4 9441 B13R1.669 CSCCNc1cc(c(cn1)F)C 42d1334be0276d2614350ac0324d9bea [0,2,0,0,0,0|2,0,0]=4 9442 B13R1.669 CSCCNc1cc(c(cn1)F)Cl 777ef6a1ed2d3d4155726ed46c15adbc [0,2,0,0,0,0|2,0,0]=4 9443 B13R1.669 CSCCNc1cc(c(cn1)F)F ffe5d20b033b9060e9366612f62acd17 [0,2,0,0,0,0|2,0,0]=4 9444 B13R1.669 CSCCNc1cc(c(cn1)F)I b6875bf84c16f04028380a5f3457f9a7 [0,2,0,0,0,0|2,0,0]=4 9445 B13R1.669 CSCCNc1cc(c(cn1)I)Br 8d1ef887e040af53c3eb49cee616a55f [0,2,0,0,0,0|2,0,0]=4 9446 B13R1.669 CSCCNc1cc(c(cn1)I)C 71ca01bffaafbe4e7779dce502f70765 [0,2,0,0,0,0|2,0,0]=4 9447 B13R1.669 CSCCNc1cc(c(cn1)I)Cl a381b54d7c7dff35e94cb6056667ccd7 [0,2,0,0,0,0|2,0,0]=4 9448 B13R1.669 CSCCNc1cc(c(cn1)I)F 368f1a7bc2bf94e85dfe741bc3239bcf [0,2,0,0,0,0|2,0,0]=4 9449 B13R1.669 CSCCNc1cc(c(cn1)N)N 751f90787a8ee4f1b154084c30ac6233 [0,2,0,0,0,0|2,0,0]=4 9450 B13R1.669 CSCCNc1ccc(c(n1)Br)Br 7492013f730826c9c3d8dc06b7cf35fd [0,2,0,0,0,0|2,0,0]=4 9451 B13R1.669 CSCCNc1ccc(c(n1)Br)C d014966bf18594b1b4b77413b91fdf70 [0,2,0,0,0,0|2,0,0]=4 9452 B13R1.669 CSCCNc1ccc(c(n1)Br)Cl a19dede9b171d8819ed64e41846d0e04 [0,2,0,0,0,0|2,0,0]=4 9453 B13R1.669 CSCCNc1ccc(c(n1)Br)F 87d9875c1cc4344ad98bbafb822d3624 [0,2,0,0,0,0|2,0,0]=4 9454 B13R1.669 CSCCNc1ccc(c(n1)Br)I 9425bcdffa3549190dd04c5be2983488 [0,2,0,0,0,0|2,0,0]=4 9455 B13R1.669 CSCCNc1ccc(c(n1)C)Br b572a892101e8e781697b4759a8c06fc [0,2,0,0,0,0|2,0,0]=4 9456 B13R1.669 CSCCNc1ccc(c(n1)C)C eb464c5fed2208d39a2be2b0e7411b12 [0,2,0,0,0,0|2,0,0]=4 9457 B13R1.669 CSCCNc1ccc(c(n1)C)Cl 12ee7fd44805f27619f3a09c088aa5dc [0,2,0,0,0,0|2,0,0]=4 9458 B13R1.669 CSCCNc1ccc(c(n1)C)F b574d6f00e2313628d36f4d93ac34bfe [0,2,0,0,0,0|2,0,0]=4 9459 B13R1.669 CSCCNc1ccc(c(n1)C)I 2ecd5690f9bff2a23135a8713c1d7470 [0,2,0,0,0,0|2,0,0]=4 9460 B13R1.669 CSCCNc1ccc(c(n1)Cl)Br ccbafadfab5f50873f5a8970b7284a09 [0,2,0,0,0,0|2,0,0]=4 9461 B13R1.669 CSCCNc1ccc(c(n1)Cl)C d0e8d7e51d484afcd3e1cd101e8b9f0c [0,2,0,0,0,0|2,0,0]=4 9462 B13R1.669 CSCCNc1ccc(c(n1)Cl)Cl 4ea3533a8fc008fee1fbc898d37717a9 [0,2,0,0,0,0|2,0,0]=4 9463 B13R1.669 CSCCNc1ccc(c(n1)Cl)F cef9d09ae0e1bbcedd0d2e3acd758ff0 [0,2,0,0,0,0|2,0,0]=4 9464 B13R1.669 CSCCNc1ccc(c(n1)Cl)I 18637bb1bb9d1dd59554d87636fb09a3 [0,2,0,0,0,0|2,0,0]=4 9465 B13R1.669 CSCCNc1ccc(c(n1)F)Br b08a791cb70af4fcb3440ff36a3faf9c [0,2,0,0,0,0|2,0,0]=4 9466 B13R1.669 CSCCNc1ccc(c(n1)F)C 12f317ed33cc4a938cd7b5229a47751a [0,2,0,0,0,0|2,0,0]=4 9467 B13R1.669 CSCCNc1ccc(c(n1)F)Cl aa0dc8f85f52032d90a9c988ef6c4acf [0,2,0,0,0,0|2,0,0]=4 9468 B13R1.669 CSCCNc1ccc(c(n1)F)F 208a5c34d86338604184e5c2b2c01675 [0,2,0,0,0,0|2,0,0]=4 9469 B13R1.669 CSCCNc1ccc(c(n1)F)I c05af45124bff3170aff215d96f7e6c2 [0,2,0,0,0,0|2,0,0]=4 9470 B13R1.669 CSCCNc1ccc(c(n1)I)Br d0ad8b276dbc44459835c14392eb0ac2 [0,2,0,0,0,0|2,0,0]=4 9471 B13R1.669 CSCCNc1ccc(c(n1)I)F 875ec64e98ec342f96be9a61d97f42e0 [0,2,0,0,0,0|2,0,0]=4 9472 B13R1.669 CSCCNc1ccc(c(n1)N)N 43e1a260d93a5983cf86e51c70363839 [0,2,0,0,0,0|2,0,0]=4 9473 B13R1.669 CSCCOc1cc(c(cn1)Br)Br d5432459b9bfd7156ac68e67eea8fea6 [0,2,0,0,0,0|2,0,0]=4 9474 B13R1.669 CSCCOc1cc(c(cn1)Br)C 20f731a44beb9753c608711431ca064f [0,2,0,0,0,0|2,0,0]=4 9475 B13R1.669 CSCCOc1cc(c(cn1)Br)Cl 678ea4eeb6e76551c49f5a44dfb510ab [0,2,0,0,0,0|2,0,0]=4 9476 B13R1.669 CSCCOc1cc(c(cn1)Br)F cf1086e7476ae86d58424bdf63dde5ee [0,2,0,0,0,0|2,0,0]=4 9477 B13R1.669 CSCCOc1cc(c(cn1)C)Br 26b168718a76d930e56e060ee14eb721 [0,2,0,0,0,0|2,0,0]=4 9478 B13R1.669 CSCCOc1cc(c(cn1)C)C d44dcef4f3df36e624e58e7b8d3a44d2 [0,2,0,0,0,0|2,0,0]=4 9479 B13R1.669 CSCCOc1cc(c(cn1)C)I 09d241d23f05230bdf467accc65472d2 [0,2,0,0,0,0|2,0,0]=4 9480 B13R1.669 CSCCOc1cc(c(cn1)Cl)Br 8755194614cfe13cdf7346ce37452c8b [0,2,0,0,0,0|2,0,0]=4 9481 B13R1.669 CSCCOc1cc(c(cn1)Cl)C 291b9e7d021261be3bf74e62d97f6b8a [0,2,0,0,0,0|2,0,0]=4 9482 B13R1.669 CSCCOc1cc(c(cn1)F)Br e84926ff1e0a06e550f3f308d8ad2530 [0,2,0,0,0,0|2,0,0]=4 9483 B13R1.669 CSCCOc1cc(c(cn1)F)C c66bbf09b1f220286c9696352033e0d8 [0,2,0,0,0,0|2,0,0]=4 9484 B13R1.669 CSCCOc1cc(c(cn1)F)I dffac602e537a78208d84036ee74a791 [0,2,0,0,0,0|2,0,0]=4 9485 B13R1.669 CSCCOc1cc(c(cn1)I)C 79673f5ff596790c1204eb554dc93560 [0,2,0,0,0,0|2,0,0]=4 9486 B13R1.669 CSCCOc1cc(c(cn1)I)Cl 42c99266f9922890fc03f129250361d8 [0,2,0,0,0,0|2,0,0]=4 9487 B13R1.669 CSCCOc1ccc(c(n1)Br)Br 7c2cfdef221a2e394ce73927785558da [0,2,0,0,0,0|2,0,0]=4 9488 B13R1.669 CSCCOc1ccc(c(n1)Br)C 84795e421c2fc7a1c3aa8815ac71d17d [0,2,0,0,0,0|2,0,0]=4 9489 B13R1.669 CSCCOc1ccc(c(n1)Br)Cl 0386e71e7d270ed51e82a8f99ac80fc9 [0,2,0,0,0,0|2,0,0]=4 9490 B13R1.669 CSCCOc1ccc(c(n1)Br)F 773a5110c9ee4fbfda88f9b4d1c33d99 [0,2,0,0,0,0|2,0,0]=4 9491 B13R1.669 CSCCOc1ccc(c(n1)C)Br 45a5b3bb878d9c4c6a0469c82585c9ee [0,2,0,0,0,0|2,0,0]=4 9492 B13R1.669 CSCCOc1ccc(c(n1)C)Cl ad6c3687c84d5e0cf7c2012a67b83d8c [0,2,0,0,0,0|2,0,0]=4 9493 B13R1.669 CSCCOc1ccc(c(n1)Cl)Br bdbded28431ac61d8aa6ab4a9ade9f4f [0,2,0,0,0,0|2,0,0]=4 9494 B13R1.669 CSCCOc1ccc(c(n1)Cl)Cl 23910fe0d744ac2e6d7d466dd3c21dc8 [0,2,0,0,0,0|2,0,0]=4 9495 B13R1.669 CSCCOc1ccc(c(n1)F)Br b1544fd1b7a9487b6d0d9a3e72f58e0d [0,2,0,0,0,0|2,0,0]=4 9496 B13R1.669 CSCCOc1ccc(c(n1)F)I 4f949ad87676bb1d9b0777974f125b42 [0,2,0,0,0,0|2,0,0]=4 9497 B13R1.669 CSCNCc1ccc(c(n1)Cl)Cl df3a2aeb0dcf874a3b7f78114b37aa3d [0,2,0,0,0,0|2,0,0]=4 9498 B13R1.669 CSCOCc1cc(c(cn1)Br)Br 79351dc5a9c21b38479af1437f0998e0 [0,2,0,0,0,0|2,0,0]=4 9499 B13R1.669 CSCOCc1cc(c(cn1)Br)C 2eca3a5350c672da600251fbf7462be6 [0,2,0,0,0,0|2,0,0]=4 9500 B13R1.669 CSCOCc1cc(c(cn1)Br)Cl cedf4951f808ee64448bbadd6c9dd232 [0,2,0,0,0,0|2,0,0]=4 9501 B13R1.669 CSCOCc1cc(c(cn1)C)Br 3aae857ef894f863d33e41df436a1ae9 [0,2,0,0,0,0|2,0,0]=4 9502 B13R1.669 CSCOCc1cc(c(cn1)C)C f5b1d69940751997175f13eb76334951 [0,2,0,0,0,0|2,0,0]=4 9503 B13R1.669 CSCOCc1cc(c(cn1)C)Cl 383a5e4d7dfcac203036e1933911d23b [0,2,0,0,0,0|2,0,0]=4 9504 B13R1.669 CSCOCc1cc(c(cn1)Cl)Cl 6b76d01d0c33d7907b62bc09aa1bf3e8 [0,2,0,0,0,0|2,0,0]=4 9505 B13R1.669 CSCOCc1cc(c(cn1)F)Br b5b1fe2b600880e5e6191f0e8740e0c0 [0,2,0,0,0,0|2,0,0]=4 9506 B13R1.669 CSCOCc1cc(c(cn1)F)C 13d84cba8ebf28a0900f59bf23fe81cc [0,2,0,0,0,0|2,0,0]=4 9507 B13R1.669 CSCOCc1cc(c(cn1)F)Cl 983aa3c200125f7b1063c7fdac083974 [0,2,0,0,0,0|2,0,0]=4 9508 B13R1.669 CSCOCc1ccc(c(n1)Br)Cl 374ebce6839404899cf8f66c796a5ea8 [0,2,0,0,0,0|2,0,0]=4 9509 B13R1.669 CSCOCc1ccc(c(n1)Br)F 53a55d45010d097e709a8d72736d3cb6 [0,2,0,0,0,0|2,0,0]=4 9510 B13R1.669 CSCOCc1ccc(c(n1)C)Cl 0b280c31d241d42edeffa98f6f0cf796 [0,2,0,0,0,0|2,0,0]=4 9511 B13R1.669 CSCOCc1ccc(c(n1)C)F c55b698b82df7238bedac3ad8770239d [0,2,0,0,0,0|2,0,0]=4 9512 B13R1.669 CSCOCc1ccc(c(n1)Cl)Cl 7c669fb4d2fa9ce246ba91d84721daec [0,2,0,0,0,0|2,0,0]=4 9513 B13R1.669 Cc1cc(ncc1Br)COCCF 7504309164503c2c3cb0aacc08786bf6 [0,2,0,0,0,0|2,0,0]=4 9514 B13R1.669 Cc1cc(ncc1Br)COCCS a9d6ce3fc0185e7aca9f99afdbb1bc09 [0,2,0,0,0,0|2,0,0]=4 9515 B13R1.669 Cc1cc(ncc1Br)NCCCF 0924ec72394580ec9c692431bf5e10fd [0,2,0,0,0,0|2,0,0]=4 9516 B13R1.669 Cc1cc(ncc1Br)NCCCO 6c1e6ec278dc87f8cfe83aa6389ccd59 [0,2,0,0,0,0|2,0,0]=4 9517 B13R1.669 Cc1cc(ncc1Br)NCCCS e92e387a9a49e888059f8843c7ea68c5 [0,2,0,0,0,0|2,0,0]=4 9518 B13R1.669 Cc1cc(ncc1Br)OCCCF 32f0ccfb4552c6b873c71d4cf6119637 [0,2,0,0,0,0|2,0,0]=4 9519 B13R1.669 Cc1cc(ncc1Br)OCCCS fd5bc2d2abc4976a075f882cb3a8b9e8 [0,2,0,0,0,0|2,0,0]=4 9520 B13R1.669 Cc1cc(ncc1Cl)NCCCF 789941d3ee2877bd8b28bd69bc16b75c [0,2,0,0,0,0|2,0,0]=4 9521 B13R1.669 Cc1cc(ncc1Cl)NCCCO 1aa27521f67f1cd211105e6ccf7e93c4 [0,2,0,0,0,0|2,0,0]=4 9522 B13R1.669 Cc1cc(ncc1Cl)NCCCS 9ca3cf2cd7130635473f1d11e42dc010 [0,2,0,0,0,0|2,0,0]=4 9523 B13R1.669 Cc1cc(ncc1Cl)OCCCF e6c8a6fdbbab248257e42b2999795cf7 [0,2,0,0,0,0|2,0,0]=4 9524 B13R1.669 Cc1cc(ncc1Cl)OCCCS 7b49a47513fbddb8a5023fe43ee5bc9c [0,2,0,0,0,0|2,0,0]=4 9525 B13R1.669 Cc1cc(ncc1F)COCCF 9bb78cb3467e4e8ff1463dff9fffb366 [0,2,0,0,0,0|2,0,0]=4 9526 B13R1.669 Cc1cc(ncc1F)COCCS cc3921811ac1f4232d5d7f74f1344fe6 [0,2,0,0,0,0|2,0,0]=4 9527 B13R1.669 Cc1cc(ncc1F)NCCCF 9cd235063ee268e74b41bf7fcc2e943c [0,2,0,0,0,0|2,0,0]=4 9528 B13R1.669 Cc1cc(ncc1F)NCCCO 36907845775623ecdbf19267061fe377 [0,2,0,0,0,0|2,0,0]=4 9529 B13R1.669 Cc1cc(ncc1F)NCCCS 1c02d75cde323bc274ee5800f3fa06b5 [0,2,0,0,0,0|2,0,0]=4 9530 B13R1.669 Cc1cc(ncc1F)OCCCF 804c9c72657cfbcf3d8e19e7083f16d1 [0,2,0,0,0,0|2,0,0]=4 9531 B13R1.669 Cc1cc(ncc1F)OCCCS 22ae0d92625237f615b6e05ccce308e1 [0,2,0,0,0,0|2,0,0]=4 9532 B13R1.669 Cc1cc(ncc1I)NCCCF 3aea2a5194aafee069e9e441b23674e0 [0,2,0,0,0,0|2,0,0]=4 9533 B13R1.669 Cc1cc(ncc1I)NCCCO ad8ffd7151ce6b518234773deb0a6657 [0,2,0,0,0,0|2,0,0]=4 9534 B13R1.669 Cc1cc(ncc1I)NCCCS 9088f18b74e07feaa6fc79fbe754ffef [0,2,0,0,0,0|2,0,0]=4 9535 B13R1.669 Cc1cc(ncc1I)OCCCF 898b0d8a58f5c802edde6b9878f50549 [0,2,0,0,0,0|2,0,0]=4 9536 B13R1.669 Cc1cc(ncc1I)OCCCS d2418ad3b042db43d3d8f2f03aa58c44 [0,2,0,0,0,0|2,0,0]=4 9537 B13R1.669 Cc1ccc(nc1Br)NCCCF 774003a3015ce3d7b2e967e5921a1250 [0,2,0,0,0,0|2,0,0]=4 9538 B13R1.669 Cc1ccc(nc1Br)NCCCO a4c1c654f1ba4277488f08b05a37cbfb [0,2,0,0,0,0|2,0,0]=4 9539 B13R1.669 Cc1ccc(nc1Br)NCCCS d5ee0ad2e84e8217b342c489de9e9cdd [0,2,0,0,0,0|2,0,0]=4 9540 B13R1.669 Cc1ccc(nc1Br)OCCCF 204ff5c57c723040748cb29d86d5603c [0,2,0,0,0,0|2,0,0]=4 9541 B13R1.669 Cc1ccc(nc1Br)OCCCS 4a14969f84910facf72fada9a15251a4 [0,2,0,0,0,0|2,0,0]=4 9542 B13R1.669 Cc1ccc(nc1C)NCCCCl 321c2c1802fde76419ce56ffe683b831 [0,2,0,0,0,0|2,0,0]=4 9543 B13R1.669 Cc1ccc(nc1C)NCCCF 55834dfa7fa326b506c2872210600fa8 [0,2,0,0,0,0|2,0,0]=4 9544 B13R1.669 Cc1ccc(nc1C)NCCCO 46889c00c0cb190f93b0ae57812464ed [0,2,0,0,0,0|2,0,0]=4 9545 B13R1.669 Cc1ccc(nc1C)NCCCS f2ba32636c9bc6b7db0647bc8019dbc9 [0,2,0,0,0,0|2,0,0]=4 9546 B13R1.669 Cc1ccc(nc1Cl)NCCCF a89b0e08630f5487e8c985ce50277720 [0,2,0,0,0,0|2,0,0]=4 9547 B13R1.669 Cc1ccc(nc1Cl)NCCCO c6bf2195373721194e3213bfaae64abe [0,2,0,0,0,0|2,0,0]=4 9548 B13R1.669 Cc1ccc(nc1Cl)NCCCS 7542bcf44e93e0f61ec25baa65b97ef2 [0,2,0,0,0,0|2,0,0]=4 9549 B13R1.669 Cc1ccc(nc1F)NCCCF 066911c5a74257fb416634d426eea2fa [0,2,0,0,0,0|2,0,0]=4 9550 B13R1.669 Cc1ccc(nc1F)NCCCO f53f3575e89cb18847e8ab56229fa01e [0,2,0,0,0,0|2,0,0]=4 9551 B13R1.669 Cc1ccc(nc1F)NCCCS 4b631b769c47b4da70a5f430e6ea2f35 [0,2,0,0,0,0|2,0,0]=4 9552 B13R1.669 Cc1cnc(cc1Br)COCCF b553f00a72311c42d87b19a3bba1bcf4 [0,2,0,0,0,0|2,0,0]=4 9553 B13R1.669 Cc1cnc(cc1Br)COCCS f54be1ff41a7cd8bc15a30d85d25ff60 [0,2,0,0,0,0|2,0,0]=4 9554 B13R1.669 Cc1cnc(cc1Br)NCCCF d0e73839c2ca7dac832af52d3819b76b [0,2,0,0,0,0|2,0,0]=4 9555 B13R1.669 Cc1cnc(cc1Br)NCCCO 4411ec97e61fcf4b9842df864f4780a7 [0,2,0,0,0,0|2,0,0]=4 9556 B13R1.669 Cc1cnc(cc1Br)NCCCS 749f7577c5009adbdfff55c268e4213a [0,2,0,0,0,0|2,0,0]=4 9557 B13R1.669 Cc1cnc(cc1Br)OCCCF 4da189acd38b8de2666d927d53e0a888 [0,2,0,0,0,0|2,0,0]=4 9558 B13R1.669 Cc1cnc(cc1Br)OCCCS d3ea62da97d7e02bcf40f7a42c2c7ec5 [0,2,0,0,0,0|2,0,0]=4 9559 B13R1.669 Cc1cnc(cc1C)COCCF d735fe1a8cbedc4d362f9f610ea188d5 [0,2,0,0,0,0|2,0,0]=4 9560 B13R1.669 Cc1cnc(cc1C)COCCS c4ac1a56635ca3ac769a24a05a2aea06 [0,2,0,0,0,0|2,0,0]=4 9561 B13R1.669 Cc1cnc(cc1C)NCCCF 9f470985dfdc6152e7cf34407fd00c23 [0,2,0,0,0,0|2,0,0]=4 9562 B13R1.669 Cc1cnc(cc1C)NCCCO 10eb35a4669484c94ce8a47ce7e0afa5 [0,2,0,0,0,0|2,0,0]=4 9563 B13R1.669 Cc1cnc(cc1C)NCCCS 8a3a08baac8afcfea32ef17b20a6b736 [0,2,0,0,0,0|2,0,0]=4 9564 B13R1.669 Cc1cnc(cc1C)OCCCF e70bb34741a7d6ed7eda80fb5028c7e3 [0,2,0,0,0,0|2,0,0]=4 9565 B13R1.669 Cc1cnc(cc1C)OCCCS b3ea422950c1e2265ef20f4117eab0bb [0,2,0,0,0,0|2,0,0]=4 9566 B13R1.669 Cc1cnc(cc1Cl)COCCF 25cf41cc86c430655db04a26a236b1ea [0,2,0,0,0,0|2,0,0]=4 9567 B13R1.669 Cc1cnc(cc1Cl)COCCS 31b069636a99bf650e29903ca250c939 [0,2,0,0,0,0|2,0,0]=4 9568 B13R1.669 Cc1cnc(cc1Cl)NCCCF bdcf9e51272cd74a28b1e7d7542c23ad [0,2,0,0,0,0|2,0,0]=4 9569 B13R1.669 Cc1cnc(cc1Cl)NCCCO dbc02618d9851b9c798eb48fbf239db0 [0,2,0,0,0,0|2,0,0]=4 9570 B13R1.669 Cc1cnc(cc1Cl)NCCCS 2a1845b60cdf782b2af0870b740b4653 [0,2,0,0,0,0|2,0,0]=4 9571 B13R1.669 Cc1cnc(cc1F)NCCCCl aad4e1762cdc6708bfd391cdfe789ed8 [0,2,0,0,0,0|2,0,0]=4 9572 B13R1.669 Cc1cnc(cc1F)NCCCF 7228d3f62cb00bb9575d95a33a3b9541 [0,2,0,0,0,0|2,0,0]=4 9573 B13R1.669 Cc1cnc(cc1F)NCCCO 78ae536624854478f4ef0f5a1bfdf1e7 [0,2,0,0,0,0|2,0,0]=4 9574 B13R1.669 Cc1cnc(cc1F)NCCCS 8d303e5443a4c5f1b27bdc01fec97480 [0,2,0,0,0,0|2,0,0]=4 9575 B13R1.669 Cc1cnc(cc1I)NCCCF 72a8479f35bc3f59a9efec613d31c7a5 [0,2,0,0,0,0|2,0,0]=4 9576 B13R1.669 Cc1cnc(cc1I)NCCCO f7d7a5bf738a14823690206af9c54129 [0,2,0,0,0,0|2,0,0]=4 9577 B13R1.669 Cc1cnc(cc1I)NCCCS fed4f78058f0c6b31206df241f131251 [0,2,0,0,0,0|2,0,0]=4 9578 B13R1.669 Cc1cnc(cc1I)OCCCF 39c5e15ae55e4fb1c72ce62f17352475 [0,2,0,0,0,0|2,0,0]=4 9579 B13R1.669 Cc1cnc(cc1I)OCCCS 25c49469f81b73a74ffcc15a6c7d72bb [0,2,0,0,0,0|2,0,0]=4 9580 B13R1.669 Cc1nc(ccc1Br)COCCF 0cc1baf027c7729a1d81fdaf0b94a718 [0,2,0,0,0,0|2,0,0]=4 9581 B13R1.669 Cc1nc(ccc1Br)COCCS ad852fa9f0105847b0980676f42f628d [0,2,0,0,0,0|2,0,0]=4 9582 B13R1.669 Cc1nc(ccc1Br)NCCCF bcaaf0ad138187ccba7fac8e4c5b5d8e [0,2,0,0,0,0|2,0,0]=4 9583 B13R1.669 Cc1nc(ccc1Br)NCCCS 9da13703ff70ceedfc24788565ab91ac [0,2,0,0,0,0|2,0,0]=4 9584 B13R1.669 Cc1nc(ccc1Br)OCCCF da3bece770797882df5f4eb3a6b02251 [0,2,0,0,0,0|2,0,0]=4 9585 B13R1.669 Cc1nc(ccc1Cl)COCCF cf6c9da2092155aadb5e7ac3cbb64f2d [0,2,0,0,0,0|2,0,0]=4 9586 B13R1.669 Cc1nc(ccc1Cl)COCCS 933908a4369fd4a493d9792954a1aec2 [0,2,0,0,0,0|2,0,0]=4 9587 B13R1.669 Cc1nc(ccc1Cl)NCCCF 988adc466a3c779281246dc96b5c92c3 [0,2,0,0,0,0|2,0,0]=4 9588 B13R1.669 Cc1nc(ccc1Cl)NCCCO d6e74f9e9bd7b8cf574040bf5130750c [0,2,0,0,0,0|2,0,0]=4 9589 B13R1.669 Cc1nc(ccc1Cl)NCCCS c7a77faeefa49c40e7399bcb41616e98 [0,2,0,0,0,0|2,0,0]=4 9590 B13R1.669 Cc1nc(ccc1Cl)OCCCF 982d6b3664c1178a8222bb1c52724ea6 [0,2,0,0,0,0|2,0,0]=4 9591 B13R1.669 Cc1nc(ccc1Cl)OCCCS 99c135af04b889714bd0cc95c13754af [0,2,0,0,0,0|2,0,0]=4 9592 B13R1.669 Cc1nc(ccc1F)CCOCF 7cf3079210ae9bf418664ca01c335eb1 [0,2,0,0,0,0|2,0,0]=4 9593 B13R1.669 Cc1nc(ccc1F)COCCF 364efc2ad513ae153f91351a936db2aa [0,2,0,0,0,0|2,0,0]=4 9594 B13R1.669 Cc1nc(ccc1F)COCCS 9fdd3f8222a08007e0ddd9564c38c340 [0,2,0,0,0,0|2,0,0]=4 9595 B13R1.669 Cc1nc(ccc1F)NCCCF 7c983f938cfc4e8c618b017f31de7efb [0,2,0,0,0,0|2,0,0]=4 9596 B13R1.669 Cc1nc(ccc1F)NCCCO a0dee405d96d29af5c3b4c60da0efef0 [0,2,0,0,0,0|2,0,0]=4 9597 B13R1.669 Cc1nc(ccc1F)NCCCS d8b2a6d1efa16ac6908a960faa6da17c [0,2,0,0,0,0|2,0,0]=4 9598 B13R1.669 Cc1nc(ccc1I)NCCCF 3f20f086352def0d0cc7b2d1c199978b [0,2,0,0,0,0|2,0,0]=4 9599 B13R1.669 Cc1nc(ccc1I)NCCCO db073c4fb9f9f0f608cec76dea31bf04 [0,2,0,0,0,0|2,0,0]=4 9600 B13R1.669 Cc1nc(ccc1I)NCCCS e3f6ce25a54e87dbe2b38d5dbc119b16 [0,2,0,0,0,0|2,0,0]=4 9601 B13R1.669 Clc1ccc(nc1Cl)CNCCBr 4a8a8d3922d91863a7b7a4dabb971b61 [0,2,0,0,0,0|2,0,0]=4 9602 B13R1.669 Clc1ccc(nc1Cl)CNCCI bb78f8fdf4038a4377115e96ae882460 [0,2,0,0,0,0|2,0,0]=4 9603 B13R1.669 FCCCNc1cc(c(cn1)Br)Br 8a41ce2ec0389304dd3ede1954d47341 [0,2,0,0,0,0|2,0,0]=4 9604 B13R1.669 FCCCNc1cc(c(cn1)Br)Cl 8b6da2c8b7b45581db7f5f9e89a257a0 [0,2,0,0,0,0|2,0,0]=4 9605 B13R1.669 FCCCNc1cc(c(cn1)Br)F 075fe992d6c8186296f28309f520aea1 [0,2,0,0,0,0|2,0,0]=4 9606 B13R1.669 FCCCNc1cc(c(cn1)Cl)Br 72679260427a892d5586b8e9d2d1e430 [0,2,0,0,0,0|2,0,0]=4 9607 B13R1.669 FCCCNc1cc(c(cn1)Cl)Cl 08d6687c8be747480f3597f14770debf [0,2,0,0,0,0|2,0,0]=4 9608 B13R1.669 FCCCNc1cc(c(cn1)Cl)F 5b3f3792a529505f50504091dd9deaf9 [0,2,0,0,0,0|2,0,0]=4 9609 B13R1.669 FCCCNc1cc(c(cn1)Cl)I acf268d8c629b2766d5fcb504a886014 [0,2,0,0,0,0|2,0,0]=4 9610 B13R1.669 FCCCNc1cc(c(cn1)F)Br aacd7478a2e6c6c2c753c426833c6484 [0,2,0,0,0,0|2,0,0]=4 9611 B13R1.669 FCCCNc1cc(c(cn1)F)Cl cac49fdfca32f09265afe139f409279c [0,2,0,0,0,0|2,0,0]=4 9612 B13R1.669 FCCCNc1cc(c(cn1)F)F 3ebacbc99a0560b2845950b717b269d5 [0,2,0,0,0,0|2,0,0]=4 9613 B13R1.669 FCCCNc1cc(c(cn1)F)I 6d65aa238dd4142c2f8274380114e0ed [0,2,0,0,0,0|2,0,0]=4 9614 B13R1.669 FCCCNc1cc(c(cn1)I)Br 21e9e619e2d88b1f11e40516c46f4b21 [0,2,0,0,0,0|2,0,0]=4 9615 B13R1.669 FCCCNc1cc(c(cn1)I)Cl 9534f084a839f6e8c86df0a256cde33e [0,2,0,0,0,0|2,0,0]=4 9616 B13R1.669 FCCCNc1cc(c(cn1)I)F c43590d3ed969f56f4960aa251777d53 [0,2,0,0,0,0|2,0,0]=4 9617 B13R1.669 FCCCNc1ccc(c(n1)Br)Br 18ae7de284ed62e8f725030281118d7f [0,2,0,0,0,0|2,0,0]=4 9618 B13R1.669 FCCCNc1ccc(c(n1)Br)Cl f5294fbbc884ab161055b15e71e9a447 [0,2,0,0,0,0|2,0,0]=4 9619 B13R1.669 FCCCNc1ccc(c(n1)Br)F cd1c804e7a26ad6748a0ac5bc6a6897b [0,2,0,0,0,0|2,0,0]=4 9620 B13R1.669 FCCCNc1ccc(c(n1)Br)I 1db17367fb5ba8e6a89a9965a0bb0beb [0,2,0,0,0,0|2,0,0]=4 9621 B13R1.669 FCCCNc1ccc(c(n1)Cl)Br dc90b186e210229229263801884c37cf [0,2,0,0,0,0|2,0,0]=4 9622 B13R1.669 FCCCNc1ccc(c(n1)Cl)Cl 0096df252cfdcc2dc39b7d7e92407ac1 [0,2,0,0,0,0|2,0,0]=4 9623 B13R1.669 FCCCNc1ccc(c(n1)Cl)F 6bf38ecd3d52da71d25a68224aec52b6 [0,2,0,0,0,0|2,0,0]=4 9624 B13R1.669 FCCCNc1ccc(c(n1)Cl)I 17430b6dea9f4b4761b7622c2a2d2ecb [0,2,0,0,0,0|2,0,0]=4 9625 B13R1.669 FCCCNc1ccc(c(n1)F)Br afbced7830a5098a738a61b4fb388c14 [0,2,0,0,0,0|2,0,0]=4 9626 B13R1.669 FCCCNc1ccc(c(n1)F)Cl d3b1712a41ebbf47c9227e25f6cf7972 [0,2,0,0,0,0|2,0,0]=4 9627 B13R1.669 FCCCNc1ccc(c(n1)F)F 0b128cd376d8f44b650a708e0c6ad8ce [0,2,0,0,0,0|2,0,0]=4 9628 B13R1.669 FCCCNc1ccc(c(n1)F)I 279d7ce7ed3b75c505caf381aeadcd5e [0,2,0,0,0,0|2,0,0]=4 9629 B13R1.669 FCCCNc1ccc(c(n1)I)Br a6610eb4ed2b37441c1edd2960dd4e23 [0,2,0,0,0,0|2,0,0]=4 9630 B13R1.669 FCCCNc1ccc(c(n1)I)F 387093f93531f6f5a70d5e04596c270e [0,2,0,0,0,0|2,0,0]=4 9631 B13R1.669 FCCCOc1cc(c(cn1)Br)Br 694802dc702658b0e00b15b1d6a52a3a [0,2,0,0,0,0|2,0,0]=4 9632 B13R1.669 FCCCOc1cc(c(cn1)Br)Cl d9a10b93e6fe3ceb0a400bbe825f4af4 [0,2,0,0,0,0|2,0,0]=4 9633 B13R1.669 FCCCOc1cc(c(cn1)Br)F 8931f03dc6524fca932b9b6d6fac07cd [0,2,0,0,0,0|2,0,0]=4 9634 B13R1.669 FCCCOc1cc(c(cn1)Cl)Br c113f95e8777b2bd8542ddc26082194e [0,2,0,0,0,0|2,0,0]=4 9635 B13R1.669 FCCCOc1cc(c(cn1)F)Br 37058830f55e54b7c028537052461704 [0,2,0,0,0,0|2,0,0]=4 9636 B13R1.669 FCCCOc1cc(c(cn1)F)I 5e5ec0e9fbb00b0afb2267b41977ff11 [0,2,0,0,0,0|2,0,0]=4 9637 B13R1.669 FCCCOc1cc(c(cn1)I)Cl 1189f76a4e3532d526737014fa792513 [0,2,0,0,0,0|2,0,0]=4 9638 B13R1.669 FCCCOc1ccc(c(n1)Br)Br 5ad446b755a2427d411f4404df5abe3a [0,2,0,0,0,0|2,0,0]=4 9639 B13R1.669 FCCCOc1ccc(c(n1)Br)Cl 9ba0914cea2eb942ea47c96346cdc59b [0,2,0,0,0,0|2,0,0]=4 9640 B13R1.669 FCCCOc1ccc(c(n1)Br)F 9c4aea322dbbe89d28268a614cd81428 [0,2,0,0,0,0|2,0,0]=4 9641 B13R1.669 FCCCOc1ccc(c(n1)Cl)Br 8c5eb3aeeccd51ce4306e6744bfd6059 [0,2,0,0,0,0|2,0,0]=4 9642 B13R1.669 FCCCOc1ccc(c(n1)Cl)Cl 4e7d95ee35851d8271cea185b4e4c3fc [0,2,0,0,0,0|2,0,0]=4 9643 B13R1.669 FCCCOc1ccc(c(n1)F)Br d78f407c5b7068cf53ce33bd21514190 [0,2,0,0,0,0|2,0,0]=4 9644 B13R1.669 FCCCOc1ccc(c(n1)F)I 08f15cc9b7729b9856ac309dfa84cc51 [0,2,0,0,0,0|2,0,0]=4 9645 B13R1.669 FCCNCc1ccc(c(n1)Br)F a7ed654343dd6ed1508f2bdb6bb32417 [0,2,0,0,0,0|2,0,0]=4 9646 B13R1.669 FCCNCc1ccc(c(n1)Cl)Cl bf93d28db404a4cc5280fdd88b916535 [0,2,0,0,0,0|2,0,0]=4 9647 B13R1.669 FCCOCc1cc(c(cn1)Br)Br 54758dff0e675b4522b852fd62454535 [0,2,0,0,0,0|2,0,0]=4 9648 B13R1.669 FCCOCc1cc(c(cn1)Br)Cl 1dfa55c9457c66edae22939cfed52886 [0,2,0,0,0,0|2,0,0]=4 9649 B13R1.669 FCCOCc1cc(c(cn1)Cl)Cl 720196c024c198b71dfbcca2c40f0d08 [0,2,0,0,0,0|2,0,0]=4 9650 B13R1.669 FCCOCc1cc(c(cn1)F)Br 9e7d0b910399a99973615196b722d973 [0,2,0,0,0,0|2,0,0]=4 9651 B13R1.669 FCCOCc1cc(c(cn1)F)Cl 886738531fcf1485cfa34f7219219b61 [0,2,0,0,0,0|2,0,0]=4 9652 B13R1.669 FCCOCc1ccc(c(n1)Br)Cl 1d3b7b17618a7c4b35156b568d141b6d [0,2,0,0,0,0|2,0,0]=4 9653 B13R1.669 FCCOCc1ccc(c(n1)Br)F 83f506576d3e2de00c9e91df3f2c2e4b [0,2,0,0,0,0|2,0,0]=4 9654 B13R1.669 FCCOCc1ccc(c(n1)Cl)Br 3769124b284eb2e7253a7dd169880b17 [0,2,0,0,0,0|2,0,0]=4 9655 B13R1.669 FCCOCc1ccc(c(n1)Cl)Cl d234b82a9fe49a61881b2d3a1d99f30b [0,2,0,0,0,0|2,0,0]=4 9656 B13R1.669 Fc1cc(ncc1Br)NCCCS 2be22ee663974a36cf8d907d3231d826 [0,2,0,0,0,0|2,0,0]=4 9657 B13R1.669 Fc1cc(ncc1Cl)NCCCS 94387601c3c77f99157db03c0b41b803 [0,2,0,0,0,0|2,0,0]=4 9658 B13R1.669 Fc1cc(ncc1I)NCCCS 67b27b49dede7cdf75febda25d124d1c [0,2,0,0,0,0|2,0,0]=4 9659 B13R1.669 Fc1ccc(nc1Br)CNCCBr 5837b8df08d580984eb71388ef532434 [0,2,0,0,0,0|2,0,0]=4 9660 B13R1.669 Fc1ccc(nc1Br)CNCCI c4cbc8fc30aae8c8584fe1e2cb835b85 [0,2,0,0,0,0|2,0,0]=4 9661 B13R1.669 Fc1ccc(nc1Br)CNCCS 332ad7b28e80b53d61db7b2b56ae55f2 [0,2,0,0,0,0|2,0,0]=4 9662 B13R1.669 Fc1ccc(nc1Br)COCCS 7ac2bb8151bdbb4942c549c5f33fad4e [0,2,0,0,0,0|2,0,0]=4 9663 B13R1.669 Fc1ccc(nc1Br)NCCCS 075d455b0693d09b8dba73675ebd89fb [0,2,0,0,0,0|2,0,0]=4 9664 B13R1.669 Fc1ccc(nc1Br)OCCCS 8c19a40e7c314fc293c590a3578d4a0e [0,2,0,0,0,0|2,0,0]=4 9665 B13R1.669 Fc1ccc(nc1Cl)NCCCS 03722ed60398d10c8c301b7dea50a85f [0,2,0,0,0,0|2,0,0]=4 9666 B13R1.669 Fc1ccc(nc1F)NCCCS 63528fa5541230a35b3cd3e10ccbe56a [0,2,0,0,0,0|2,0,0]=4 9667 B13R1.669 Fc1ccc(nc1I)NCCCS 2bf6e3940aa16d92b723188da783170c [0,2,0,0,0,0|2,0,0]=4 9668 B13R1.669 Fc1cnc(cc1Br)COCCS 2e1c6623ac7ad7e9779d91cc1a8c625d [0,2,0,0,0,0|2,0,0]=4 9669 B13R1.669 Fc1cnc(cc1Br)NCCCS 844c1539e21bef3b8afd87f28e8f8841 [0,2,0,0,0,0|2,0,0]=4 9670 B13R1.669 Fc1cnc(cc1Br)OCCCS c0a0b3092d645f35635d29c543161470 [0,2,0,0,0,0|2,0,0]=4 9671 B13R1.669 Fc1cnc(cc1Cl)COCCS 249e41674cdb526170a5ead2cabfc2ff [0,2,0,0,0,0|2,0,0]=4 9672 B13R1.669 Fc1cnc(cc1Cl)NCCCS 05a29f562f18e5a31c74e7b02fb24802 [0,2,0,0,0,0|2,0,0]=4 9673 B13R1.669 Fc1cnc(cc1F)NCCCS a750e35661af98c5a450b6bcb5a51b4f [0,2,0,0,0,0|2,0,0]=4 9674 B13R1.669 Fc1cnc(cc1I)NCCCS 37841e13e36c21aeee1d1c47ffb97fea [0,2,0,0,0,0|2,0,0]=4 9675 B13R1.669 Fc1cnc(cc1I)OCCCS 71fc67050e1540ff02fd34d83266c890 [0,2,0,0,0,0|2,0,0]=4 9676 B13R1.669 Fc1nc(ccc1Br)NCCCS 99a1a1342af41e29b8b858fe3d6eba74 [0,2,0,0,0,0|2,0,0]=4 9677 B13R1.669 Fc1nc(ccc1Br)OCCCS 5ac6d5fe41e707f77ce698dae24edbdb [0,2,0,0,0,0|2,0,0]=4 9678 B13R1.669 Fc1nc(ccc1Cl)NCCCS 1160acc6cffa4c9c0761457a08824192 [0,2,0,0,0,0|2,0,0]=4 9679 B13R1.669 Fc1nc(ccc1I)NCCCS 0f143d73b836b9b47661646602b861a9 [0,2,0,0,0,0|2,0,0]=4 9680 B13R1.669 Fc1nc(ccc1I)OCCCS 37a8c175f14d0d63763f5f87f94457fd [0,2,0,0,0,0|2,0,0]=4 9681 B13R1.669 Nc1ccc(nc1N)NCCCCl e3fd2a4db8a0b8a3f1feb50b9df7dab3 [0,2,0,0,0,0|2,0,0]=4 9682 B13R1.669 Nc1ccc(nc1N)NCCCO 2ae5abee5cc4448068564cb9c462e24a [0,2,0,0,0,0|2,0,0]=4 9683 B13R1.669 Nc1cnc(cc1N)NCCCCl 3df64fe931f650a82ce7116f6aead435 [0,2,0,0,0,0|2,0,0]=4 9684 B13R1.669 Nc1cnc(cc1N)NCCCO 7185531167b71ec301919947f8325e41 [0,2,0,0,0,0|2,0,0]=4 9685 B13R1.669 OCCCNc1cc(c(cn1)Br)Br ee09194a62380b94a2e0bc20ed4574bc [0,2,0,0,0,0|2,0,0]=4 9686 B13R1.669 OCCCNc1cc(c(cn1)Br)Cl b79330e00d920c7a0fe8b36ed5f2ac74 [0,2,0,0,0,0|2,0,0]=4 9687 B13R1.669 OCCCNc1cc(c(cn1)Br)F 60958709f7bf53e50ea668ed037e885b [0,2,0,0,0,0|2,0,0]=4 9688 B13R1.669 OCCCNc1cc(c(cn1)Cl)Br 5427e785e4c95a731bc3f5a96b26ce62 [0,2,0,0,0,0|2,0,0]=4 9689 B13R1.669 OCCCNc1cc(c(cn1)Cl)Cl f8334f63c6e3025413d5690910b2c0ee [0,2,0,0,0,0|2,0,0]=4 9690 B13R1.669 OCCCNc1cc(c(cn1)Cl)F c8b5d1d2eca0c6c88a8d7e60618208a8 [0,2,0,0,0,0|2,0,0]=4 9691 B13R1.669 OCCCNc1cc(c(cn1)Cl)I 8b9f1c70f31c052c7b20a43d702cb144 [0,2,0,0,0,0|2,0,0]=4 9692 B13R1.669 OCCCNc1cc(c(cn1)F)Br b813a0da4e06fd8c2301ded0471183c0 [0,2,0,0,0,0|2,0,0]=4 9693 B13R1.669 OCCCNc1cc(c(cn1)F)Cl c9571497d3e73d5975b0cc0805431594 [0,2,0,0,0,0|2,0,0]=4 9694 B13R1.669 OCCCNc1cc(c(cn1)F)F 302d29a101870af77cbf42ad6fbbf5b8 [0,2,0,0,0,0|2,0,0]=4 9695 B13R1.669 OCCCNc1cc(c(cn1)F)I 50d38749a4520fa9b798a5c070316811 [0,2,0,0,0,0|2,0,0]=4 9696 B13R1.669 OCCCNc1cc(c(cn1)I)Br c3172cb4ea21a1bc9342e85af80d659b [0,2,0,0,0,0|2,0,0]=4 9697 B13R1.669 OCCCNc1cc(c(cn1)I)Cl e94d1610761ff1af8551dd79af1ae511 [0,2,0,0,0,0|2,0,0]=4 9698 B13R1.669 OCCCNc1cc(c(cn1)I)F 3b9b79e79142fa4dff81411b009d7dcd [0,2,0,0,0,0|2,0,0]=4 9699 B13R1.669 OCCCNc1ccc(c(n1)Br)Cl b84bc9178e777bf96db18a13a5c21559 [0,2,0,0,0,0|2,0,0]=4 9700 B13R1.669 OCCCNc1ccc(c(n1)Cl)Cl 7558f5ea8be2479d4b6aebac911d1039 [0,2,0,0,0,0|2,0,0]=4 9701 B13R1.669 OCCCNc1ccc(c(n1)Cl)F 3271dee6a717844f4d30f61ff0bd760b [0,2,0,0,0,0|2,0,0]=4 9702 B13R1.669 OCCCNc1ccc(c(n1)Cl)I 80b4fd054813e72ef1c9f83fe1fa9d9a [0,2,0,0,0,0|2,0,0]=4 9703 B13R1.669 OCCCNc1ccc(c(n1)F)Cl 05197e92d2219a50a772a59c832a0656 [0,2,0,0,0,0|2,0,0]=4 9704 B13R1.669 OCCCNc1ccc(c(n1)F)F 16e9503742124e00b04980e9532ab9de [0,2,0,0,0,0|2,0,0]=4 9705 B13R1.669 OCCCNc1ccc(c(n1)F)I 5f15ef5da6132ccca1034d3238fc7006 [0,2,0,0,0,0|2,0,0]=4 9706 B13R1.669 OCCCNc1ccc(c(n1)I)F b06afe058f940cc7f069784495b9b911 [0,2,0,0,0,0|2,0,0]=4 9707 B13R1.669 OCCNCc1ccc(c(n1)Br)F 885d9d7b20b7c02ca2825f8a91cc1020 [0,2,0,0,0,0|2,0,0]=4 9708 B13R1.669 OCCNCc1ccc(c(n1)Cl)Cl 11f3ae1c7f5fb357f37164b7d818e1fd [0,2,0,0,0,0|2,0,0]=4 9709 B13R1.669 SCCCNc1cc(c(cn1)Br)Br 648774500d1797792d7302260464de15 [0,2,0,0,0,0|2,0,0]=4 9710 B13R1.669 SCCCNc1cc(c(cn1)Br)Cl 43f1b8da2a3c7de6be8ba9cf94314cd8 [0,2,0,0,0,0|2,0,0]=4 9711 B13R1.669 SCCCNc1cc(c(cn1)Cl)Br 5d8dce38b45c7e51c4ad561371b514af [0,2,0,0,0,0|2,0,0]=4 9712 B13R1.669 SCCCNc1cc(c(cn1)Cl)Cl 8e54a8e726bb0a7bbcb81adeefe4d260 [0,2,0,0,0,0|2,0,0]=4 9713 B13R1.669 SCCCNc1cc(c(cn1)Cl)I 0d3ee3fdf6d9bcd24e9ced82967fb94d [0,2,0,0,0,0|2,0,0]=4 9714 B13R1.669 SCCCNc1cc(c(cn1)I)Br 442bf4d068258d9689f1cbda8cb26aea [0,2,0,0,0,0|2,0,0]=4 9715 B13R1.669 SCCCNc1cc(c(cn1)I)Cl 444580a279510047e8575df04918b172 [0,2,0,0,0,0|2,0,0]=4 9716 B13R1.669 SCCCNc1ccc(c(n1)Br)Br d000577a0fc256068d52bf11e1f68227 [0,2,0,0,0,0|2,0,0]=4 9717 B13R1.669 SCCCNc1ccc(c(n1)Br)Cl 718e1dc78e3d1d2ae6948ee99616f24d [0,2,0,0,0,0|2,0,0]=4 9718 B13R1.669 SCCCNc1ccc(c(n1)Br)I 0f9472452047476131bf623e27de62d1 [0,2,0,0,0,0|2,0,0]=4 9719 B13R1.669 SCCCNc1ccc(c(n1)Cl)Br 2b49a3030728eedd8a2db30fed2c028a [0,2,0,0,0,0|2,0,0]=4 9720 B13R1.669 SCCCNc1ccc(c(n1)Cl)Cl c396a40d943e4c358c0aa961d5430fa1 [0,2,0,0,0,0|2,0,0]=4 9721 B13R1.669 SCCCNc1ccc(c(n1)Cl)I 9c50c4399e242af8de970d07da2d2a4b [0,2,0,0,0,0|2,0,0]=4 9722 B13R1.669 SCCCNc1ccc(c(n1)I)Br e73e99c578cf666ce3cf79c3364b7faa [0,2,0,0,0,0|2,0,0]=4 9723 B13R1.669 SCCCOc1cc(c(cn1)Br)Cl 7fda6c40d8bb512427f9d8b99c70d9d1 [0,2,0,0,0,0|2,0,0]=4 9724 B13R1.669 SCCCOc1cc(c(cn1)Cl)Br 82728c0aba6e929865feb0c3d3cbca4f [0,2,0,0,0,0|2,0,0]=4 9725 B13R1.669 SCCCOc1cc(c(cn1)I)Cl 5394db8a1f0b28fe64c5128ff1c87975 [0,2,0,0,0,0|2,0,0]=4 9726 B13R1.669 SCCCOc1ccc(c(n1)Br)Cl 571c7a8398d0bc0ecaac3fc4cc24b257 [0,2,0,0,0,0|2,0,0]=4 9727 B13R1.669 SCCCOc1ccc(c(n1)Cl)Cl 908c89db0f0bd1eae616009dad221494 [0,2,0,0,0,0|2,0,0]=4 9728 B13R1.669 SCCNCc1ccc(c(n1)Cl)Cl 4fa6e2a46178bdd469826699cbc19e24 [0,2,0,0,0,0|2,0,0]=4 9729 B13R1.669 SCCOCc1cc(c(cn1)Br)Br 2187ae9f8268470a6656fd27caba1e57 [0,2,0,0,0,0|2,0,0]=4 9730 B13R1.669 SCCOCc1cc(c(cn1)Br)Cl 0f8a604dd85d42bd6afe3380b75192a4 [0,2,0,0,0,0|2,0,0]=4 9731 B13R1.669 SCCOCc1cc(c(cn1)Cl)Cl ce481439c3c7ff203ec542dd6fb656f5 [0,2,0,0,0,0|2,0,0]=4 9732 B13R1.669 SCCOCc1ccc(c(n1)Br)Cl c4dee8da7f1012429f21acb196f69925 [0,2,0,0,0,0|2,0,0]=4 9733 B13R1.669 SCCOCc1ccc(c(n1)Cl)Br 6f82114956d818e0c74982691204f0cf [0,2,0,0,0,0|2,0,0]=4 9734 B13R1.669 SCCOCc1ccc(c(n1)Cl)Cl b58904a8c1002c5952109ecd86154127 [0,2,0,0,0,0|2,0,0]=4 9735 B13R1.6 BrCCNCCc1cccc(c1)Br 197d6b3c8c2ad89b5630f7b73d647ead [0,2,0,0,0,0|2,0,0]=4 9736 B13R1.6 Brc1cccc(c1)CCNCCI 8a9f09e7a87df9b02c3e1f26690bda0e [0,2,0,0,0,0|2,0,0]=4 9737 B13R1.6 C#CCCCNc1cc(ccn1)Br b301bdae30dbf0d0ad00e10a66725928 [0,2,0,0,0,0|0,0,2]=4 9738 B13R1.6 C#CCCCNc1cc(ccn1)C 679e7acd9cac883c4e19f52ab950090b [0,2,0,0,0,0|0,0,2]=4 9739 B13R1.6 C#CCCCNc1cc(ccn1)Cl 0479d56fd6482310003605f9b260381b [0,2,0,0,0,0|0,0,2]=4 9740 B13R1.6 C#CCCCNc1cc(ccn1)F 142210ef834dc05900365d03ac4c9e68 [0,2,0,0,0,0|0,0,2]=4 9741 B13R1.6 C#CCCCNc1cc(ccn1)I f8893560cd88ce5a6e157dafa28f5711 [0,2,0,0,0,0|0,0,2]=4 9742 B13R1.6 C#CCCCNc1cccc(n1)Br 8dd9ccb7e3e2e31fe244d6516b2dcc62 [0,2,0,0,0,0|0,0,2]=4 9743 B13R1.6 C#CCCCNc1cccc(n1)C 26984cbc715fa58ca26513e2a03b8d9a [0,2,0,0,0,0|0,0,2]=4 9744 B13R1.6 C#CCCCNc1cccc(n1)Cl fe9ef60c36b3853b484cbbd94e24fa71 [0,2,0,0,0,0|0,0,2]=4 9745 B13R1.6 C#CCCCNc1cccc(n1)F 4e90fbd4239b7567562adbc0e409939a [0,2,0,0,0,0|0,0,2]=4 9746 B13R1.6 C#CCCCNc1cccc(n1)I 54d0ce31e19e04a04f3df7446207f41d [0,2,0,0,0,0|0,0,2]=4 9747 B13R1.6 C#CCCCOc1cc(ccn1)Br 5cd92ed8f2e1db23c2b5b8ea4c77f58c [0,2,0,0,0,0|0,0,2]=4 9748 B13R1.6 C#CCCCOc1cc(ccn1)C f89e0b722d12ba42e3fb36a508343fd9 [0,2,0,0,0,0|0,0,2]=4 9749 B13R1.6 C#CCCCOc1cc(ccn1)Cl ddab80b50a642e741c6d7f4eda127d8e [0,2,0,0,0,0|0,0,2]=4 9750 B13R1.6 C#CCCCOc1cc(ccn1)F eb279dea0aaee08c044e5aab878e7998 [0,2,0,0,0,0|0,0,2]=4 9751 B13R1.6 C#CCCCOc1cccc(n1)Br 7f3743f4247905d07a113396d43ade11 [0,2,0,0,0,0|0,0,2]=4 9752 B13R1.6 C#CCCCOc1cccc(n1)C e9f908c7e6864b98a146e80762b22b24 [0,2,0,0,0,0|0,0,2]=4 9753 B13R1.6 C#CCCCOc1cccc(n1)F d17765778a949ad54c480674847accaf [0,2,0,0,0,0|0,0,2]=4 9754 B13R1.6 C#CCCNCc1cc(ccn1)Br c149161cb05641efd22f8e3a465015d0 [0,2,0,0,0,0|0,0,2]=4 9755 B13R1.6 C#CCCNCc1cc(ccn1)C 4c555e23d23d116e5ae128d1d5f35897 [0,2,0,0,0,0|0,0,2]=4 9756 B13R1.6 C#CCCNCc1cc(ccn1)Cl ae8c4a9bc9a38d792a324e29b1a1d31d [0,2,0,0,0,0|0,0,2]=4 9757 B13R1.6 C#CCCNCc1cccc(n1)Br f507388c91ff0d45e9bf6e33bdaf6b2a [0,2,0,0,0,0|0,0,2]=4 9758 B13R1.6 C#CCCNCc1cccc(n1)C f066fbd00e35304d36452d7e6de2844c [0,2,0,0,0,0|0,0,2]=4 9759 B13R1.6 C#CCCNCc1cccc(n1)Cl 5ead47c6a02a3b5c2313c2f4fc31342d [0,2,0,0,0,0|0,0,2]=4 9760 B13R1.6 C#CCCNCc1cccc(n1)F 4d2160a2c63b2ad0bceeaba6ce61cb0f [0,2,0,0,0,0|0,0,2]=4 9761 B13R1.6 C#CCCOCc1cc(ccn1)Br eea9d2ce35d8c97df133539158500ea0 [0,2,0,0,0,0|0,0,2]=4 9762 B13R1.6 C#CCCOCc1cc(ccn1)C a483c3b63e017ef8e90d33930ea7a7bf [0,2,0,0,0,0|0,0,2]=4 9763 B13R1.6 C#CCCOCc1cc(ccn1)Cl 82644200e5c74e5c08ec649f2d9b73bc [0,2,0,0,0,0|0,0,2]=4 9764 B13R1.6 C#CCCOCc1cc(ccn1)F a8cc2f4f2addd23531d438412fd1ab3a [0,2,0,0,0,0|0,0,2]=4 9765 B13R1.6 C#CCCOCc1cc(ccn1)I 0dca5b9bcfc6095dbd7d140852f93c56 [0,2,0,0,0,0|0,0,2]=4 9766 B13R1.6 C#CCCOCc1cccc(n1)Br 5793f9e9e77a5506b60f79dc1eade434 [0,2,0,0,0,0|0,0,2]=4 9767 B13R1.6 C#CCCOCc1cccc(n1)C 96abd3fd0df3a2058c56d15e5e9cd12a [0,2,0,0,0,0|0,0,2]=4 9768 B13R1.6 C#CCCOCc1cccc(n1)Cl 87b6deb5a8328dbc75e9df77eee7753d [0,2,0,0,0,0|0,0,2]=4 9769 B13R1.6 C#CCCOCc1cccc(n1)F eda5605a0c367da3cb81737dc1ac19f4 [0,2,0,0,0,0|0,0,2]=4 9770 B13R1.6 C#CCCOCc1cccc(n1)I ea2f7d34f068927988f130edcb012809 [0,2,0,0,0,0|0,0,2]=4 9771 B13R1.6 C#CCNCCc1cccc(n1)C 83e94d35c3159b2d9e497e4695f2c594 [0,2,0,0,0,0|0,0,2]=4 9772 B13R1.6 C#CCOCCc1cc(ccn1)Br fe0daa26706c0ac7e9751089479d281a [0,2,0,0,0,0|0,0,2]=4 9773 B13R1.6 C#CCOCCc1cccc(n1)Br 40b0de182d6c1de0ec1a72d951976e71 [0,2,0,0,0,0|0,0,2]=4 9774 B13R1.6 C#CCOCCc1cccc(n1)C ec2d0642dfe42dd519e26cad9f8a89fb [0,2,0,0,0,0|0,0,2]=4 9775 B13R1.6 C#CCOCCc1cccc(n1)Cl 361850b28a12a5141f03f1b7b33a014b [0,2,0,0,0,0|0,0,2]=4 9776 B13R1.6 C/C=C/CNCc1cc(ccn1)Br 9a2fb088688d921a06740d3c2a6133ae [0,2,0,0,0,0|0,0,2]=4 9777 B13R1.6 C/C=C/CNCc1cc(ccn1)C 727dee34755ebc3802e29436d3af004e [0,2,0,0,0,0|0,0,2]=4 9778 B13R1.6 C/C=C/CNCc1cc(ccn1)Cl 4e9ce6c2197c2780a125472a35b47416 [0,2,0,0,0,0|0,0,2]=4 9779 B13R1.6 C/C=C/CNCc1cccc(n1)Br fc03b950c37d838a5c00f1e1c284e7b2 [0,2,0,0,0,0|0,0,2]=4 9780 B13R1.6 C/C=C/CNCc1cccc(n1)C 7f5d81a1e89c3d8dfb3074512fc4338d [0,2,0,0,0,0|0,0,2]=4 9781 B13R1.6 C/C=C/CNCc1cccc(n1)Cl 86eb98252c0e52b845d257df60a4c576 [0,2,0,0,0,0|0,0,2]=4 9782 B13R1.6 C/C=C/CNCc1cccc(n1)F 563a2abde2c206776a4d10d2836d4f03 [0,2,0,0,0,0|0,0,2]=4 9783 B13R1.6 C/C=C/COCc1cc(ccn1)Br 551ecf148275e7f53cbb78c01ad8caa6 [0,2,0,0,0,0|0,0,2]=4 9784 B13R1.6 C/C=C/COCc1cc(ccn1)C 28bce8f4a74ee466b93a743e6fc285ef [0,2,0,0,0,0|0,0,2]=4 9785 B13R1.6 C/C=C/COCc1cc(ccn1)Cl 9a66cda04eda6550ac548f06a069abe6 [0,2,0,0,0,0|0,0,2]=4 9786 B13R1.6 C/C=C/COCc1cc(ccn1)F d73079f8f610bdf19993d6d141d72550 [0,2,0,0,0,0|0,0,2]=4 9787 B13R1.6 C/C=C/COCc1cc(ccn1)I f3fa47df412a64188649de242a2e200b [0,2,0,0,0,0|0,0,2]=4 9788 B13R1.6 C/C=C/COCc1cccc(n1)Br d46f694ad8387739de764bbdc2302e38 [0,2,0,0,0,0|0,0,2]=4 9789 B13R1.6 C/C=C/COCc1cccc(n1)C 5f6f30bcc95510b604508c794d764a6c [0,2,0,0,0,0|0,0,2]=4 9790 B13R1.6 C/C=C/COCc1cccc(n1)Cl d598318b158bc38dd2763135633dab6d [0,2,0,0,0,0|0,0,2]=4 9791 B13R1.6 C/C=C/COCc1cccc(n1)F 1a98a18c6b80fafb52b1de76a58b6597 [0,2,0,0,0,0|0,0,2]=4 9792 B13R1.6 C/C=C/COCc1cccc(n1)I 8915fc50633dca0fca46ea97fdbec941 [0,2,0,0,0,0|0,0,2]=4 9793 B13R1.6 C/C=C\CNCc1cc(ccn1)Br 4b0d73fd42c09ac0dbc49940d6612be9 [0,2,0,0,0,0|0,0,2]=4 9794 B13R1.6 C/C=C\CNCc1cc(ccn1)C a41d71bdc6f740c338b382f7e7b6cd93 [0,2,0,0,0,0|0,0,2]=4 9795 B13R1.6 C/C=C\CNCc1cc(ccn1)Cl 079682a915af96c3d5f137539f0478dd [0,2,0,0,0,0|0,0,2]=4 9796 B13R1.6 C/C=C\CNCc1cccc(n1)Br 1f5288de6c92ab979603dd5003ed3d70 [0,2,0,0,0,0|0,0,2]=4 9797 B13R1.6 C/C=C\CNCc1cccc(n1)C e9e76456334c3f4691fc4539e3af0f89 [0,2,0,0,0,0|0,0,2]=4 9798 B13R1.6 C/C=C\CNCc1cccc(n1)Cl 2593b156b5abb1b41034784275b37188 [0,2,0,0,0,0|0,0,2]=4 9799 B13R1.6 C/C=C\CNCc1cccc(n1)F 7e36e5f7f5abb550da589ef1d5a3b7f7 [0,2,0,0,0,0|0,0,2]=4 9800 B13R1.6 C/C=C\COCc1cc(ccn1)Br 4537598f92656921c3143e6b118a7fee [0,2,0,0,0,0|0,0,2]=4 9801 B13R1.6 C/C=C\COCc1cc(ccn1)C 2a20313bd541c18744798ec2020f192b [0,2,0,0,0,0|0,0,2]=4 9802 B13R1.6 C/C=C\COCc1cc(ccn1)Cl 2a2d198e501968f24d4a4df44b64b76c [0,2,0,0,0,0|0,0,2]=4 9803 B13R1.6 C/C=C\COCc1cc(ccn1)F 596b1c800659db006d605370ef5c19d2 [0,2,0,0,0,0|0,0,2]=4 9804 B13R1.6 C/C=C\COCc1cc(ccn1)I 16f1b722d0505fa8fb83c5dd8a78aaea [0,2,0,0,0,0|0,0,2]=4 9805 B13R1.6 C/C=C\COCc1cccc(n1)Br a4341a1c2c2663cdf47c8ec60980e9f7 [0,2,0,0,0,0|0,0,2]=4 9806 B13R1.6 C/C=C\COCc1cccc(n1)C 4bf02a43f06f8d75e44ae0974c385b19 [0,2,0,0,0,0|0,0,2]=4 9807 B13R1.6 C/C=C\COCc1cccc(n1)Cl b5b9af2a74d26b97aab6f28aeef735a1 [0,2,0,0,0,0|0,0,2]=4 9808 B13R1.6 C/C=C\COCc1cccc(n1)F d411849e4fd997fd2434086ccdd41d66 [0,2,0,0,0,0|0,0,2]=4 9809 B13R1.6 C/C=C\COCc1cccc(n1)I d3aac8cbbc802d9d3a8254ee64d47bd9 [0,2,0,0,0,0|0,0,2]=4 9810 B13R1.6 C=CCCCNc1cc(ccn1)Br 9d1fcc21570d767aa1facd33929cbf99 [0,2,0,0,0,0|0,0,2]=4 9811 B13R1.6 C=CCCCNc1cc(ccn1)C 4b3ca0fed5f48fc694d65526c8840df3 [0,2,0,0,0,0|0,0,2]=4 9812 B13R1.6 C=CCCCNc1cc(ccn1)Cl 3e6f8b53c80887af9dabadab1ad53767 [0,2,0,0,0,0|0,0,2]=4 9813 B13R1.6 C=CCCCNc1cc(ccn1)F b8ed985421320d3eaf3097e9769983d7 [0,2,0,0,0,0|0,0,2]=4 9814 B13R1.6 C=CCCCNc1cc(ccn1)I 92a014dc2ad236c296f036da1df114b6 [0,2,0,0,0,0|0,0,2]=4 9815 B13R1.6 C=CCCCNc1cc(ccn1)O 4af4a60d7b817508ac957859fb34d1a3 [0,2,0,0,0,0|0,0,2]=4 9816 B13R1.6 C=CCCCNc1cccc(n1)Br 571157d3caca0196006037195922727b [0,2,0,0,0,0|0,0,2]=4 9817 B13R1.6 C=CCCCNc1cccc(n1)C 865747155f0a60cef1e556ba782d15dc [0,2,0,0,0,0|0,0,2]=4 9818 B13R1.6 C=CCCCNc1cccc(n1)Cl 0d71634cfc3e32fa03a72df02e771408 [0,2,0,0,0,0|0,0,2]=4 9819 B13R1.6 C=CCCCNc1cccc(n1)F 5a961648cedd3eaca2cd33a7e8e9712a [0,2,0,0,0,0|0,0,2]=4 9820 B13R1.6 C=CCCCNc1cccc(n1)I 2361f1910ed2f2961a78ece6abcb22b7 [0,2,0,0,0,0|0,0,2]=4 9821 B13R1.6 C=CCCCOc1cc(ccn1)Br e405b2a40efb27e1da42fa21128cccbc [0,2,0,0,0,0|0,0,2]=4 9822 B13R1.6 C=CCCCOc1cc(ccn1)C 42dd43b793309b03b05bb7d8bf09aebe [0,2,0,0,0,0|0,0,2]=4 9823 B13R1.6 C=CCCCOc1cc(ccn1)Cl 70a67c6e3608ae2e73a0066b11211eec [0,2,0,0,0,0|0,0,2]=4 9824 B13R1.6 C=CCCCOc1cc(ccn1)F d532a0b97f6cc532ee7bd9e9931bad2e [0,2,0,0,0,0|0,0,2]=4 9825 B13R1.6 C=CCCCOc1cccc(n1)Br 7161091293715373eca1e7e12c118a38 [0,2,0,0,0,0|0,0,2]=4 9826 B13R1.6 C=CCCCOc1cccc(n1)C f60d4a42f99ca884b2058945c965752f [0,2,0,0,0,0|0,0,2]=4 9827 B13R1.6 C=CCCCOc1cccc(n1)F ce298aabcebe1328541efc83414dca07 [0,2,0,0,0,0|0,0,2]=4 9828 B13R1.6 C=CCCNCc1cc(ccn1)Br 727faabf3c27ca426429daca65568f0a [0,2,0,0,0,0|0,0,2]=4 9829 B13R1.6 C=CCCNCc1cc(ccn1)C 372867adb609a02e03e59a160510bc6a [0,2,0,0,0,0|0,0,2]=4 9830 B13R1.6 C=CCCNCc1cc(ccn1)Cl 1acb0b746fc47cc039999302631354fc [0,2,0,0,0,0|0,0,2]=4 9831 B13R1.6 C=CCCNCc1cccc(n1)Br 42ef3ff914f466bbc725c093f6d3423e [0,2,0,0,0,0|0,0,2]=4 9832 B13R1.6 C=CCCNCc1cccc(n1)C a08a2f58d9afc675fdfa1336bd5430ea [0,2,0,0,0,0|0,0,2]=4 9833 B13R1.6 C=CCCNCc1cccc(n1)Cl c275fc6e6edada1ac8d003adb1a79805 [0,2,0,0,0,0|0,0,2]=4 9834 B13R1.6 C=CCCNCc1cccc(n1)F 233f0a4dfd9b440425666044f2a174b0 [0,2,0,0,0,0|0,0,2]=4 9835 B13R1.6 C=CCCOCc1cc(ccn1)Br 05baf27806f5bae7285a7034a1822e0c [0,2,0,0,0,0|0,0,2]=4 9836 B13R1.6 C=CCCOCc1cc(ccn1)C f6bee3e9e2e9be9dbf42648e00c3dbc0 [0,2,0,0,0,0|0,0,2]=4 9837 B13R1.6 C=CCCOCc1cc(ccn1)Cl 3b1120c1bfa26e452d527f4fb2692f9e [0,2,0,0,0,0|0,0,2]=4 9838 B13R1.6 C=CCCOCc1cc(ccn1)F ea6ffce88de301f4e5b3e85f6f6e12fa [0,2,0,0,0,0|0,0,2]=4 9839 B13R1.6 C=CCCOCc1cc(ccn1)I f5c152d5891152ad62fa023c19542c60 [0,2,0,0,0,0|0,0,2]=4 9840 B13R1.6 C=CCCOCc1cccc(n1)Br d26635d42c1ac60d99f694fd1369cdb9 [0,2,0,0,0,0|0,0,2]=4 9841 B13R1.6 C=CCCOCc1cccc(n1)C 6bf49c1c57e13f9edc7795f60dc9ee07 [0,2,0,0,0,0|0,0,2]=4 9842 B13R1.6 C=CCCOCc1cccc(n1)Cl 3335bd170ca001b029162355066014d2 [0,2,0,0,0,0|0,0,2]=4 9843 B13R1.6 C=CCCOCc1cccc(n1)F b74d3ce2ed620bfe3ddb4a68ea4480f0 [0,2,0,0,0,0|0,0,2]=4 9844 B13R1.6 C=CCCOCc1cccc(n1)I ccdb746b56cfa0604d63af003de30c63 [0,2,0,0,0,0|0,0,2]=4 9845 B13R1.6 C=CCNCCc1cccc(n1)C aad1abd4ad3f2a71e30c18f35749c8b7 [0,2,0,0,0,0|0,0,2]=4 9846 B13R1.6 C=CCOCCc1cc(ccn1)Br 7083c4e803cdc0ec7b10c6fc017727c9 [0,2,0,0,0,0|0,0,2]=4 9847 B13R1.6 C=CCOCCc1cccc(n1)Br 2bcbcd87bd954b503ee8f39c574c900d [0,2,0,0,0,0|0,0,2]=4 9848 B13R1.6 C=CCOCCc1cccc(n1)C 5f23743973658a0498671413b38941d9 [0,2,0,0,0,0|0,0,2]=4 9849 B13R1.6 C=CCOCCc1cccc(n1)Cl c701bf8698c4c4271fbcb5eae16364f0 [0,2,0,0,0,0|0,0,2]=4 9850 B13R1.6 CC#CCNCc1cc(ccn1)Br 56496b5ed2fb9ec108906ad712a751e9 [0,2,0,0,0,0|0,0,2]=4 9851 B13R1.6 CC#CCNCc1cc(ccn1)Cl 475e68f02bf7daf1440e58d058f9c59c [0,2,0,0,0,0|0,0,2]=4 9852 B13R1.6 CC#CCNCc1cccc(n1)Br 6ac88473fcafbfd1093d8257a683a6f5 [0,2,0,0,0,0|0,0,2]=4 9853 B13R1.6 CC#CCNCc1cccc(n1)C 15d7573b463c73d3252fe4f016a73023 [0,2,0,0,0,0|0,0,2]=4 9854 B13R1.6 CC#CCNCc1cccc(n1)Cl a4fc6f00a75126465d7e03112ba644d3 [0,2,0,0,0,0|0,0,2]=4 9855 B13R1.6 CC#CCNCc1cccc(n1)F 2f25e92661f64803f9c3e5a3dd9272ee [0,2,0,0,0,0|0,0,2]=4 9856 B13R1.6 CC#CCOCc1cc(ccn1)Br b048975c3540597c20c16595f985d1af [0,2,0,0,0,0|0,0,2]=4 9857 B13R1.6 CC#CCOCc1cc(ccn1)Cl e897ea0299a34a3a7a9ff1e3659c17e0 [0,2,0,0,0,0|0,0,2]=4 9858 B13R1.6 CC#CCOCc1cccc(n1)Br 448900116521599e4fa741d272a8924e [0,2,0,0,0,0|0,0,2]=4 9859 B13R1.6 CC#CCOCc1cccc(n1)C 0bcd4e78d24abfa771904f4b2b13b9dc [0,2,0,0,0,0|0,0,2]=4 9860 B13R1.6 CC#CCOCc1cccc(n1)Cl 014d435b3f3c300182ef48dc540d3f07 [0,2,0,0,0,0|0,0,2]=4 9861 B13R1.6 CC#CCOCc1cccc(n1)F 58e5d53a09f1c60670a79a467399268a [0,2,0,0,0,0|0,0,2]=4 9862 B13R1.6 CC/C=C/CNc1cc(ccn1)Br 8e30ac954be504e47a5fe72435576a73 [0,2,0,0,0,0|0,0,2]=4 9863 B13R1.6 CC/C=C/CNc1cc(ccn1)C 662a7833a1c39a5435338595a61b7b16 [0,2,0,0,0,0|0,0,2]=4 9864 B13R1.6 CC/C=C/CNc1cc(ccn1)Cl c522213b2a797886d85fccf9a6f021d8 [0,2,0,0,0,0|0,0,2]=4 9865 B13R1.6 CC/C=C/CNc1cc(ccn1)F 27babfb354258d89b893bb2e1cff6b5d [0,2,0,0,0,0|0,0,2]=4 9866 B13R1.6 CC/C=C/CNc1cc(ccn1)I 312dc5adf398bae54c33adfeb81375a7 [0,2,0,0,0,0|0,0,2]=4 9867 B13R1.6 CC/C=C/CNc1cccc(n1)Br 5c7a48e898e2d04614a75a98b98e8af0 [0,2,0,0,0,0|0,0,2]=4 9868 B13R1.6 CC/C=C/CNc1cccc(n1)C 457b854c1e739999b42129425dbd0d25 [0,2,0,0,0,0|0,0,2]=4 9869 B13R1.6 CC/C=C/CNc1cccc(n1)Cl 097ead9cf90685fe4ff20a5130a38715 [0,2,0,0,0,0|0,0,2]=4 9870 B13R1.6 CC/C=C/CNc1cccc(n1)F 866afb06ce658b4917aef129a05f0400 [0,2,0,0,0,0|0,0,2]=4 9871 B13R1.6 CC/C=C/CNc1cccc(n1)I 01d5e4cc5c8a03b8716f6968a3bcab39 [0,2,0,0,0,0|0,0,2]=4 9872 B13R1.6 CC/C=C/COc1cc(ccn1)Br 13d74491196312ff966fd5cae1951617 [0,2,0,0,0,0|0,0,2]=4 9873 B13R1.6 CC/C=C/COc1cc(ccn1)C ea3d14daafc62be37d960a1f4bf4ea1c [0,2,0,0,0,0|0,0,2]=4 9874 B13R1.6 CC/C=C/COc1cc(ccn1)Cl 6ab06aceffd22e743b7c1d3b67ba73a3 [0,2,0,0,0,0|0,0,2]=4 9875 B13R1.6 CC/C=C/COc1cc(ccn1)F c72a7ff258ab620abcb807b518988732 [0,2,0,0,0,0|0,0,2]=4 9876 B13R1.6 CC/C=C/COc1cccc(n1)Br 62c6bb6721b8fde40313210acffa090b [0,2,0,0,0,0|0,0,2]=4 9877 B13R1.6 CC/C=C/COc1cccc(n1)C d1f054e2b9da52ca88181b45975ed4da [0,2,0,0,0,0|0,0,2]=4 9878 B13R1.6 CC/C=C/COc1cccc(n1)F 053662e05d4b9a7b7ab85627aae35a63 [0,2,0,0,0,0|0,0,2]=4 9879 B13R1.6 CC=CCNCc1cc(ccn1)Br fc4459967aecf2d314c05b5d2bf92bb2 [0,2,0,0,0,0|0,0,2]=4 9880 B13R1.6 CC=CCNCc1cc(ccn1)C b99dd73ca11b752413737a9ccae5ebd6 [0,2,0,0,0,0|0,0,2]=4 9881 B13R1.6 CC=CCNCc1cc(ccn1)Cl dabcd177c8738e99fdb53771e18ad89e [0,2,0,0,0,0|0,0,2]=4 9882 B13R1.6 CC=CCNCc1cccc(n1)Br 9cd1fd9c212910a1818fac667a91ee99 [0,2,0,0,0,0|0,0,2]=4 9883 B13R1.6 CC=CCNCc1cccc(n1)C a1e73471c66eccb57cf82ad950d0fa84 [0,2,0,0,0,0|0,0,2]=4 9884 B13R1.6 CC=CCNCc1cccc(n1)Cl b204c7b8d43b31488f9cf83a50ee4ce9 [0,2,0,0,0,0|0,0,2]=4 9885 B13R1.6 CC=CCNCc1cccc(n1)F 926515b2953de24be24ed1950f1102af [0,2,0,0,0,0|0,0,2]=4 9886 B13R1.6 CC=CCOCc1cc(ccn1)Br f33ab9cd3c7ba8abaf75e64a9bbe5c5d [0,2,0,0,0,0|0,0,2]=4 9887 B13R1.6 CC=CCOCc1cc(ccn1)C 4fdd5b5b66c526e4eb0f94ff60fd344c [0,2,0,0,0,0|0,0,2]=4 9888 B13R1.6 CC=CCOCc1cc(ccn1)Cl 7303f3167fa77cad5ed9ae1ab52e777f [0,2,0,0,0,0|0,0,2]=4 9889 B13R1.6 CC=CCOCc1cccc(n1)Br f937988fea5f1014d61878b7141f3021 [0,2,0,0,0,0|0,0,2]=4 9890 B13R1.6 CC=CCOCc1cccc(n1)C 0152d52777618c90a38ce79eb6de0cb3 [0,2,0,0,0,0|0,0,2]=4 9891 B13R1.6 CC=CCOCc1cccc(n1)Cl e6fc670b114003fedfb35e192b766052 [0,2,0,0,0,0|0,0,2]=4 9892 B13R1.6 CC=CCOCc1cccc(n1)F f9d37b13bc0f71ab52ba74d728a0546b [0,2,0,0,0,0|0,0,2]=4 9893 B13R1.6 CCC#CCNc1cc(ccn1)F 27c7acc2015ed62e42770922f78f5acc [0,2,0,0,0,0|0,0,2]=4 9894 B13R1.6 CCC#CCOc1cc(ccn1)Br 961ca2d04894b7488136eba4f39568b7 [0,2,0,0,0,0|0,0,2]=4 9895 B13R1.6 CCCCCNc1c[n+](ccn1)[O-] c9439843444703f0637685266a5b15ea [0,2,0,0,0,0|1,0,0]=3 9896 B13R1.6 CCCCCNc1cc(ccn1)Br feccf6cb7ee98646187f9226e889a7cb [0,2,0,0,0,0|0,0,0]=2 9897 B13R1.6 CCCCCNc1cc(ccn1)C 5866dbb14a2479357a3631f1bd7989c0 [0,2,0,0,0,0|0,0,0]=2 9898 B13R1.6 CCCCCNc1cc(ccn1)Cl a7dc4b3e0fbefe6f28a8be2eb128b97b [0,2,0,0,0,0|0,0,0]=2 9899 B13R1.6 CCCCCNc1cc(ccn1)F b11a497c02efec075ff7de03f3fc4a1a [0,2,0,0,0,0|0,0,0]=2 9900 B13R1.6 CCCCCNc1cc(ccn1)I bd04dcc1047f081c347fafcc743fa54d [0,2,0,0,0,0|0,0,0]=2 9901 B13R1.6 CCCCCNc1cc(cnn1)Br c7993954eebfd1dfb2711e9568f182f8 [0,2,0,0,0,0|1,0,0]=3 9902 B13R1.6 CCCCCNc1cc(cnn1)C 00368f46729a016cefb0ed0d504bdd3a [0,2,0,0,0,0|1,0,0]=3 9903 B13R1.6 CCCCCNc1cc(cnn1)Cl 7e17ed766c85f0f5c39f18f1f8cdff3e [0,2,0,0,0,0|1,0,0]=3 9904 B13R1.6 CCCCCNc1cc(ncn1)Br e733ae3daacfddd0e560f73b852a959e [0,2,0,0,0,0|1,0,0]=3 9905 B13R1.6 CCCCCNc1cc(ncn1)C 659022dfe0ed7f93c6658711a7fbc660 [0,2,0,0,0,0|1,0,0]=3 9906 B13R1.6 CCCCCNc1cc(ncn1)Cl b9a90248f3716d9f3ca4a51b72b95e86 [0,2,0,0,0,0|1,0,0]=3 9907 B13R1.6 CCCCCNc1cc(ncn1)F 9cad1b3321bbc04c33c6a72dab4474ad [0,2,0,0,0,0|1,0,0]=3 9908 B13R1.6 CCCCCNc1cc(ncn1)I 34af9af428d9c9620b4c381cdde41901 [0,2,0,0,0,0|1,0,0]=3 9909 B13R1.6 CCCCCNc1cc[nH]c(=O)c1 9afdb3eef4fe7389f14036b0c209a7e3 [0,2,0,0,0,0|2,0,0]=4 9910 B13R1.6 CCCCCNc1cc[nH]c(=O)n1 c020fa79085c27a66debf5606308bc36 [0,2,0,0,0,0|1,0,0]=3 9911 B13R1.6 CCCCCNc1cc[nH]c(=S)c1 a743640b0aff4a57ad23daf1fbb62ace [0,2,0,0,0,0|2,0,0]=4 9912 B13R1.6 CCCCCNc1ccc[n+](c1)[O-] 16b0fdb94e97b7a0de41110dc21bce1c [0,2,0,0,0,0|2,0,0]=4 9913 B13R1.6 CCCCCNc1cccc(=O)[nH]1 061a8cfdf8b3c3a85fd1e3068fe292fc [0,2,0,0,0,0|0,0,1]=3 9914 B13R1.6 CCCCCNc1cccc(c1)Br e25c5679df4aebfb8230a9c45a0f1c2e [0,2,0,0,0,0|1,0,0]=3 9915 B13R1.6 CCCCCNc1cccc(c1)C 90ded62860b66c5d23f6c238d12f21f0 [0,2,0,0,0,0|1,0,0]=3 9916 B13R1.6 CCCCCNc1cccc(c1)Cl 573750f7b3b47458d32f54142f4b7f21 [0,2,0,0,0,0|1,0,0]=3 9917 B13R1.6 CCCCCNc1cccc(c1)F cc45f88bce84aeaa26291add2afa19c7 [0,2,0,0,0,0|1,0,0]=3 9918 B13R1.6 CCCCCNc1cccc(c1)I 3cab09806d0f96a8622c5b62d5aa79e8 [0,2,0,0,0,0|1,0,0]=3 9919 B13R1.6 CCCCCNc1cccc(c1)O b37d97c85f83c771c4c409a4c5b334bf [0,2,0,0,0,0|1,0,0]=3 9920 B13R1.6 CCCCCNc1cccc(c1)S 4ad3b15cc25abfcc6d5b464c600f4456 [0,2,0,0,0,0|1,0,0]=3 9921 B13R1.6 CCCCCNc1cccc(n1)Br 9b1728d06152f48883d2812d99ad4d02 [0,2,0,0,0,0|0,0,0]=2 9922 B13R1.6 CCCCCNc1cccc(n1)C 70012ab0ee4af6d1b7365c55efcb97b6 [0,2,0,0,0,0|0,0,0]=2 9923 B13R1.6 CCCCCNc1cccc(n1)Cl dea9790273aee5bd3aaa2c3b38715097 [0,2,0,0,0,0|0,0,0]=2 9924 B13R1.6 CCCCCNc1cccc(n1)F b6b68ea93c927db4effc3609bf8de69e [0,2,0,0,0,0|0,0,0]=2 9925 B13R1.6 CCCCCNc1cccc(n1)I eeb8494e34c54dbc5d555c30c4d0dc88 [0,2,0,0,0,0|0,0,0]=2 9926 B13R1.6 CCCCCNc1ccnc(c1)Br 39984671add3b35b566f2840368e19ae [0,2,0,0,0,0|2,0,0]=4 9927 B13R1.6 CCCCCNc1ccnc(c1)C d0c34196a00fbbe7166e66493fed2173 [0,2,0,0,0,0|2,0,0]=4 9928 B13R1.6 CCCCCNc1ccnc(c1)Cl 76d708cf6b276ca793908f0af2f80f63 [0,2,0,0,0,0|2,0,0]=4 9929 B13R1.6 CCCCCNc1ccnc(c1)F 886cdcdee8469a6d1fdb3c4061fec7d4 [0,2,0,0,0,0|2,0,0]=4 9930 B13R1.6 CCCCCNc1ccnc(c1)I e9264691b8729719396f7e1d5c6f63bf [0,2,0,0,0,0|2,0,0]=4 9931 B13R1.6 CCCCCNc1ccnc(n1)Br e6782d6e643e76a82e7b2658c7a7652d [0,2,0,0,0,0|1,0,0]=3 9932 B13R1.6 CCCCCNc1ccnc(n1)C 1c31ff713bd0a0fadbd71d2e4e369b84 [0,2,0,0,0,0|1,0,0]=3 9933 B13R1.6 CCCCCNc1ccnc(n1)Cl 864950067c1bf483cdbcb6e514bf7f34 [0,2,0,0,0,0|1,0,0]=3 9934 B13R1.6 CCCCCNc1ccnc(n1)F 38e01072cb377be98f101f9fa347e367 [0,2,0,0,0,0|1,0,0]=3 9935 B13R1.6 CCCCCNc1ccnc(n1)S ce0632cd8c00a55ec4dd7f24bb805772 [0,2,0,0,0,0|1,0,0]=3 9936 B13R1.6 CCCCCNc1cn[nH]c(=O)n1 eb60799549bfe40fa78c4803dcce42a2 [0,2,0,0,0,0|2,0,0]=4 9937 B13R1.6 CCCCCNc1cncc(c1)Br 8640cc0eb13a2cf4269552c32dc9fc47 [0,2,0,0,0,0|2,0,0]=4 9938 B13R1.6 CCCCCNc1cncc(c1)C 7f1600b9db4d594968ebdfc1d1045243 [0,2,0,0,0,0|2,0,0]=4 9939 B13R1.6 CCCCCNc1cncc(c1)Cl 963e37c6cd6a5a3603e3c53262b4597c [0,2,0,0,0,0|2,0,0]=4 9940 B13R1.6 CCCCCNc1cncc(c1)F fc825cca07ac7131cbfde32cede8f5e8 [0,2,0,0,0,0|2,0,0]=4 9941 B13R1.6 CCCCCNc1cncc(c1)I 2e1d659bc6c51470f7569ff008c52b6e [0,2,0,0,0,0|2,0,0]=4 9942 B13R1.6 CCCCCNc1cncc(n1)Br 421554dd098cd4085d097beff02da310 [0,2,0,0,0,0|1,0,0]=3 9943 B13R1.6 CCCCCNc1cncc(n1)C a8bddb2d73ad0a1580794d98ba424008 [0,2,0,0,0,0|1,0,0]=3 9944 B13R1.6 CCCCCNc1cncc(n1)Cl 0df67dec23fcf907cea36ac225ae5878 [0,2,0,0,0,0|1,0,0]=3 9945 B13R1.6 CCCCCNc1cncc(n1)F 6860a7b68e56516ac42a16a9e044f40f [0,2,0,0,0,0|1,0,0]=3 9946 B13R1.6 CCCCCNc1cnnc(n1)C 5c6dd707d9f796bb65c57b5b623dcf03 [0,2,0,0,0,0|2,0,0]=4 9947 B13R1.6 CCCCCNc1cnnc(n1)Cl 63bc54da766d26dde352131d91f4796e [0,2,0,0,0,0|2,0,0]=4 9948 B13R1.6 CCCCCNc1nc[nH]c(=O)n1 b097c1e4307db3e8c1f9d936a74f0e1c [0,2,0,0,0,0|2,0,0]=4 9949 B13R1.6 CCCCCNc1nccc(=O)[nH]1 3d31eb6f49424eae535a180c61bc184c [0,2,0,0,0,0|1,0,0]=3 9950 B13R1.6 CCCCCNc1nccc(n1)Br ba93787478acb020282631d462e29263 [0,2,0,0,0,0|1,0,0]=3 9951 B13R1.6 CCCCCNc1nccc(n1)C 7a28bc556f7b117273e2c72ece1acf69 [0,2,0,0,0,0|1,0,0]=3 9952 B13R1.6 CCCCCNc1nccc(n1)Cl 657ba5a40fd249750137bb4eb8a0a8df [0,2,0,0,0,0|1,0,0]=3 9953 B13R1.6 CCCCCNc1nccc(n1)F 5e5eccb852e57ab72234a7310459c9a2 [0,2,0,0,0,0|1,0,0]=3 9954 B13R1.6 CCCCCNc1nccc(n1)I 1be4c302b822763fc6dc618f5435e023 [0,2,0,0,0,0|1,0,0]=3 9955 B13R1.6 CCCCCNc1nccc(n1)S f033965f3f40ef5aa130ca3b97576746 [0,2,0,0,0,0|1,0,0]=3 9956 B13R1.6 CCCCCNc1ncnc(n1)Cl 0921885cbc0620004367c71b751b7647 [0,2,0,0,0,0|2,0,0]=4 9957 B13R1.6 CCCCCNc1ncnc(n1)S e1495acd53a180b09aae44be2c031e6b [0,2,0,0,0,0|2,0,0]=4 9958 B13R1.6 CCCCCOc1cc(ccn1)Br 622d1efb764426021cbef8e0005c0adb [0,2,0,0,0,0|0,0,0]=2 9959 B13R1.6 CCCCCOc1cc(ccn1)C a99b432978924ecd3c12462afcce6409 [0,2,0,0,0,0|0,0,0]=2 9960 B13R1.6 CCCCCOc1cc(ccn1)Cl 199a0b735d59525f3122ec778bd9bb88 [0,2,0,0,0,0|0,0,0]=2 9961 B13R1.6 CCCCCOc1cc(ccn1)F 7f154ef77416369a6f8831c6c51ab600 [0,2,0,0,0,0|0,0,0]=2 9962 B13R1.6 CCCCCOc1cc(ncn1)Br 52207272df5cad2f46487c7fefbbe04b [0,2,0,0,0,0|1,0,0]=3 9963 B13R1.6 CCCCCOc1cc(ncn1)C c53d73d8c2d64e5791429021fa9dd23f [0,2,0,0,0,0|1,0,0]=3 9964 B13R1.6 CCCCCOc1cc(ncn1)Cl 8c149106cd8805052446915325d6b0cb [0,2,0,0,0,0|1,0,0]=3 9965 B13R1.6 CCCCCOc1ccc[n+](c1)[O-] aa69c45f735eca95d9f9ff6d8c231654 [0,2,0,0,0,0|2,0,0]=4 9966 B13R1.6 CCCCCOc1cccc(=O)[nH]1 efa1275f5ccb4d4e3e4fcc3ce55a2f85 [0,2,0,0,0,0|0,0,1]=3 9967 B13R1.6 CCCCCOc1cccc(c1)Br e7333ea95aa551c2511ecae95cabb5fb [0,2,0,0,0,0|1,0,0]=3 9968 B13R1.6 CCCCCOc1cccc(c1)C b1149b4680d107baeb74a61ca0cfbaca [0,2,0,0,0,0|1,0,0]=3 9969 B13R1.6 CCCCCOc1cccc(c1)Cl 7d564bd0a00c1d61770abe5e91841fd6 [0,2,0,0,0,0|1,0,0]=3 9970 B13R1.6 CCCCCOc1cccc(c1)F 78577f6711392062b139a0452035d431 [0,2,0,0,0,0|1,0,0]=3 9971 B13R1.6 CCCCCOc1cccc(c1)I 7a90fd5bf21017e44019f2f6a5f69537 [0,2,0,0,0,0|1,0,0]=3 9972 B13R1.6 CCCCCOc1cccc(c1)S 48135047bdce92f027a702bcef8929f7 [0,2,0,0,0,0|1,0,0]=3 9973 B13R1.6 CCCCCOc1cccc(n1)Br 6a1682ecc7538f90d94ba15ec0d0a992 [0,2,0,0,0,0|0,0,0]=2 9974 B13R1.6 CCCCCOc1cccc(n1)C 7e353cc0ecfd4f4fcea63065a184d797 [0,2,0,0,0,0|0,0,0]=2 9975 B13R1.6 CCCCCOc1cccc(n1)F e83a8939e5df735457e755041186ff6f [0,2,0,0,0,0|0,0,0]=2 9976 B13R1.6 CCCCCOc1ccnc(c1)Br aea9d0a1ed99b11c8dc2d1e64aa0f5ea [0,2,0,0,0,0|2,0,0]=4 9977 B13R1.6 CCCCCOc1ccnc(c1)C aa3923c8bc5bc142e64dc7ab1807fae6 [0,2,0,0,0,0|2,0,0]=4 9978 B13R1.6 CCCCCOc1ccnc(c1)Cl e349dc2d2304e50b16bf6c84afe93776 [0,2,0,0,0,0|2,0,0]=4 9979 B13R1.6 CCCCCOc1ccnc(c1)F 2e34ef241621a5a62e9778cd994c8e69 [0,2,0,0,0,0|2,0,0]=4 9980 B13R1.6 CCCCCOc1ccnc(n1)C e068a3b43a7a140cab24e4f9c20203f0 [0,2,0,0,0,0|1,0,0]=3 9981 B13R1.6 CCCCCOc1ccnc(n1)Cl c7228c85e52ecfbca7d376f8aae6bbcd [0,2,0,0,0,0|1,0,0]=3 9982 B13R1.6 CCCCCOc1cncc(c1)Br 318d5c43520dcf16e9de2022f1a89804 [0,2,0,0,0,0|2,0,0]=4 9983 B13R1.6 CCCCCOc1cncc(c1)C dd3bd0604d5d72be2b7b72f5dfba1aa3 [0,2,0,0,0,0|2,0,0]=4 9984 B13R1.6 CCCCCOc1cncc(c1)Cl 2d2cbd14ddb7b1f9159c0f8f4fa71f8d [0,2,0,0,0,0|2,0,0]=4 9985 B13R1.6 CCCCCOc1cncc(c1)F 9f44dcb1f2eff6c357ef1c83d14a425f [0,2,0,0,0,0|2,0,0]=4 9986 B13R1.6 CCCCCOc1cncc(c1)I 9e4547532baf3f3caa3a125bb64189bc [0,2,0,0,0,0|2,0,0]=4 9987 B13R1.6 CCCCCOc1cncc(n1)Br 55cd93015a29544862bc394f7de605c3 [0,2,0,0,0,0|1,0,0]=3 9988 B13R1.6 CCCCCOc1cncc(n1)Cl 9364ed7d3949568db7473aafbf6c1831 [0,2,0,0,0,0|1,0,0]=3 9989 B13R1.6 CCCCCOc1nccc(n1)Cl 877633077f92652edf136c5286cd1942 [0,2,0,0,0,0|1,0,0]=3 9990 B13R1.6 CCCCCOc1nccc(n1)S 0e4c6dc10d7af7dd8075a86b15c8c666 [0,2,0,0,0,0|1,0,0]=3 9991 B13R1.6 CCCCNCc1cc(ccn1)Br 125fe59e156220d139138e453552de26 [0,2,0,0,0,0|0,0,0]=2 9992 B13R1.6 CCCCNCc1cc(ccn1)C 95bd77345c8033991a281a9898893898 [0,2,0,0,0,0|0,0,0]=2 9993 B13R1.6 CCCCNCc1cc(ccn1)Cl 32a74870ee10d0f1dd2200e8f163aced [0,2,0,0,0,0|0,0,0]=2 9994 B13R1.6 CCCCNCc1cc(cnn1)C 4d0324c6674e38524ae521f7bac26fb5 [0,2,0,0,0,0|1,0,0]=3 9995 B13R1.6 CCCCNCc1cc[nH]c(=O)c1 79709f2a635a7344bcdba0677b1c98b3 [0,2,0,0,0,0|2,0,0]=4 9996 B13R1.6 CCCCNCc1cc[nH]c(=O)n1 5e15c5325f13ae0a99a877acb5f56313 [0,2,0,0,0,0|1,0,0]=3 9997 B13R1.6 CCCCNCc1ccc[n+](c1)[O-] acfe5838aee0db5fed1d111a8e701328 [0,2,0,0,0,0|2,0,0]=4 9998 B13R1.6 CCCCNCc1cccc(c1)Br e4cfc279cec1c38687aabe7dde977467 [0,2,0,0,0,0|1,0,0]=3 9999 B13R1.6 CCCCNCc1cccc(c1)C 856001d358db010c3288786e4c699b84 [0,2,0,0,0,0|1,0,0]=3 10000 B13R1.6 CCCCNCc1cccc(c1)Cl c842ccfec97732d204defd93e4bc23cc [0,2,0,0,0,0|1,0,0]=3 10001 B13R1.6 CCCCNCc1cccc(c1)F 19f9bbcc92648660d092dad7af571542 [0,2,0,0,0,0|1,0,0]=3 10002 B13R1.6 CCCCNCc1cccc(c1)I 2c72c6b3ccc2697776d66d905723a683 [0,2,0,0,0,0|1,0,0]=3 10003 B13R1.6 CCCCNCc1cccc(n1)Br 8830c2a1d0f8f6a561d5850eb0f0af22 [0,2,0,0,0,0|0,0,0]=2 10004 B13R1.6 CCCCNCc1cccc(n1)C 914cdfd334e9a30cfd53c05665b4ec0b [0,2,0,0,0,0|0,0,0]=2 10005 B13R1.6 CCCCNCc1cccc(n1)Cl c960652668e977dd93c94575d80feb24 [0,2,0,0,0,0|0,0,0]=2 10006 B13R1.6 CCCCNCc1cccc(n1)F 8bc04534c5b4c31d8b247c0477aef8f1 [0,2,0,0,0,0|0,0,0]=2 10007 B13R1.6 CCCCNCc1ccnc(c1)Br eb136c0c6dd823ec17d43bc951062308 [0,2,0,0,0,0|2,0,0]=4 10008 B13R1.6 CCCCNCc1ccnc(c1)C dd22dab55df5fc71164676d33fd0c582 [0,2,0,0,0,0|2,0,0]=4 10009 B13R1.6 CCCCNCc1ccnc(c1)Cl e33f26a9fbdf0971c9e3dd2a5f5af171 [0,2,0,0,0,0|2,0,0]=4 10010 B13R1.6 CCCCNCc1ccnc(c1)F 2ddaf2e578861b213d012e37c36eb341 [0,2,0,0,0,0|2,0,0]=4 10011 B13R1.6 CCCCNCc1ccnc(n1)C df46e6b1a8458c02e3270be84f66a817 [0,2,0,0,0,0|1,0,0]=3 10012 B13R1.6 CCCCNCc1ccnc(n1)Cl 66be29686992f3c15d8d6ccbc00bdb46 [0,2,0,0,0,0|1,0,0]=3 10013 B13R1.6 CCCCNCc1cncc(c1)Br bfb08ce51f4b4fc6a1f95f352be382bb [0,2,0,0,0,0|2,0,0]=4 10014 B13R1.6 CCCCNCc1cncc(c1)C 714318af787d36cc3eb8ae950ac97560 [0,2,0,0,0,0|2,0,0]=4 10015 B13R1.6 CCCCNCc1cncc(c1)Cl b485781044a0886f0840da16d8bb3796 [0,2,0,0,0,0|2,0,0]=4 10016 B13R1.6 CCCCNCc1cncc(c1)F 35ccfdefef1798ca4d1308d932e296ad [0,2,0,0,0,0|2,0,0]=4 10017 B13R1.6 CCCCNCc1cncc(n1)Cl 1a9894fb8fd0ae6b1584b5f7cd3816d4 [0,2,0,0,0,0|1,0,0]=3 10018 B13R1.6 CCCCNCc1nccc(n1)C 0940969c061a9db863ea83c555872a89 [0,2,0,0,0,0|1,0,0]=3 10019 B13R1.6 CCCCNCc1nccc(n1)Cl 5d776fa10da418a08d871ed4da6d7d5c [0,2,0,0,0,0|1,0,0]=3 10020 B13R1.6 CCCCOCc1cc(ccn1)Br e457db6ad4ecbbbe11e444326810a133 [0,2,0,0,0,0|0,0,0]=2 10021 B13R1.6 CCCCOCc1cc(ccn1)C 9d39fc7de0ce63a33d3bc4572e28c7cf [0,2,0,0,0,0|0,0,0]=2 10022 B13R1.6 CCCCOCc1cc(ccn1)Cl 9944cffbe1405fdb54e093bce307392f [0,2,0,0,0,0|0,0,0]=2 10023 B13R1.6 CCCCOCc1cc(ccn1)F df525079f55a26774d291707ed509b38 [0,2,0,0,0,0|0,0,0]=2 10024 B13R1.6 CCCCOCc1cc(ccn1)I 4e0a8d5bf67870ee4cafdea54b290c1d [0,2,0,0,0,0|0,0,0]=2 10025 B13R1.6 CCCCOCc1cc(cnn1)C b6370ce6d6bf6815289f01453c6c7447 [0,2,0,0,0,0|1,0,0]=3 10026 B13R1.6 CCCCOCc1cc(ncn1)C 770acde3f093e1ca6aec3d5d17a92777 [0,2,0,0,0,0|1,0,0]=3 10027 B13R1.6 CCCCOCc1cc(ncn1)Cl 628bf62849d09d4216eccd083fa0872c [0,2,0,0,0,0|1,0,0]=3 10028 B13R1.6 CCCCOCc1cc[nH]c(=O)c1 5fe7061a39e5572c049b413f2fad2fd1 [0,2,0,0,0,0|2,0,0]=4 10029 B13R1.6 CCCCOCc1ccc[n+](c1)[O-] ffc9acff2f8547537ae4dd6fc623eb45 [0,2,0,0,0,0|2,0,0]=4 10030 B13R1.6 CCCCOCc1cccc(c1)Br 575063df90c05b42625c19dcb4477157 [0,2,0,0,0,0|1,0,0]=3 10031 B13R1.6 CCCCOCc1cccc(c1)C 2d07d1d37dabd008e812a7c5ac2afc6f [0,2,0,0,0,0|1,0,0]=3 10032 B13R1.6 CCCCOCc1cccc(c1)Cl d9dbafdf71c8a3c22ab0b549d5535088 [0,2,0,0,0,0|1,0,0]=3 10033 B13R1.6 CCCCOCc1cccc(c1)F aa30864e46d097125efa7d3ba08f3aaa [0,2,0,0,0,0|1,0,0]=3 10034 B13R1.6 CCCCOCc1cccc(c1)I 7099ebc40a2b9e66556b3da67a4467d8 [0,2,0,0,0,0|1,0,0]=3 10035 B13R1.6 CCCCOCc1cccc(n1)Br cfd8c0ec9cffe61d424b2c0688527b8d [0,2,0,0,0,0|0,0,0]=2 10036 B13R1.6 CCCCOCc1cccc(n1)C 57432e226a623b07c5f859b4c6f15b1e [0,2,0,0,0,0|0,0,0]=2 10037 B13R1.6 CCCCOCc1cccc(n1)Cl 9c473d4eff32b39aaaf5be5b0ca0c4e3 [0,2,0,0,0,0|0,0,0]=2 10038 B13R1.6 CCCCOCc1cccc(n1)F 742f9eb9bbc191ed9b594e879ee979ab [0,2,0,0,0,0|0,0,0]=2 10039 B13R1.6 CCCCOCc1cccc(n1)I 158e43b204e4204283e69bdca473fc73 [0,2,0,0,0,0|0,0,0]=2 10040 B13R1.6 CCCCOCc1ccnc(=O)[nH]1 db4fcc0f6d4ef1bc25f332343104d8c7 [0,2,0,0,0,0|1,0,1]=4 10041 B13R1.6 CCCCOCc1ccnc(c1)Br 80b377fb4524e6e5f9a6b0bbd28b0584 [0,2,0,0,0,0|2,0,0]=4 10042 B13R1.6 CCCCOCc1ccnc(c1)C 61076e90039b1d3959f7a485c204b29a [0,2,0,0,0,0|2,0,0]=4 10043 B13R1.6 CCCCOCc1ccnc(c1)Cl 602c30098405451454a7e0843cd083e5 [0,2,0,0,0,0|2,0,0]=4 10044 B13R1.6 CCCCOCc1ccnc(c1)F 4d650308ebc1c9522e4d8d1f36aaeba2 [0,2,0,0,0,0|2,0,0]=4 10045 B13R1.6 CCCCOCc1ccnc(n1)C 500477dffde7ba787d2d5603b13fb1e2 [0,2,0,0,0,0|1,0,0]=3 10046 B13R1.6 CCCCOCc1ccnc(n1)Cl a812f299ef688c156cf9d8b8c64ab52f [0,2,0,0,0,0|1,0,0]=3 10047 B13R1.6 CCCCOCc1cncc(c1)Br cc37cc4d1a228fe11bc503d58966fcfa [0,2,0,0,0,0|2,0,0]=4 10048 B13R1.6 CCCCOCc1cncc(c1)C 3532fab1916419dc9661a3fc9c24b5a2 [0,2,0,0,0,0|2,0,0]=4 10049 B13R1.6 CCCCOCc1cncc(c1)Cl 00fa68b6bec92b7fec2a68c75822e8a9 [0,2,0,0,0,0|2,0,0]=4 10050 B13R1.6 CCCCOCc1cncc(c1)F d2d89027f13fb29cea734e59bbeddb23 [0,2,0,0,0,0|2,0,0]=4 10051 B13R1.6 CCCCOCc1cncc(c1)I e1e3ea1cbac51fc94e68e0e8c48597d2 [0,2,0,0,0,0|2,0,0]=4 10052 B13R1.6 CCCCOCc1cncc(n1)Br df09c9a0f37061929ec86f506a0d30a7 [0,2,0,0,0,0|1,0,0]=3 10053 B13R1.6 CCCCOCc1cncc(n1)Cl 6dd3182e7a394017b2595a5b3dd01f79 [0,2,0,0,0,0|1,0,0]=3 10054 B13R1.6 CCCCOCc1nccc(n1)C 601ef43d0eb55d410b9a21ed4fa2c09b [0,2,0,0,0,0|1,0,0]=3 10055 B13R1.6 CCCCOCc1nccc(n1)Cl bb22f7667056ab2c25e243068c48802a [0,2,0,0,0,0|1,0,0]=3 10056 B13R1.6 CCCNCCc1cccc(c1)Br 29ee5963fbc2b7ff2660166095d0f947 [0,2,0,0,0,0|1,0,0]=3 10057 B13R1.6 CCCNCCc1cccc(c1)C e424052a4faeea3c32ca5211c663272d [0,2,0,0,0,0|1,0,0]=3 10058 B13R1.6 CCCNCCc1cccc(c1)Cl 81fe509e557a8d2567bf07dbdfbf87a9 [0,2,0,0,0,0|1,0,0]=3 10059 B13R1.6 CCCNCCc1cccc(c1)F 1fceda4763e375f5d115f6e7e4ef88a0 [0,2,0,0,0,0|1,0,0]=3 10060 B13R1.6 CCCNCCc1cccc(c1)I 43a8e7b3d1ef9dd0d16384978a631250 [0,2,0,0,0,0|1,0,0]=3 10061 B13R1.6 CCCNCCc1cccc(n1)C a8e43caa7b6402d0cfdfa4baf2f09c56 [0,2,0,0,0,0|0,0,0]=2 10062 B13R1.6 CCCNCCc1ccnc(c1)C e82d745a40b38d83af391b682e6aedd7 [0,2,0,0,0,0|2,0,0]=4 10063 B13R1.6 CCCNCCc1cncc(c1)F c7afd2fbf73fb0b6d6b1b5fcf304bb7b [0,2,0,0,0,0|2,0,0]=4 10064 B13R1.6 CCCNCCc1cncc(n1)Cl daa910853c27e23049bfb325a1f031d8 [0,2,0,0,0,0|1,0,0]=3 10065 B13R1.6 CCCOCCc1cc(ccn1)Br e4d3ccc023ebeba7c36068e2bd71e14a [0,2,0,0,0,0|0,0,0]=2 10066 B13R1.6 CCCOCCc1cccc(c1)Br 472e66ed6019162da37846b891ca4f92 [0,2,0,0,0,0|1,0,0]=3 10067 B13R1.6 CCCOCCc1cccc(c1)C d552fd8338f474efe995c47cfd8e44a6 [0,2,0,0,0,0|1,0,0]=3 10068 B13R1.6 CCCOCCc1cccc(c1)Cl b5942d4f019b75f0a54431df184a8d2d [0,2,0,0,0,0|1,0,0]=3 10069 B13R1.6 CCCOCCc1cccc(c1)F d0c9f3bd992bab63c6470c4cf9daf4a9 [0,2,0,0,0,0|1,0,0]=3 10070 B13R1.6 CCCOCCc1cccc(c1)I f2ad0b971e8fc825f5ae45711686d3fa [0,2,0,0,0,0|1,0,0]=3 10071 B13R1.6 CCCOCCc1cccc(n1)Br 4fd378333251aa47b0a3e2b77c7770b7 [0,2,0,0,0,0|0,0,0]=2 10072 B13R1.6 CCCOCCc1cccc(n1)C e13b856777d64e2081b4aa4abeda0248 [0,2,0,0,0,0|0,0,0]=2 10073 B13R1.6 CCCOCCc1cccc(n1)Cl e5f5eeb781047b210941bdd1950668c4 [0,2,0,0,0,0|0,0,0]=2 10074 B13R1.6 CCCOCCc1ccnc(c1)Cl a5a0f95a6fd3e9f38d3593532b98e434 [0,2,0,0,0,0|2,0,0]=4 10075 B13R1.6 CCCOCCc1cncc(c1)F a98b4f2a9b2953805c2e6474b9fa54a7 [0,2,0,0,0,0|2,0,0]=4 10076 B13R1.6 CCCOCCc1cncc(n1)Cl dbf0bcb200d8fb54b38944e2c3375926 [0,2,0,0,0,0|1,0,0]=3 10077 B13R1.6 CCNCCCc1cccc(c1)Br 1ec5c8533f0046ced622270b0b38d4bc [0,2,0,0,0,0|1,0,0]=3 10078 B13R1.6 CCNCCCc1cccc(c1)C 796a7e41d7e7d02f283bb4a6d9f50135 [0,2,0,0,0,0|1,0,0]=3 10079 B13R1.6 CCNCCCc1cccc(c1)Cl 8a91d52b6a634c7639648e62355a3091 [0,2,0,0,0,0|1,0,0]=3 10080 B13R1.6 CCNCCCc1cccc(c1)F a116d2cc622dabe580bf634af1fc004b [0,2,0,0,0,0|1,0,0]=3 10081 B13R1.6 CCNCCOc1cccc(c1)Br 120f5428af0ab4d79a1a729f46eca9bd [0,2,0,0,0,0|2,0,0]=4 10082 B13R1.6 CCNCCOc1cccc(c1)C 706e901881a602716adcac6556e8858c [0,2,0,0,0,0|2,0,0]=4 10083 B13R1.6 CCNCCOc1cccc(c1)Cl 71d43d948fd372f58b78094833044940 [0,2,0,0,0,0|2,0,0]=4 10084 B13R1.6 CCNCCOc1cccc(c1)F fd9a2429c5ab49f94c6b3e5f213a8b71 [0,2,0,0,0,0|2,0,0]=4 10085 B13R1.6 CCOCCCc1cccc(c1)Br 8680f4b5705c6eea362d4c60872a31d8 [0,2,0,0,0,0|1,0,0]=3 10086 B13R1.6 CCOCCCc1cccc(c1)C a73ed073a6ac3506d1865811b23f7665 [0,2,0,0,0,0|1,0,0]=3 10087 B13R1.6 CCOCCCc1cccc(c1)Cl aac42f96c49b3e42f23e8afa48f1720f [0,2,0,0,0,0|1,0,0]=3 10088 B13R1.6 CCOCCCc1cccc(c1)F 8e0c0afae2e652ba405335511fd17c81 [0,2,0,0,0,0|1,0,0]=3 10089 B13R1.6 CCOCCCc1cccc(n1)C a24968bc4f164b75460a9cf0aa7c4947 [0,2,0,0,0,0|0,0,0]=2 10090 B13R1.6 CCOCCCc1ccnc(c1)C 49ebb242c6d1eb56a6bd1aacc44e66d6 [0,2,0,0,0,0|2,0,0]=4 10091 B13R1.6 CCOCCNc1c[n+](ccn1)[O-] 4a91beb0b24d1e6f93f0627ff6f80636 [0,2,0,0,0,0|2,0,0]=4 10092 B13R1.6 CCOCCNc1cc(ccn1)Br 6e02aa7024ac8c34f0938b7028190f6b [0,2,0,0,0,0|1,0,0]=3 10093 B13R1.6 CCOCCNc1cc(ccn1)C 190d30ac479eb3217aa0dc545d49b759 [0,2,0,0,0,0|1,0,0]=3 10094 B13R1.6 CCOCCNc1cc(ccn1)Cl ace90efced5f3e1f1feae271bc17af98 [0,2,0,0,0,0|1,0,0]=3 10095 B13R1.6 CCOCCNc1cc(ccn1)F 064e9890d241df104897df24ea41eeca [0,2,0,0,0,0|1,0,0]=3 10096 B13R1.6 CCOCCNc1cc(ccn1)I 133c459eac1c0317ad5b73fdcb89bb71 [0,2,0,0,0,0|1,0,0]=3 10097 B13R1.6 CCOCCNc1cc(ccn1)O ebba2d8ba756c04f3d1cebc0a2b682a6 [0,2,0,0,0,0|1,0,0]=3 10098 B13R1.6 CCOCCNc1cc(cnn1)Br c16517edd271f2d0627b9db27ef7a5b7 [0,2,0,0,0,0|2,0,0]=4 10099 B13R1.6 CCOCCNc1cc(cnn1)C b6da0f53f850ba9822cafba0e8062625 [0,2,0,0,0,0|2,0,0]=4 10100 B13R1.6 CCOCCNc1cc(cnn1)Cl 841f91c5adb20f21d249fd904fcd84a9 [0,2,0,0,0,0|2,0,0]=4 10101 B13R1.6 CCOCCNc1cc(cnn1)O 51538aa20cfb733bbe084198b2ee825b [0,2,0,0,0,0|2,0,0]=4 10102 B13R1.6 CCOCCNc1cc(ncn1)Br 36d532dec8abfe5fe5147ec7f51612b0 [0,2,0,0,0,0|2,0,0]=4 10103 B13R1.6 CCOCCNc1cc(ncn1)C c191ad1ad28d59f0aec4ae0bf0eaa989 [0,2,0,0,0,0|2,0,0]=4 10104 B13R1.6 CCOCCNc1cc(ncn1)Cl edeec53018d964e214075bb148c486d3 [0,2,0,0,0,0|2,0,0]=4 10105 B13R1.6 CCOCCNc1cc(ncn1)F 200d394ef89bd77f2cf90eab86cc89eb [0,2,0,0,0,0|2,0,0]=4 10106 B13R1.6 CCOCCNc1cc(ncn1)I 3cd2d9374b08a2458b0c2e501b4ebc22 [0,2,0,0,0,0|2,0,0]=4 10107 B13R1.6 CCOCCNc1cc[nH]c(=O)n1 e17912a40779c22bec283762fd5d2d14 [0,2,0,0,0,0|2,0,0]=4 10108 B13R1.6 CCOCCNc1cccc(=O)[nH]1 94e9e7a42e3adf94c8f82e82366b5d09 [0,2,0,0,0,0|1,0,1]=4 10109 B13R1.6 CCOCCNc1cccc(c1)Br 472100bcf233dfa46156506debb7a458 [0,2,0,0,0,0|2,0,0]=4 10110 B13R1.6 CCOCCNc1cccc(c1)C c3e88770fc74f79efaab8d41f6d1039a [0,2,0,0,0,0|2,0,0]=4 10111 B13R1.6 CCOCCNc1cccc(c1)Cl b2ce6d1cdcadd770ad8e4c4a4acc5d7b [0,2,0,0,0,0|2,0,0]=4 10112 B13R1.6 CCOCCNc1cccc(c1)F 589347822e11d56ef51b7425ab50cac2 [0,2,0,0,0,0|2,0,0]=4 10113 B13R1.6 CCOCCNc1cccc(c1)I 2778c0082fe892bd998a845ad25267c0 [0,2,0,0,0,0|2,0,0]=4 10114 B13R1.6 CCOCCNc1cccc(c1)O 27afe9b2532d25b3448d996580ccf603 [0,2,0,0,0,0|2,0,0]=4 10115 B13R1.6 CCOCCNc1cccc(c1)S 4d8f261ee41de7751dbfcd5ff09492eb [0,2,0,0,0,0|2,0,0]=4 10116 B13R1.6 CCOCCNc1cccc(n1)Br 8d785b59c35db9c1bfdad84c7e848116 [0,2,0,0,0,0|1,0,0]=3 10117 B13R1.6 CCOCCNc1cccc(n1)C b4e18b533d7c53bef7df878a4fd3d6a7 [0,2,0,0,0,0|1,0,0]=3 10118 B13R1.6 CCOCCNc1cccc(n1)Cl e847443585a035d7759ede736cf0c82a [0,2,0,0,0,0|1,0,0]=3 10119 B13R1.6 CCOCCNc1cccc(n1)F b20f9bf7734934aa7eb731d7e4fdb70b [0,2,0,0,0,0|1,0,0]=3 10120 B13R1.6 CCOCCNc1cccc(n1)I 720b87d1721a0df119c97504333fd862 [0,2,0,0,0,0|1,0,0]=3 10121 B13R1.6 CCOCCNc1ccnc(n1)Br 19930624f4a77a3c3cca546078ddde40 [0,2,0,0,0,0|2,0,0]=4 10122 B13R1.6 CCOCCNc1ccnc(n1)C 7e0fe9251e94d72739e01f72ff46422b [0,2,0,0,0,0|2,0,0]=4 10123 B13R1.6 CCOCCNc1ccnc(n1)Cl 445d8491e956a69e536bb019805eefad [0,2,0,0,0,0|2,0,0]=4 10124 B13R1.6 CCOCCNc1ccnc(n1)F 4d5fe84fcbf86cb851554e7bc437230f [0,2,0,0,0,0|2,0,0]=4 10125 B13R1.6 CCOCCNc1ccnc(n1)S d278f67b868b92ee5e2b9784cf594855 [0,2,0,0,0,0|2,0,0]=4 10126 B13R1.6 CCOCCNc1cncc(n1)Br 631f477fafffd73f35f1aa883a7baff3 [0,2,0,0,0,0|2,0,0]=4 10127 B13R1.6 CCOCCNc1cncc(n1)C 8e7fbb2f54d8f7c85d7a66e015f981da [0,2,0,0,0,0|2,0,0]=4 10128 B13R1.6 CCOCCNc1cncc(n1)Cl 263c4d53c83340f450d6f92a5a6b0eee [0,2,0,0,0,0|2,0,0]=4 10129 B13R1.6 CCOCCNc1cncc(n1)F 7108c6de5bc4ea90521087ffd5ecba20 [0,2,0,0,0,0|2,0,0]=4 10130 B13R1.6 CCOCCNc1cncc(n1)O 1fdf297cb1d93d5501ccb4d447de05fb [0,2,0,0,0,0|2,0,0]=4 10131 B13R1.6 CCOCCNc1nccc(=O)[nH]1 368d5419b74748cc11f80fd14959a495 [0,2,0,0,0,0|2,0,0]=4 10132 B13R1.6 CCOCCNc1nccc(n1)Br f77906641be6193d8b27578024450313 [0,2,0,0,0,0|2,0,0]=4 10133 B13R1.6 CCOCCNc1nccc(n1)C 4ff3092acced7b90bfff3c87e87e2108 [0,2,0,0,0,0|2,0,0]=4 10134 B13R1.6 CCOCCNc1nccc(n1)Cl 3af7b9c0111c1610a5173ba03ebb643e [0,2,0,0,0,0|2,0,0]=4 10135 B13R1.6 CCOCCNc1nccc(n1)F e5715b7a87a0d765e0aa4fc65796594d [0,2,0,0,0,0|2,0,0]=4 10136 B13R1.6 CCOCCNc1nccc(n1)I cc3c31eeabfd7e370191c588ec8dc7ad [0,2,0,0,0,0|2,0,0]=4 10137 B13R1.6 CCOCCNc1nccc(n1)S 3cdc65cc20fe927c8be214421b4e2280 [0,2,0,0,0,0|2,0,0]=4 10138 B13R1.6 CCOCCOc1cc(ccn1)Br b343bcbdf8654ff402c53bc5f5f78e12 [0,2,0,0,0,0|1,0,0]=3 10139 B13R1.6 CCOCCOc1cc(ccn1)C 7992f58f5b3baa19483572cb33683bd8 [0,2,0,0,0,0|1,0,0]=3 10140 B13R1.6 CCOCCOc1cc(ccn1)Cl 5077839fe40ccb9903cbc5a0fc45d72a [0,2,0,0,0,0|1,0,0]=3 10141 B13R1.6 CCOCCOc1cc(ccn1)F 953fbf70d746a56b70a34391ce9a6427 [0,2,0,0,0,0|1,0,0]=3 10142 B13R1.6 CCOCCOc1cc(ncn1)Br 216136c827d9841f020f85e671469eeb [0,2,0,0,0,0|2,0,0]=4 10143 B13R1.6 CCOCCOc1cc(ncn1)C e1aff37c751de3d5e2e8229e79ab56ef [0,2,0,0,0,0|2,0,0]=4 10144 B13R1.6 CCOCCOc1cc(ncn1)Cl f90114ab5b216600db6a150974854af5 [0,2,0,0,0,0|2,0,0]=4 10145 B13R1.6 CCOCCOc1cccc(=O)[nH]1 3401fcb573ff811b87b32746c1dc3895 [0,2,0,0,0,0|1,0,1]=4 10146 B13R1.6 CCOCCOc1cccc(c1)Br 9929be90d1b19a5c778cc061b36cf2fd [0,2,0,0,0,0|2,0,0]=4 10147 B13R1.6 CCOCCOc1cccc(c1)C e564173a0b8116ee928e324b39da2065 [0,2,0,0,0,0|2,0,0]=4 10148 B13R1.6 CCOCCOc1cccc(c1)Cl 1543f9c523b3ea65b610d21415c35aa9 [0,2,0,0,0,0|2,0,0]=4 10149 B13R1.6 CCOCCOc1cccc(c1)F 06d920c399df5443d9aaede3c67cdedd [0,2,0,0,0,0|2,0,0]=4 10150 B13R1.6 CCOCCOc1cccc(c1)I ea3c161fa31bbe3d54be1dc8c1d2e170 [0,2,0,0,0,0|2,0,0]=4 10151 B13R1.6 CCOCCOc1cccc(c1)S 91bae77e016c1f28d6c16607c321b94b [0,2,0,0,0,0|2,0,0]=4 10152 B13R1.6 CCOCCOc1cccc(n1)Br d33d0f7a8acf6bb63680ccf10a2d9a28 [0,2,0,0,0,0|1,0,0]=3 10153 B13R1.6 CCOCCOc1cccc(n1)C dfa74960b1b584206f3329afb69bd4bc [0,2,0,0,0,0|1,0,0]=3 10154 B13R1.6 CCOCCOc1cccc(n1)F c663d8aef470fc4e8c34a5e3a09323ff [0,2,0,0,0,0|1,0,0]=3 10155 B13R1.6 CCOCCOc1ccnc(n1)C 8095e3021f30fabc9785b1fbe8106fde [0,2,0,0,0,0|2,0,0]=4 10156 B13R1.6 CCOCCOc1ccnc(n1)Cl 9a508c842b620002b471b55943c06ab8 [0,2,0,0,0,0|2,0,0]=4 10157 B13R1.6 CCOCCOc1cncc(n1)Br ceb699e22001b1506360fd6a3f857ef9 [0,2,0,0,0,0|2,0,0]=4 10158 B13R1.6 CCOCCOc1cncc(n1)C db4c503f11f2a6d68eab5cd9138e42c0 [0,2,0,0,0,0|2,0,0]=4 10159 B13R1.6 CCOCCOc1cncc(n1)Cl f2e9f5d49aae756b915a5d7038dd6f65 [0,2,0,0,0,0|2,0,0]=4 10160 B13R1.6 CCOCCOc1nccc(n1)Cl fd70fb963dbf076f35dc588f7cb2f64f [0,2,0,0,0,0|2,0,0]=4 10161 B13R1.6 CCOCCOc1nccc(n1)S 8d9b6e06325849d4f50a0fb3505a5a88 [0,2,0,0,0,0|2,0,0]=4 10162 B13R1.6 CCOCCSc1cccc(c1)Br baf2513675fc4405e34e01ae85e2e7fe [0,2,0,0,0,0|2,0,0]=4 10163 B13R1.6 CCOCCSc1cccc(c1)C 4590ce05061f4be1cc0da47e33c2863f [0,2,0,0,0,0|2,0,0]=4 10164 B13R1.6 CCOCCSc1cccc(c1)Cl 1e7910acb6f6be0025093601ec68779f [0,2,0,0,0,0|2,0,0]=4 10165 B13R1.6 CCOCCSc1cccc(c1)F 40d3fe02a48786efff151c8987c35b74 [0,2,0,0,0,0|2,0,0]=4 10166 B13R1.6 CCOCNCc1cc(ccn1)Br 0814e111c6bb3fad51dfbf252f0b01f8 [0,2,0,0,0,0|1,0,0]=3 10167 B13R1.6 CCOCNCc1cc(ccn1)C 319ce8d510a3b5bf11a9fe8cd7a6c93b [0,2,0,0,0,0|1,0,0]=3 10168 B13R1.6 CCOCNCc1cc[nH]c(=O)n1 85d8f3a7911513d2ce8dad4e2db7db4e [0,2,0,0,0,0|2,0,0]=4 10169 B13R1.6 CCOCNCc1cccc(c1)Br c88aff1af01d43115ba4e4eab1c799ba [0,2,0,0,0,0|2,0,0]=4 10170 B13R1.6 CCOCNCc1cccc(c1)C 7151ce030070b222d4772ed8000c26a0 [0,2,0,0,0,0|2,0,0]=4 10171 B13R1.6 CCOCNCc1cccc(c1)Cl fbb3f898c53cd8c7be7dcdb55b8719c5 [0,2,0,0,0,0|2,0,0]=4 10172 B13R1.6 CCOCNCc1cccc(c1)F ff076dcf4d13d2008f04d1b4c60d3ff0 [0,2,0,0,0,0|2,0,0]=4 10173 B13R1.6 CCOCNCc1cccc(c1)I 0d37cb2cc5ecee1963e229a13fb021a4 [0,2,0,0,0,0|2,0,0]=4 10174 B13R1.6 CCOCNCc1cccc(n1)C 8cbde5ffa700e3971d5d9422e0c965a4 [0,2,0,0,0,0|1,0,0]=3 10175 B13R1.6 CCOCNCc1cccc(n1)Cl 27ab5d4b94b956319701870b77dbdebc [0,2,0,0,0,0|1,0,0]=3 10176 B13R1.6 CCOCNCc1cccc(n1)F c8a86bcbf4085d8d6ef9a35b17ae3023 [0,2,0,0,0,0|1,0,0]=3 10177 B13R1.6 CCOCNCc1ccnc(n1)C 4c6ccbe1e8ff9d5bf6617778faa60eb6 [0,2,0,0,0,0|2,0,0]=4 10178 B13R1.6 CCOCNCc1nccc(n1)C 0f5525bfa1c6ac1fbd1646423f8ec90a [0,2,0,0,0,0|2,0,0]=4 10179 B13R1.6 CCOCNCc1nccc(n1)Cl d1e59094a78bdc67d144082c0a045e1d [0,2,0,0,0,0|2,0,0]=4 10180 B13R1.6 CCOCOCc1cc(ccn1)Br 1dfa78333b6c1ed44722df86574a5591 [0,2,0,0,0,0|1,0,0]=3 10181 B13R1.6 CCOCOCc1cc(ccn1)C 8f8c2eb3bd25cd9b09da6c33269c4a18 [0,2,0,0,0,0|1,0,0]=3 10182 B13R1.6 CCOCOCc1cc(ccn1)Cl b69ef493b52c5fbf9b9a5c61d09810c2 [0,2,0,0,0,0|1,0,0]=3 10183 B13R1.6 CCOCOCc1cc(ccn1)F 65fa0ac579c7b5dfdd93f89cd02425b1 [0,2,0,0,0,0|1,0,0]=3 10184 B13R1.6 CCOCOCc1cc(ccn1)I d2fde39ecab4c1394a009a69b942b227 [0,2,0,0,0,0|1,0,0]=3 10185 B13R1.6 CCOCOCc1cc(ncn1)Cl cd2b4cb2c830d5c5d61d809dd4809cd2 [0,2,0,0,0,0|2,0,0]=4 10186 B13R1.6 CCOCOCc1cccc(c1)C cd056307b58d813e82e56e6539f9d158 [0,2,0,0,0,0|2,0,0]=4 10187 B13R1.6 CCOCOCc1cccc(c1)F 2d076331b98c2ed838a1a32edbba6dbf [0,2,0,0,0,0|2,0,0]=4 10188 B13R1.6 CCOCOCc1cccc(c1)I a1f14587fa07cb0bea74a8e0b3dab83d [0,2,0,0,0,0|2,0,0]=4 10189 B13R1.6 CCSCCNc1cc(ccn1)Br 2e5d73781aa642a1eeda6ec89f78e135 [0,2,0,0,0,0|1,0,0]=3 10190 B13R1.6 CCSCCNc1cc(ccn1)C 53c6d558a966d81f3f5bab67560459e5 [0,2,0,0,0,0|1,0,0]=3 10191 B13R1.6 CCSCCNc1cc(ccn1)Cl 734fe8eaf625b9860fd3161a590596a8 [0,2,0,0,0,0|1,0,0]=3 10192 B13R1.6 CCSCCNc1cc(ccn1)F 1f8ad020c97b242289b03f15cae4273b [0,2,0,0,0,0|1,0,0]=3 10193 B13R1.6 CCSCCNc1cc(ccn1)I 3a72b7abfa0f28a289d9bb459b6c8ddf [0,2,0,0,0,0|1,0,0]=3 10194 B13R1.6 CCSCCNc1cc(cnn1)Br c8eac58181795c162f91f295b5a0411e [0,2,0,0,0,0|2,0,0]=4 10195 B13R1.6 CCSCCNc1cc(cnn1)C 21fa5f439c8079b44c4d1bc9156e9ea8 [0,2,0,0,0,0|2,0,0]=4 10196 B13R1.6 CCSCCNc1cc(cnn1)Cl ef001d7cc90408ca137b45561f5c18f2 [0,2,0,0,0,0|2,0,0]=4 10197 B13R1.6 CCSCCNc1cc(ncn1)Br a14c2929daaffabb0e2d805d76b64d3d [0,2,0,0,0,0|2,0,0]=4 10198 B13R1.6 CCSCCNc1cc(ncn1)C 501a1d33ebed4ddf3114ca57e4749cbe [0,2,0,0,0,0|2,0,0]=4 10199 B13R1.6 CCSCCNc1cc(ncn1)Cl aee783b68c7a40793015ce203b18a3cb [0,2,0,0,0,0|2,0,0]=4 10200 B13R1.6 CCSCCNc1cc(ncn1)F 7604ebd8723fcce0a80b52ee42c56bf5 [0,2,0,0,0,0|2,0,0]=4 10201 B13R1.6 CCSCCNc1cc(ncn1)I 5575dcae3d33ca74b6fdfb57045be008 [0,2,0,0,0,0|2,0,0]=4 10202 B13R1.6 CCSCCNc1cc[nH]c(=O)n1 bb59b1e4bbb13955562d076bcf790085 [0,2,0,0,0,0|2,0,0]=4 10203 B13R1.6 CCSCCNc1cccc(c1)Br 42fbc375a10e41be93403e21035a30f6 [0,2,0,0,0,0|2,0,0]=4 10204 B13R1.6 CCSCCNc1cccc(c1)C 65f38a431464f9e130534f3fa480d4ee [0,2,0,0,0,0|2,0,0]=4 10205 B13R1.6 CCSCCNc1cccc(c1)Cl 54498dac0873297fb8340536f6e1ba08 [0,2,0,0,0,0|2,0,0]=4 10206 B13R1.6 CCSCCNc1cccc(c1)F adf7addb49eee11101e61dafc7dd440d [0,2,0,0,0,0|2,0,0]=4 10207 B13R1.6 CCSCCNc1cccc(c1)I 8a69a58a0999517023daaaaac1d6ea48 [0,2,0,0,0,0|2,0,0]=4 10208 B13R1.6 CCSCCNc1cccc(c1)S e4df31a2e468355b15dde6f030ab34e9 [0,2,0,0,0,0|2,0,0]=4 10209 B13R1.6 CCSCCNc1cccc(n1)Br ea2085d7e6acab5ea3b5122707e84f8f [0,2,0,0,0,0|1,0,0]=3 10210 B13R1.6 CCSCCNc1cccc(n1)C c1df70acb193c498bb76940341520e4d [0,2,0,0,0,0|1,0,0]=3 10211 B13R1.6 CCSCCNc1cccc(n1)Cl 9d1f9fe1e119c3b8c95cb018987ca596 [0,2,0,0,0,0|1,0,0]=3 10212 B13R1.6 CCSCCNc1cccc(n1)F b340dd18587cead790b32b8137d53ccb [0,2,0,0,0,0|1,0,0]=3 10213 B13R1.6 CCSCCNc1cccc(n1)I c3d03a1bd70570724ba04c561bf7ad5c [0,2,0,0,0,0|1,0,0]=3 10214 B13R1.6 CCSCCNc1ccnc(n1)Br 750909d354452f3f4ec30521891bd52c [0,2,0,0,0,0|2,0,0]=4 10215 B13R1.6 CCSCCNc1ccnc(n1)C a3717d3bcbb7896f17c595b40abaa9f3 [0,2,0,0,0,0|2,0,0]=4 10216 B13R1.6 CCSCCNc1ccnc(n1)Cl 905f7a09b9e5e736cb93bf4719d75caf [0,2,0,0,0,0|2,0,0]=4 10217 B13R1.6 CCSCCNc1ccnc(n1)F ef3d1b9d101215495ce8faa544ca4c9b [0,2,0,0,0,0|2,0,0]=4 10218 B13R1.6 CCSCCNc1ccnc(n1)S 2ca5ff42f805361b2e7fe5733283f7da [0,2,0,0,0,0|2,0,0]=4 10219 B13R1.6 CCSCCNc1cncc(n1)Br 12f8471b072c9f5b3ab3240dfd4df85e [0,2,0,0,0,0|2,0,0]=4 10220 B13R1.6 CCSCCNc1cncc(n1)C 983103cca77551e4d76719e73c5a8e8a [0,2,0,0,0,0|2,0,0]=4 10221 B13R1.6 CCSCCNc1cncc(n1)Cl 6ba1cb37597e2eaf3a6d03f19543bf20 [0,2,0,0,0,0|2,0,0]=4 10222 B13R1.6 CCSCCNc1cncc(n1)F e8f310e3b200b3a259961aec56bbf60b [0,2,0,0,0,0|2,0,0]=4 10223 B13R1.6 CCSCCNc1nccc(=O)[nH]1 7b2013d52344b6320921d5d54a50a5d9 [0,2,0,0,0,0|2,0,0]=4 10224 B13R1.6 CCSCCNc1nccc(n1)Br f5e440d5a847432a0dacdee5b3923b9d [0,2,0,0,0,0|2,0,0]=4 10225 B13R1.6 CCSCCNc1nccc(n1)C ed3c1a0b7507cb84e3b5b6b2d432245d [0,2,0,0,0,0|2,0,0]=4 10226 B13R1.6 CCSCCNc1nccc(n1)Cl 22fd8e5a910d0e353beb8f130cf49ce8 [0,2,0,0,0,0|2,0,0]=4 10227 B13R1.6 CCSCCNc1nccc(n1)F 2a93568318c3f9be3f0ae45c5d7cae85 [0,2,0,0,0,0|2,0,0]=4 10228 B13R1.6 CCSCCNc1nccc(n1)I 2433d025f41f40953f01bdb9c0129766 [0,2,0,0,0,0|2,0,0]=4 10229 B13R1.6 CCSCCNc1nccc(n1)S 57aa829be3904f43f89b6bd635bb1c39 [0,2,0,0,0,0|2,0,0]=4 10230 B13R1.6 CCSCCOc1cc(ccn1)Br 6724d382405ce48f63a15cf14e264d77 [0,2,0,0,0,0|1,0,0]=3 10231 B13R1.6 CCSCCOc1cc(ccn1)C 8b2b447374d525f14e6fa1aa37132dc7 [0,2,0,0,0,0|1,0,0]=3 10232 B13R1.6 CCSCCOc1cc(ccn1)Cl 6c6b7d34f9c7aef18ee1ef9a83424196 [0,2,0,0,0,0|1,0,0]=3 10233 B13R1.6 CCSCCOc1cc(ccn1)F 81542265fd66b3f64eccd0b123fd0c06 [0,2,0,0,0,0|1,0,0]=3 10234 B13R1.6 CCSCCOc1cc(ncn1)Br eed425d8c4d3b7331bd78c6d324331a8 [0,2,0,0,0,0|2,0,0]=4 10235 B13R1.6 CCSCCOc1cc(ncn1)C a3bf7009682d671dae618c15a22cd2d9 [0,2,0,0,0,0|2,0,0]=4 10236 B13R1.6 CCSCCOc1cc(ncn1)Cl 85b86ead6667fa84acee496564de019f [0,2,0,0,0,0|2,0,0]=4 10237 B13R1.6 CCSCCOc1cccc(=O)[nH]1 f305bdd76b8bbc58cba56b7eca26d121 [0,2,0,0,0,0|1,0,1]=4 10238 B13R1.6 CCSCCOc1cccc(c1)Br 28816615c38a8a0b7027e85eb676590d [0,2,0,0,0,0|2,0,0]=4 10239 B13R1.6 CCSCCOc1cccc(c1)C 0092f02e0638efd3b3443e0734d19d37 [0,2,0,0,0,0|2,0,0]=4 10240 B13R1.6 CCSCCOc1cccc(c1)Cl 094840a6a1b1181afc69b6a91f516cf1 [0,2,0,0,0,0|2,0,0]=4 10241 B13R1.6 CCSCCOc1cccc(c1)F 51f4647110cb61e103c8f293382b1e93 [0,2,0,0,0,0|2,0,0]=4 10242 B13R1.6 CCSCCOc1cccc(c1)I 19353a8985482f074fb6c7dff107e9b8 [0,2,0,0,0,0|2,0,0]=4 10243 B13R1.6 CCSCCOc1cccc(c1)S 0ffe769c5a1eed4ab33b31bbe510039e [0,2,0,0,0,0|2,0,0]=4 10244 B13R1.6 CCSCCOc1cccc(n1)Br 92129cfad9936bbba7052c33ae49f29f [0,2,0,0,0,0|1,0,0]=3 10245 B13R1.6 CCSCCOc1cccc(n1)C 089d24c55a2edfb43138b571fc4e5f48 [0,2,0,0,0,0|1,0,0]=3 10246 B13R1.6 CCSCCOc1cccc(n1)F 610962ec5f6306e6f551caa630d2fbf0 [0,2,0,0,0,0|1,0,0]=3 10247 B13R1.6 CCSCCOc1ccnc(n1)C 29a370e943fa5c4f273c893fb0f8cb96 [0,2,0,0,0,0|2,0,0]=4 10248 B13R1.6 CCSCCOc1ccnc(n1)Cl 401e137d8993db8f7bbdd1178598ec9f [0,2,0,0,0,0|2,0,0]=4 10249 B13R1.6 CCSCCOc1cncc(n1)Br 92ef1dc7645addde140da8f927b32bc2 [0,2,0,0,0,0|2,0,0]=4 10250 B13R1.6 CCSCCOc1cncc(n1)Cl e1d14ecb2b496a9c477c041ccc46f40a [0,2,0,0,0,0|2,0,0]=4 10251 B13R1.6 CCSCCOc1nccc(n1)Cl 22af2a2c275aa5db8a0cd1c7c5148979 [0,2,0,0,0,0|2,0,0]=4 10252 B13R1.6 CCSCCOc1nccc(n1)S b03705f3b56bba842200ab5cdc3320fc [0,2,0,0,0,0|2,0,0]=4 10253 B13R1.6 COCCCNc1cc(ccn1)Br 0ad33bcdc616a3a08072bd616385619d [0,2,0,0,0,0|1,0,0]=3 10254 B13R1.6 COCCCNc1cc(ccn1)C d0326c04047883f4b549c1d4219752e0 [0,2,0,0,0,0|1,0,0]=3 10255 B13R1.6 COCCCNc1cc(ccn1)Cl 24124ad86d01a784739033fb54c41db8 [0,2,0,0,0,0|1,0,0]=3 10256 B13R1.6 COCCCNc1cc(ccn1)F 299685d8635118ba038eeb221c417801 [0,2,0,0,0,0|1,0,0]=3 10257 B13R1.6 COCCCNc1cc(ccn1)I 62994b61c43c20a21263f8db948ecdf2 [0,2,0,0,0,0|1,0,0]=3 10258 B13R1.6 COCCCNc1cc(cnn1)Br abdffce5c524d49b532640ad0834a189 [0,2,0,0,0,0|2,0,0]=4 10259 B13R1.6 COCCCNc1cc(cnn1)C de50818146154d26455ef07f20adfc48 [0,2,0,0,0,0|2,0,0]=4 10260 B13R1.6 COCCCNc1cc(cnn1)Cl 10204dc92d88bfa137b6e0c0fd3bd7b4 [0,2,0,0,0,0|2,0,0]=4 10261 B13R1.6 COCCCNc1cc(ncn1)Br bf3fbe65e1fbafac55305db1949f96c6 [0,2,0,0,0,0|2,0,0]=4 10262 B13R1.6 COCCCNc1cc(ncn1)C 1a220e0599956dd8e19fbf14690084d5 [0,2,0,0,0,0|2,0,0]=4 10263 B13R1.6 COCCCNc1cc(ncn1)Cl 1450317c00f9875ab3a010869dde37b5 [0,2,0,0,0,0|2,0,0]=4 10264 B13R1.6 COCCCNc1cc(ncn1)F eaccee69877d8b8667b3ac963590d2b6 [0,2,0,0,0,0|2,0,0]=4 10265 B13R1.6 COCCCNc1cc(ncn1)I 07a8651eb243bbdec13cbfebc881697f [0,2,0,0,0,0|2,0,0]=4 10266 B13R1.6 COCCCNc1cc[nH]c(=O)n1 f427b37f1bb1e1bd273aa2188c20e2fc [0,2,0,0,0,0|2,0,0]=4 10267 B13R1.6 COCCCNc1cccc(=O)[nH]1 2ad7c54c4d19168f75599715d3e5cfe1 [0,2,0,0,0,0|1,0,1]=4 10268 B13R1.6 COCCCNc1cccc(c1)Br fa3362811cb16b96b459a3eaa038abe6 [0,2,0,0,0,0|2,0,0]=4 10269 B13R1.6 COCCCNc1cccc(c1)C e1b3ae7886c37412dfd3158badeb0927 [0,2,0,0,0,0|2,0,0]=4 10270 B13R1.6 COCCCNc1cccc(c1)Cl 4084d1efb4ad2dd00c8988eecc1c7338 [0,2,0,0,0,0|2,0,0]=4 10271 B13R1.6 COCCCNc1cccc(c1)F d94d43a475630599167ba4f9a06b91d1 [0,2,0,0,0,0|2,0,0]=4 10272 B13R1.6 COCCCNc1cccc(c1)I c7d381e042356c727db7e87e50d96b59 [0,2,0,0,0,0|2,0,0]=4 10273 B13R1.6 COCCCNc1cccc(c1)O f4b46242a2f65b789f346d5e7dea2a8d [0,2,0,0,0,0|2,0,0]=4 10274 B13R1.6 COCCCNc1cccc(c1)S 66f7f6e3eeea5851b4fc78d1846d4283 [0,2,0,0,0,0|2,0,0]=4 10275 B13R1.6 COCCCNc1cccc(n1)Br 5aed592cb87a60e86ed58e9eb577a3ac [0,2,0,0,0,0|1,0,0]=3 10276 B13R1.6 COCCCNc1cccc(n1)C ea8de8ada1a3a1b2fcd7f68a7585e5b1 [0,2,0,0,0,0|1,0,0]=3 10277 B13R1.6 COCCCNc1cccc(n1)Cl 0f754b2fce21cfa6ffb2fe981fddb5c6 [0,2,0,0,0,0|1,0,0]=3 10278 B13R1.6 COCCCNc1cccc(n1)F fb29fdafffd33c50de37473df0809485 [0,2,0,0,0,0|1,0,0]=3 10279 B13R1.6 COCCCNc1cccc(n1)I 3ee5b96813289b478a46ee175aca0068 [0,2,0,0,0,0|1,0,0]=3 10280 B13R1.6 COCCCNc1ccnc(n1)Br b0ac9230bdb1357593b1de32344ebe68 [0,2,0,0,0,0|2,0,0]=4 10281 B13R1.6 COCCCNc1ccnc(n1)C 8ed66d45ba9612a786ef426411275ec4 [0,2,0,0,0,0|2,0,0]=4 10282 B13R1.6 COCCCNc1ccnc(n1)Cl 9b2b9444348ae3f26677ae28138fd218 [0,2,0,0,0,0|2,0,0]=4 10283 B13R1.6 COCCCNc1ccnc(n1)F 326a6af99acf4e779e9b7a97f4e1723b [0,2,0,0,0,0|2,0,0]=4 10284 B13R1.6 COCCCNc1ccnc(n1)S 5928cccc5124a0dc3aacdd0d94a1f7e6 [0,2,0,0,0,0|2,0,0]=4 10285 B13R1.6 COCCCNc1cncc(n1)Br d9ad5926e6b995575213c7f64b770ce8 [0,2,0,0,0,0|2,0,0]=4 10286 B13R1.6 COCCCNc1cncc(n1)C 3009afbf94aaf0319a335f81466b6a9d [0,2,0,0,0,0|2,0,0]=4 10287 B13R1.6 COCCCNc1cncc(n1)Cl 84dadd01fd9d211b4effb69a26958e0f [0,2,0,0,0,0|2,0,0]=4 10288 B13R1.6 COCCCNc1cncc(n1)F 1ee9b9ff6feda6075d6a0720879d94c2 [0,2,0,0,0,0|2,0,0]=4 10289 B13R1.6 COCCCNc1nccc(=O)[nH]1 357f11359c3e1d1b2f6d8d8568e9813b [0,2,0,0,0,0|2,0,0]=4 10290 B13R1.6 COCCCNc1nccc(n1)Br 4617260e7a4b259bcff649ac94a9d599 [0,2,0,0,0,0|2,0,0]=4 10291 B13R1.6 COCCCNc1nccc(n1)C ff3df353ee1bf962cab0701d9baf1c86 [0,2,0,0,0,0|2,0,0]=4 10292 B13R1.6 COCCCNc1nccc(n1)Cl cad0c41246a1871f1b0aee1775ff4bab [0,2,0,0,0,0|2,0,0]=4 10293 B13R1.6 COCCCNc1nccc(n1)F d5be7fd6d9578f9d370e407cc4042439 [0,2,0,0,0,0|2,0,0]=4 10294 B13R1.6 COCCCNc1nccc(n1)I 7d35720f979341448ac5fcde2018c02d [0,2,0,0,0,0|2,0,0]=4 10295 B13R1.6 COCCCNc1nccc(n1)S bc85c9d683d60e36aa37d62f1a13125e [0,2,0,0,0,0|2,0,0]=4 10296 B13R1.6 COCCCOc1cc(ccn1)Br 5cdea5809282aa5f3a4886703dd0b7a2 [0,2,0,0,0,0|1,0,0]=3 10297 B13R1.6 COCCCOc1cc(ccn1)C 65a9cfea4684036c5cc0ba2a412381cd [0,2,0,0,0,0|1,0,0]=3 10298 B13R1.6 COCCCOc1cc(ccn1)Cl ed417c515697cde6782ec41ee96ca3ff [0,2,0,0,0,0|1,0,0]=3 10299 B13R1.6 COCCCOc1cc(ccn1)F b3e95bbae9fd3ac42bbdb414d96afee8 [0,2,0,0,0,0|1,0,0]=3 10300 B13R1.6 COCCCOc1cc(ncn1)Br 97a199d2cf1f9e67058f2c746d660d57 [0,2,0,0,0,0|2,0,0]=4 10301 B13R1.6 COCCCOc1cc(ncn1)C 1883421bb11adad81458b98239bc6e6f [0,2,0,0,0,0|2,0,0]=4 10302 B13R1.6 COCCCOc1cc(ncn1)Cl 28188a1674cb877457c25eb6158c2ace [0,2,0,0,0,0|2,0,0]=4 10303 B13R1.6 COCCCOc1cccc(=O)[nH]1 1cfaf1ad4322406e6bbe33a850387a61 [0,2,0,0,0,0|1,0,1]=4 10304 B13R1.6 COCCCOc1cccc(c1)Br 87cc3da9ceb461ec1eb0181ea82a4c6b [0,2,0,0,0,0|2,0,0]=4 10305 B13R1.6 COCCCOc1cccc(c1)C 7f38f3904e25afb0a835a05aa6eb0368 [0,2,0,0,0,0|2,0,0]=4 10306 B13R1.6 COCCCOc1cccc(c1)Cl ce5bc717d71fdeaf7c3a3478b731cd98 [0,2,0,0,0,0|2,0,0]=4 10307 B13R1.6 COCCCOc1cccc(c1)F 7bad4ae18299a0cf643c10c61f7cf9d1 [0,2,0,0,0,0|2,0,0]=4 10308 B13R1.6 COCCCOc1cccc(c1)I 389642d8389f8a1db467cf2c3b5c846a [0,2,0,0,0,0|2,0,0]=4 10309 B13R1.6 COCCCOc1cccc(c1)S 9c630bd01a5491c101885d389b679fed [0,2,0,0,0,0|2,0,0]=4 10310 B13R1.6 COCCCOc1cccc(n1)Br b427e053e37ec8d580d4a335c0a5c5b5 [0,2,0,0,0,0|1,0,0]=3 10311 B13R1.6 COCCCOc1cccc(n1)C 890639f77ab71513f07eb7dc3e860282 [0,2,0,0,0,0|1,0,0]=3 10312 B13R1.6 COCCCOc1cccc(n1)F 56c3b37566b19bf30f8044db814e9f03 [0,2,0,0,0,0|1,0,0]=3 10313 B13R1.6 COCCCOc1ccnc(n1)C 280715270cc6425e5792dff76a0e8460 [0,2,0,0,0,0|2,0,0]=4 10314 B13R1.6 COCCCOc1ccnc(n1)Cl 032fda67b3f4b9fcec132df3ac1419b5 [0,2,0,0,0,0|2,0,0]=4 10315 B13R1.6 COCCCOc1cncc(n1)Br 9dc0958afecfd12c6bfc9e93cdb78270 [0,2,0,0,0,0|2,0,0]=4 10316 B13R1.6 COCCCOc1cncc(n1)C ebebf57007977f42efb2d1b4f055e250 [0,2,0,0,0,0|2,0,0]=4 10317 B13R1.6 COCCCOc1cncc(n1)Cl 58ed59881565f6a45acefe672702d3e8 [0,2,0,0,0,0|2,0,0]=4 10318 B13R1.6 COCCCOc1nccc(n1)Cl d15b688d9a8e9fa474da0747fff9e1c7 [0,2,0,0,0,0|2,0,0]=4 10319 B13R1.6 COCCCOc1nccc(n1)S cb9889024eb51e732818c8722d4dc162 [0,2,0,0,0,0|2,0,0]=4 10320 B13R1.6 COCCNCc1cc(ccn1)Br 4daea0804f04276953ee0a17f1b677dd [0,2,0,0,0,0|1,0,0]=3 10321 B13R1.6 COCCNCc1cc(ccn1)C 058b04c2974321a3f52207ee3d7b09c8 [0,2,0,0,0,0|1,0,0]=3 10322 B13R1.6 COCCNCc1cc(ccn1)Cl c99b6948830fafd2fbf9416b3eef8ac6 [0,2,0,0,0,0|1,0,0]=3 10323 B13R1.6 COCCNCc1cc(cnn1)C e209438c00d7830c3b34305c6a730a9f [0,2,0,0,0,0|2,0,0]=4 10324 B13R1.6 COCCNCc1cc[nH]c(=O)n1 f0be82775e27fccb8531ee0cd61297c2 [0,2,0,0,0,0|2,0,0]=4 10325 B13R1.6 COCCNCc1cccc(c1)Br 1f2ec05b112d1524c9f795c8866ea916 [0,2,0,0,0,0|2,0,0]=4 10326 B13R1.6 COCCNCc1cccc(c1)C d1740a2ade3add1f69864f9fcb30eb3f [0,2,0,0,0,0|2,0,0]=4 10327 B13R1.6 COCCNCc1cccc(c1)Cl fe68e4e635c546f2c1ba16f740957f8c [0,2,0,0,0,0|2,0,0]=4 10328 B13R1.6 COCCNCc1cccc(c1)F c60b20e7d083f4e0e1cfb5ed46c71056 [0,2,0,0,0,0|2,0,0]=4 10329 B13R1.6 COCCNCc1cccc(c1)I fdfbcb45d51db8e0963e62f28800d398 [0,2,0,0,0,0|2,0,0]=4 10330 B13R1.6 COCCNCc1cccc(n1)Br 06bbc29325c51b3f0016113a05636ba3 [0,2,0,0,0,0|1,0,0]=3 10331 B13R1.6 COCCNCc1cccc(n1)C eef96cfaf4286fdfefa0656cc6bc5b08 [0,2,0,0,0,0|1,0,0]=3 10332 B13R1.6 COCCNCc1cccc(n1)Cl e9cd361f2ce31b7e73ec395b5569e2f0 [0,2,0,0,0,0|1,0,0]=3 10333 B13R1.6 COCCNCc1cccc(n1)F 06658edb4b27f95c4d6a1a5f99830425 [0,2,0,0,0,0|1,0,0]=3 10334 B13R1.6 COCCNCc1ccnc(n1)C 1eb6399ad58aeb8a0dde2a9684d566ff [0,2,0,0,0,0|2,0,0]=4 10335 B13R1.6 COCCNCc1ccnc(n1)Cl 7079faeb802d402825dd30aec61bdedf [0,2,0,0,0,0|2,0,0]=4 10336 B13R1.6 COCCNCc1cncc(n1)Cl 0383f70f6c094ec0cd5337510f7174b2 [0,2,0,0,0,0|2,0,0]=4 10337 B13R1.6 COCCNCc1nccc(n1)C 150423327fac5fd47403a0ac5cce5957 [0,2,0,0,0,0|2,0,0]=4 10338 B13R1.6 COCCNCc1nccc(n1)Cl 46e51d76d12e0f68a30433ffc9bf99f0 [0,2,0,0,0,0|2,0,0]=4 10339 B13R1.6 COCCOCc1cc(ccn1)Br 440c24534265f57d0342639117f52979 [0,2,0,0,0,0|1,0,0]=3 10340 B13R1.6 COCCOCc1cc(ccn1)C 90221bd976697372cd4ed8dc653d6da1 [0,2,0,0,0,0|1,0,0]=3 10341 B13R1.6 COCCOCc1cc(ccn1)Cl 4d7b695895760a6793d38be33f82f5b0 [0,2,0,0,0,0|1,0,0]=3 10342 B13R1.6 COCCOCc1cc(ccn1)F fbe1e1e203e31241f908625d68ac5f0a [0,2,0,0,0,0|1,0,0]=3 10343 B13R1.6 COCCOCc1cc(ccn1)I ebe0f7dc59ae987fe1fd76c604dadc5d [0,2,0,0,0,0|1,0,0]=3 10344 B13R1.6 COCCOCc1cc(cnn1)C 290612372f2a7558b0a21396f03a8559 [0,2,0,0,0,0|2,0,0]=4 10345 B13R1.6 COCCOCc1cc(ncn1)C 31e9c2ee0b6f8ea55cd95e582403e7de [0,2,0,0,0,0|2,0,0]=4 10346 B13R1.6 COCCOCc1cc(ncn1)Cl dd3ad47ba38d9672ba69c04e575229eb [0,2,0,0,0,0|2,0,0]=4 10347 B13R1.6 COCCOCc1cccc(c1)Br 8205c83dafe154edf4ad7f56fd0fe054 [0,2,0,0,0,0|2,0,0]=4 10348 B13R1.6 COCCOCc1cccc(c1)C 7ad0cd51b25b8a4b1fed5eb8f600d7ee [0,2,0,0,0,0|2,0,0]=4 10349 B13R1.6 COCCOCc1cccc(c1)Cl 6dc1cfcedf6156ef9746484da324b210 [0,2,0,0,0,0|2,0,0]=4 10350 B13R1.6 COCCOCc1cccc(c1)F a3aa70be40ad0c48daf7d24ecc96cef6 [0,2,0,0,0,0|2,0,0]=4 10351 B13R1.6 COCCOCc1cccc(c1)I 1166f706c79765f2059556b08f4d6c63 [0,2,0,0,0,0|2,0,0]=4 10352 B13R1.6 COCCOCc1cccc(n1)Br 8420f6208eaeabd5c775f57dea9fb0f7 [0,2,0,0,0,0|1,0,0]=3 10353 B13R1.6 COCCOCc1cccc(n1)C 01db2e9eb6a4175440589423dd5ec072 [0,2,0,0,0,0|1,0,0]=3 10354 B13R1.6 COCCOCc1cccc(n1)Cl 75917352a59ab225d80992fdf0929ac8 [0,2,0,0,0,0|1,0,0]=3 10355 B13R1.6 COCCOCc1cccc(n1)F 179a9eda82b5545c367351cea72156ea [0,2,0,0,0,0|1,0,0]=3 10356 B13R1.6 COCCOCc1cccc(n1)I 6ab16f9cbed8e0d7ae1bd257a35a498e [0,2,0,0,0,0|1,0,0]=3 10357 B13R1.6 COCCOCc1ccnc(n1)C ba754dd49da79ee78c459325cc35b8fb [0,2,0,0,0,0|2,0,0]=4 10358 B13R1.6 COCCOCc1ccnc(n1)Cl e2b4925981bca69c64e57dd3ce501426 [0,2,0,0,0,0|2,0,0]=4 10359 B13R1.6 COCCOCc1cncc(n1)Br e2a38723fa5c044c05f4a1d9e8e52d47 [0,2,0,0,0,0|2,0,0]=4 10360 B13R1.6 COCCOCc1cncc(n1)Cl 37fbf88a2e058c01bbcdf0bbf9fa1a8d [0,2,0,0,0,0|2,0,0]=4 10361 B13R1.6 COCCOCc1nccc(n1)C 25ea046b2150ee361f0590434df49201 [0,2,0,0,0,0|2,0,0]=4 10362 B13R1.6 COCCOCc1nccc(n1)Cl 4397e79ba66656ca1c054d4f24ccc544 [0,2,0,0,0,0|2,0,0]=4 10363 B13R1.6 COCNCCc1cccc(c1)Br 8fb221abcca0796b107dcd9a384d90a3 [0,2,0,0,0,0|2,0,0]=4 10364 B13R1.6 COCNCCc1cccc(c1)C 5a09b08bcc6ba44ffdf9ec750e4a9099 [0,2,0,0,0,0|2,0,0]=4 10365 B13R1.6 COCNCCc1cccc(c1)Cl 7371af6509b8cb17e51dc6cbdf0b0aa8 [0,2,0,0,0,0|2,0,0]=4 10366 B13R1.6 COCNCCc1cccc(c1)F 97cccfbc31ad820fb171ada1eb5c12ac [0,2,0,0,0,0|2,0,0]=4 10367 B13R1.6 COCNCCc1cccc(c1)I 831902eae044115d26a4e3c4cfcb09e6 [0,2,0,0,0,0|2,0,0]=4 10368 B13R1.6 COCNCCc1cccc(n1)C c3d7948edea445632fc1e06ea0c8aec0 [0,2,0,0,0,0|1,0,0]=3 10369 B13R1.6 COCOCCc1cc(ccn1)Br 8b0d3ee6718ab9e8290449d688b734c1 [0,2,0,0,0,0|1,0,0]=3 10370 B13R1.6 COCOCCc1cccc(c1)Br 65ba33df2e0b175eb5a0629031e729f6 [0,2,0,0,0,0|2,0,0]=4 10371 B13R1.6 COCOCCc1cccc(c1)C e8b5c7e2027f9d633d74853640de8c56 [0,2,0,0,0,0|2,0,0]=4 10372 B13R1.6 COCOCCc1cccc(c1)Cl 4151bf5885075989007076fc9e40d0b8 [0,2,0,0,0,0|2,0,0]=4 10373 B13R1.6 COCOCCc1cccc(c1)F 9f3f7e8940b4e992bbc66796dd4ef7ea [0,2,0,0,0,0|2,0,0]=4 10374 B13R1.6 COCOCCc1cccc(c1)I ec5827de6b1ce66841ebd5c92c8794e8 [0,2,0,0,0,0|2,0,0]=4 10375 B13R1.6 COCOCCc1cccc(n1)Br 70006a7a2af4d8cb140f2d1c7d71dbc3 [0,2,0,0,0,0|1,0,0]=3 10376 B13R1.6 COCOCCc1cccc(n1)C b0954eea0a21e0c67d4b064cdba4919d [0,2,0,0,0,0|1,0,0]=3 10377 B13R1.6 COCOCCc1cccc(n1)Cl faee041ec4401e8b6e9a1b7ad1b921ed [0,2,0,0,0,0|1,0,0]=3 10378 B13R1.6 COCOCCc1cncc(n1)Cl 53670946ac144debc7e6d904f3a9b0e3 [0,2,0,0,0,0|2,0,0]=4 10379 B13R1.6 CSCCCNc1cc(ccn1)Br 89078045554aa076f79fdf239b2a66d2 [0,2,0,0,0,0|1,0,0]=3 10380 B13R1.6 CSCCCNc1cc(ccn1)C 5a4e7027b669dbebdb23112e2ba231fd [0,2,0,0,0,0|1,0,0]=3 10381 B13R1.6 CSCCCNc1cc(ccn1)Cl d0a4ad2e3c608b4bd93d1e0f4c07d856 [0,2,0,0,0,0|1,0,0]=3 10382 B13R1.6 CSCCCNc1cc(ccn1)F ab6f0eef59dd1833f670d651efc76b7c [0,2,0,0,0,0|1,0,0]=3 10383 B13R1.6 CSCCCNc1cc(ccn1)I d5ae93f1aaad5cb534c3931bdcd86972 [0,2,0,0,0,0|1,0,0]=3 10384 B13R1.6 CSCCCNc1cc(cnn1)Br 98a7775f783f802652325adfeeaf6f32 [0,2,0,0,0,0|2,0,0]=4 10385 B13R1.6 CSCCCNc1cc(cnn1)C 7b074e8d96fa5f7a15034029ae97d547 [0,2,0,0,0,0|2,0,0]=4 10386 B13R1.6 CSCCCNc1cc(cnn1)Cl f334b3acb24c4e970d59e57bc5c69d92 [0,2,0,0,0,0|2,0,0]=4 10387 B13R1.6 CSCCCNc1cc(ncn1)Br 92f24d3a044854c44c8bd4a7d7cf0aae [0,2,0,0,0,0|2,0,0]=4 10388 B13R1.6 CSCCCNc1cc(ncn1)C a2cd2dd405dafae53a67571c6610a25e [0,2,0,0,0,0|2,0,0]=4 10389 B13R1.6 CSCCCNc1cc(ncn1)Cl d698fe5b60a5289e140bf6a17985aaa2 [0,2,0,0,0,0|2,0,0]=4 10390 B13R1.6 CSCCCNc1cc(ncn1)F 7f9a74b13411f9eb6724d1b67986a37e [0,2,0,0,0,0|2,0,0]=4 10391 B13R1.6 CSCCCNc1cc(ncn1)I 426fa09218fd480c69b1dfe34a163458 [0,2,0,0,0,0|2,0,0]=4 10392 B13R1.6 CSCCCNc1cc[nH]c(=O)n1 68ff6868eb946e1d16f18312b26ed383 [0,2,0,0,0,0|2,0,0]=4 10393 B13R1.6 CSCCCNc1cccc(=O)[nH]1 5883ee40a10885dce99223b5938fc0d4 [0,2,0,0,0,0|1,0,1]=4 10394 B13R1.6 CSCCCNc1cccc(c1)Br 59654c98a0e2bb3ca1afe2131df5040f [0,2,0,0,0,0|2,0,0]=4 10395 B13R1.6 CSCCCNc1cccc(c1)C 50e6e3414fc3b8896a2f59928e2bcee8 [0,2,0,0,0,0|2,0,0]=4 10396 B13R1.6 CSCCCNc1cccc(c1)Cl bd52d12e84d7095ac77f9c4264735487 [0,2,0,0,0,0|2,0,0]=4 10397 B13R1.6 CSCCCNc1cccc(c1)F 35ad47ed7b1978c50997f6460f2d96dd [0,2,0,0,0,0|2,0,0]=4 10398 B13R1.6 CSCCCNc1cccc(c1)I 2d2d782a32979267f2e3b15ac2fe5cc6 [0,2,0,0,0,0|2,0,0]=4 10399 B13R1.6 CSCCCNc1cccc(c1)S 8eb2055e03f8f0f12d9972704841063f [0,2,0,0,0,0|2,0,0]=4 10400 B13R1.6 CSCCCNc1cccc(n1)Br 857b2ecb76587edf47866717757e1af0 [0,2,0,0,0,0|1,0,0]=3 10401 B13R1.6 CSCCCNc1cccc(n1)C a9bbda2a5f5940ec238e4c6c8304842d [0,2,0,0,0,0|1,0,0]=3 10402 B13R1.6 CSCCCNc1cccc(n1)Cl 79459c74c865c4c3abdf076185d97739 [0,2,0,0,0,0|1,0,0]=3 10403 B13R1.6 CSCCCNc1cccc(n1)F 5f906ee1421bf46e0e49399067840792 [0,2,0,0,0,0|1,0,0]=3 10404 B13R1.6 CSCCCNc1cccc(n1)I 1bfdbe5e810508bf8a1065fa436886fc [0,2,0,0,0,0|1,0,0]=3 10405 B13R1.6 CSCCCNc1ccnc(n1)Br 3187edb9116493e662156f1f8e6fe251 [0,2,0,0,0,0|2,0,0]=4 10406 B13R1.6 CSCCCNc1ccnc(n1)C 1af94b880005961e519fbc65a109d7ec [0,2,0,0,0,0|2,0,0]=4 10407 B13R1.6 CSCCCNc1ccnc(n1)Cl 577aa891cffc3efb23b0cb0bab47e9ce [0,2,0,0,0,0|2,0,0]=4 10408 B13R1.6 CSCCCNc1ccnc(n1)F f7638090444246e86a82b5a9f84d52da [0,2,0,0,0,0|2,0,0]=4 10409 B13R1.6 CSCCCNc1ccnc(n1)S fa9172cf5bcac204c7fd1f3907df711f [0,2,0,0,0,0|2,0,0]=4 10410 B13R1.6 CSCCCNc1cncc(n1)Br 4a11204ee02ab4086d667628ac9fed69 [0,2,0,0,0,0|2,0,0]=4 10411 B13R1.6 CSCCCNc1cncc(n1)C 51089445ca621c812892400912084d30 [0,2,0,0,0,0|2,0,0]=4 10412 B13R1.6 CSCCCNc1cncc(n1)Cl a269720d684162aa5f15f3c54e970b4f [0,2,0,0,0,0|2,0,0]=4 10413 B13R1.6 CSCCCNc1cncc(n1)F d6258434eed45ac1441797f8f41756cb [0,2,0,0,0,0|2,0,0]=4 10414 B13R1.6 CSCCCNc1nccc(=O)[nH]1 7267ea77ea9c91819d54cec11ab3c9ae [0,2,0,0,0,0|2,0,0]=4 10415 B13R1.6 CSCCCNc1nccc(n1)Br f47795030512393256ddaca35c2f508b [0,2,0,0,0,0|2,0,0]=4 10416 B13R1.6 CSCCCNc1nccc(n1)C aaa687ae329a71bff4c14809b8e886dd [0,2,0,0,0,0|2,0,0]=4 10417 B13R1.6 CSCCCNc1nccc(n1)Cl 9e286ee95a789c026760e84ac6355130 [0,2,0,0,0,0|2,0,0]=4 10418 B13R1.6 CSCCCNc1nccc(n1)F 46eafc7ea03122d02605df154df2e613 [0,2,0,0,0,0|2,0,0]=4 10419 B13R1.6 CSCCCNc1nccc(n1)I 019c1a33c395c4fde998848b2903c13d [0,2,0,0,0,0|2,0,0]=4 10420 B13R1.6 CSCCCNc1nccc(n1)S 50d5e59b189878b73739ee84f5434165 [0,2,0,0,0,0|2,0,0]=4 10421 B13R1.6 CSCCCOc1cc(ccn1)Br b4fd272d7a9362a373b1d4f6f94f1584 [0,2,0,0,0,0|1,0,0]=3 10422 B13R1.6 CSCCCOc1cc(ccn1)C 7bf5092c87bb6595d634106732b86c40 [0,2,0,0,0,0|1,0,0]=3 10423 B13R1.6 CSCCCOc1cc(ccn1)Cl 3fd4c45960cf3c50da5b8bee21992642 [0,2,0,0,0,0|1,0,0]=3 10424 B13R1.6 CSCCCOc1cc(ccn1)F 40c302696596dc392b5b44e9c8c879b9 [0,2,0,0,0,0|1,0,0]=3 10425 B13R1.6 CSCCCOc1cc(ncn1)Br 4fce09d34d2b29e6862ce30f1a4a7dd2 [0,2,0,0,0,0|2,0,0]=4 10426 B13R1.6 CSCCCOc1cc(ncn1)C a5a6f33146de0b4278a37fdccbed7352 [0,2,0,0,0,0|2,0,0]=4 10427 B13R1.6 CSCCCOc1cc(ncn1)Cl dba831df6ce8c176b760f3898df107a8 [0,2,0,0,0,0|2,0,0]=4 10428 B13R1.6 CSCCCOc1cccc(=O)[nH]1 35b0840be469e3f1b5c78cf58859d1d2 [0,2,0,0,0,0|1,0,1]=4 10429 B13R1.6 CSCCCOc1cccc(c1)Br 4d04ff9926c44aeda1a7635eb6d410d4 [0,2,0,0,0,0|2,0,0]=4 10430 B13R1.6 CSCCCOc1cccc(c1)C ce661b599de34a429fe3013b99588058 [0,2,0,0,0,0|2,0,0]=4 10431 B13R1.6 CSCCCOc1cccc(c1)Cl a475c0c873376e830cb93924f697219e [0,2,0,0,0,0|2,0,0]=4 10432 B13R1.6 CSCCCOc1cccc(c1)F e1e67e88b3769d796bdd440d91761e59 [0,2,0,0,0,0|2,0,0]=4 10433 B13R1.6 CSCCCOc1cccc(c1)I 7fea5ae56d09e5412a1df3d56cda7bcf [0,2,0,0,0,0|2,0,0]=4 10434 B13R1.6 CSCCCOc1cccc(c1)S e36769b31f3f45160320eb5a295893f6 [0,2,0,0,0,0|2,0,0]=4 10435 B13R1.6 CSCCCOc1cccc(n1)Br 32315e9a69045bbfe4906eef6cc5dcdd [0,2,0,0,0,0|1,0,0]=3 10436 B13R1.6 CSCCCOc1cccc(n1)C 0956d3f03650ee7859db96f8edd8777c [0,2,0,0,0,0|1,0,0]=3 10437 B13R1.6 CSCCCOc1cccc(n1)F ac4759e07eec8b86bb19c951c01680b8 [0,2,0,0,0,0|1,0,0]=3 10438 B13R1.6 CSCCCOc1ccnc(n1)C d9fdc182d03c293016bbd80fab3c0c9e [0,2,0,0,0,0|2,0,0]=4 10439 B13R1.6 CSCCCOc1ccnc(n1)Cl b58f556b31b5257e6f337f6ff94eeecb [0,2,0,0,0,0|2,0,0]=4 10440 B13R1.6 CSCCCOc1cncc(n1)Br 578ecc0a5664979255fedd57a2164af0 [0,2,0,0,0,0|2,0,0]=4 10441 B13R1.6 CSCCCOc1cncc(n1)C 8ab6bd248e082f7c5738453fa1ecf991 [0,2,0,0,0,0|2,0,0]=4 10442 B13R1.6 CSCCCOc1cncc(n1)Cl c5c71f1c6429085ddef36865a9d48d4c [0,2,0,0,0,0|2,0,0]=4 10443 B13R1.6 CSCCCOc1nccc(n1)Cl 8cbce725cec2786f81420d7b00a30737 [0,2,0,0,0,0|2,0,0]=4 10444 B13R1.6 CSCCCOc1nccc(n1)S c72a3287e782299bd1871769ff07c5c6 [0,2,0,0,0,0|2,0,0]=4 10445 B13R1.6 CSCCNCc1cc(ccn1)Br f1fa529ce2c5aff9221d91b80ba6b03a [0,2,0,0,0,0|1,0,0]=3 10446 B13R1.6 CSCCNCc1cc(ccn1)C bf3037ad16215d6c01669e9f32a292c0 [0,2,0,0,0,0|1,0,0]=3 10447 B13R1.6 CSCCNCc1cc(ccn1)Cl aba8dad3666dd0ec4eb9b5b61ef2f132 [0,2,0,0,0,0|1,0,0]=3 10448 B13R1.6 CSCCNCc1cc[nH]c(=O)n1 5a38d6c11c7f71c3cf6652820145d970 [0,2,0,0,0,0|2,0,0]=4 10449 B13R1.6 CSCCNCc1cccc(c1)Br 9333d9b7995fd3567e361f17ca0d3e14 [0,2,0,0,0,0|2,0,0]=4 10450 B13R1.6 CSCCNCc1cccc(c1)C 24acfa108f8d8b6e1397cb05151fa386 [0,2,0,0,0,0|2,0,0]=4 10451 B13R1.6 CSCCNCc1cccc(c1)Cl 430458a78b93586242ccc5b87ece6116 [0,2,0,0,0,0|2,0,0]=4 10452 B13R1.6 CSCCNCc1cccc(c1)F e9dd2034fef73732e09d8433496044e6 [0,2,0,0,0,0|2,0,0]=4 10453 B13R1.6 CSCCNCc1cccc(c1)I 8616cdbc4a2eb8af0bbef044a4c3976e [0,2,0,0,0,0|2,0,0]=4 10454 B13R1.6 CSCCNCc1cccc(n1)Br 5f276afa655a18d8f8c82e04b2a66fca [0,2,0,0,0,0|1,0,0]=3 10455 B13R1.6 CSCCNCc1cccc(n1)C 88beefc19b6daaf72aacd260e5f21b89 [0,2,0,0,0,0|1,0,0]=3 10456 B13R1.6 CSCCNCc1cccc(n1)Cl dedae7fedb91a01a0177ddf41c62fd59 [0,2,0,0,0,0|1,0,0]=3 10457 B13R1.6 CSCCNCc1cccc(n1)F f5e9c5372f35f51dee5e84e5e518532e [0,2,0,0,0,0|1,0,0]=3 10458 B13R1.6 CSCCNCc1ccnc(n1)C 76b7b41cd6444584aeee84deff957fbb [0,2,0,0,0,0|2,0,0]=4 10459 B13R1.6 CSCCNCc1ccnc(n1)Cl 64117710d722576c510db88e4f6b85af [0,2,0,0,0,0|2,0,0]=4 10460 B13R1.6 CSCCNCc1cncc(n1)Cl 74a822e5cbb7be58bba5bbb40120f2a4 [0,2,0,0,0,0|2,0,0]=4 10461 B13R1.6 CSCCNCc1nccc(n1)C 2a0edda245d57fc4915af16f791e04af [0,2,0,0,0,0|2,0,0]=4 10462 B13R1.6 CSCCNCc1nccc(n1)Cl ff13254142a8f805eae440d5a43c855f [0,2,0,0,0,0|2,0,0]=4 10463 B13R1.6 CSCCOCc1cc(ccn1)Br 5f793ccd9a44c111df75fba047253db7 [0,2,0,0,0,0|1,0,0]=3 10464 B13R1.6 CSCCOCc1cc(ccn1)C 8cb0c9c726bbbd2050a87600c17d446e [0,2,0,0,0,0|1,0,0]=3 10465 B13R1.6 CSCCOCc1cc(ccn1)Cl ef056875100124fe7d4065f2465b0909 [0,2,0,0,0,0|1,0,0]=3 10466 B13R1.6 CSCCOCc1cc(ccn1)F c28c4b550195ee867208a51892c14649 [0,2,0,0,0,0|1,0,0]=3 10467 B13R1.6 CSCCOCc1cc(ccn1)I 3dd6c948c86cdbd9a80c411d3ba712c0 [0,2,0,0,0,0|1,0,0]=3 10468 B13R1.6 CSCCOCc1cc(cnn1)C 526cbe464bae9b6cb9eaa9cf6111c74d [0,2,0,0,0,0|2,0,0]=4 10469 B13R1.6 CSCCOCc1cc(ncn1)C fa82a05b51faa85de180aad588f27bee [0,2,0,0,0,0|2,0,0]=4 10470 B13R1.6 CSCCOCc1cc(ncn1)Cl d7f218e6b49217606c75bf9fbe31669e [0,2,0,0,0,0|2,0,0]=4 10471 B13R1.6 CSCCOCc1cccc(c1)Br d2b2bf0b0e67f0a7f43e75f165db0bd0 [0,2,0,0,0,0|2,0,0]=4 10472 B13R1.6 CSCCOCc1cccc(c1)C d99d3954c2eb355769359781dc5591cd [0,2,0,0,0,0|2,0,0]=4 10473 B13R1.6 CSCCOCc1cccc(c1)Cl 80561ce3292d2e76a5626f619387615e [0,2,0,0,0,0|2,0,0]=4 10474 B13R1.6 CSCCOCc1cccc(c1)F a85e77794719902d1124a64ed2eb4cf9 [0,2,0,0,0,0|2,0,0]=4 10475 B13R1.6 CSCCOCc1cccc(c1)I 6a4b31ce0837c734ce1c76051df29595 [0,2,0,0,0,0|2,0,0]=4 10476 B13R1.6 CSCCOCc1cccc(n1)Br 91eff9d927519bd7856edb5f27785f51 [0,2,0,0,0,0|1,0,0]=3 10477 B13R1.6 CSCCOCc1cccc(n1)C e8c629c15480f599e006dc3ae9a0e847 [0,2,0,0,0,0|1,0,0]=3 10478 B13R1.6 CSCCOCc1cccc(n1)Cl 1c67341e245f9dfcac7e62fa05aa2531 [0,2,0,0,0,0|1,0,0]=3 10479 B13R1.6 CSCCOCc1cccc(n1)F b12465bc72974dfeb104c5874642822c [0,2,0,0,0,0|1,0,0]=3 10480 B13R1.6 CSCCOCc1cccc(n1)I 872022125acb744902be921f45bce0dd [0,2,0,0,0,0|1,0,0]=3 10481 B13R1.6 CSCCOCc1ccnc(n1)C 61d7ec2e75cbe98bf7753a474d72569b [0,2,0,0,0,0|2,0,0]=4 10482 B13R1.6 CSCCOCc1ccnc(n1)Cl 75ae0de647a36ce55c2684670a1e4d9e [0,2,0,0,0,0|2,0,0]=4 10483 B13R1.6 CSCCOCc1cncc(n1)Br 2920e9933f032cc9d9e1ba2d21236464 [0,2,0,0,0,0|2,0,0]=4 10484 B13R1.6 CSCCOCc1cncc(n1)Cl c2a6a7585532d07874821192be5ac63d [0,2,0,0,0,0|2,0,0]=4 10485 B13R1.6 CSCCOCc1nccc(n1)C c96b7e9f3751089fcd1ba6fa83b46c97 [0,2,0,0,0,0|2,0,0]=4 10486 B13R1.6 CSCCOCc1nccc(n1)Cl d3f66e388e96ff9fd0caeb3f83f9a664 [0,2,0,0,0,0|2,0,0]=4 10487 B13R1.6 CSCNCCc1cccc(c1)Br 292c93595d9b023e55bfba416323ce51 [0,2,0,0,0,0|2,0,0]=4 10488 B13R1.6 CSCNCCc1cccc(c1)C d209fd84665cdcbe78de52493f0bd1af [0,2,0,0,0,0|2,0,0]=4 10489 B13R1.6 CSCNCCc1cccc(c1)Cl acf992f0b953a9632060318d4e42c49b [0,2,0,0,0,0|2,0,0]=4 10490 B13R1.6 CSCNCCc1cccc(c1)F f2c66b6ccc3542551788613b552ae2e1 [0,2,0,0,0,0|2,0,0]=4 10491 B13R1.6 CSCNCCc1cccc(c1)I eb42ab27647c4c4b125ae43121c7715f [0,2,0,0,0,0|2,0,0]=4 10492 B13R1.6 CSCNCCc1cccc(n1)C 40a6ee190c4517e7db8c8f328e9b67d5 [0,2,0,0,0,0|1,0,0]=3 10493 B13R1.6 CSCOCCc1cc(ccn1)Br c5e40f92abd885b5dd3906f879dbdb60 [0,2,0,0,0,0|1,0,0]=3 10494 B13R1.6 CSCOCCc1cccc(c1)Br 6ae29f4b3904b4e96775a8812d33a2c6 [0,2,0,0,0,0|2,0,0]=4 10495 B13R1.6 CSCOCCc1cccc(c1)C 1efb1a70d9eca2ceeb36336d87781d3b [0,2,0,0,0,0|2,0,0]=4 10496 B13R1.6 CSCOCCc1cccc(c1)Cl 5578482cbfbe64ce9cc2c36177cafa0c [0,2,0,0,0,0|2,0,0]=4 10497 B13R1.6 CSCOCCc1cccc(c1)F 31abda4a2001930e91c3523c4f995b7b [0,2,0,0,0,0|2,0,0]=4 10498 B13R1.6 CSCOCCc1cccc(c1)I b903c387d253afeb0fd1f3a11ffbbbb1 [0,2,0,0,0,0|2,0,0]=4 10499 B13R1.6 CSCOCCc1cccc(n1)Br 2e0b6db0cdb2dad6852a5f8dc3d3a782 [0,2,0,0,0,0|1,0,0]=3 10500 B13R1.6 CSCOCCc1cccc(n1)C 287d63212555c083f42cb804b73c8902 [0,2,0,0,0,0|1,0,0]=3 10501 B13R1.6 CSCOCCc1cccc(n1)Cl 21d730fc064f1b8224c89f53597450d1 [0,2,0,0,0,0|1,0,0]=3 10502 B13R1.6 CSCOCCc1cncc(n1)Cl ffe7188a066e7842184bc6f60696e7c4 [0,2,0,0,0,0|2,0,0]=4 10503 B13R1.6 Cc1cc(ncn1)COCCCF aa135679864b3bd4e8e7f215566bb9d5 [0,2,0,0,0,0|2,0,0]=4 10504 B13R1.6 Cc1cc(ncn1)COCCCS 5f60c0a196af5f476538c74b61b16be5 [0,2,0,0,0,0|2,0,0]=4 10505 B13R1.6 Cc1cc(ncn1)NCCCCF 5a98ed9df0de01a935a759df945a5866 [0,2,0,0,0,0|2,0,0]=4 10506 B13R1.6 Cc1cc(ncn1)NCCCCO cfe2abd6f12e78d40ed54df0bf3e2bdd [0,2,0,0,0,0|2,0,0]=4 10507 B13R1.6 Cc1cc(ncn1)OCCCCF 84daad72a67838026f392dd58390ee1e [0,2,0,0,0,0|2,0,0]=4 10508 B13R1.6 Cc1cccc(c1)CCCNCF 7ea0228de4ea8cd8d81a798a26ff3fba [0,2,0,0,0,0|2,0,0]=4 10509 B13R1.6 Cc1cccc(c1)CCCNCO a6b8efbe722b324952964f6ee1d5aa68 [0,2,0,0,0,0|2,0,0]=4 10510 B13R1.6 Cc1cccc(c1)CCCOCF c1a9d1ddd65620862d17d800b7c4b4f4 [0,2,0,0,0,0|2,0,0]=4 10511 B13R1.6 Cc1cccc(c1)CCNCCBr d924f28679c7e57f12f9e7558269323c [0,2,0,0,0,0|2,0,0]=4 10512 B13R1.6 Cc1cccc(c1)CCNCCF 8364d20b37e3a4f969d5d1826071b8d9 [0,2,0,0,0,0|2,0,0]=4 10513 B13R1.6 Cc1cccc(c1)CCNCCI 1d4e5332e9dbb042e595971994569312 [0,2,0,0,0,0|2,0,0]=4 10514 B13R1.6 Cc1cccc(c1)CCNCCO 12aff4065ab203cf4bd5087e946c0e92 [0,2,0,0,0,0|2,0,0]=4 10515 B13R1.6 Cc1cccc(c1)CCNCCS be1f0819a522e62dc2b179e6d4bee149 [0,2,0,0,0,0|2,0,0]=4 10516 B13R1.6 Cc1cccc(c1)CCOCCF 9a263b1a84a22696f8bdd74e0b223bed [0,2,0,0,0,0|2,0,0]=4 10517 B13R1.6 Cc1cccc(c1)CCOCCS a42a3e9310bbb81ace6596c83e6a356d [0,2,0,0,0,0|2,0,0]=4 10518 B13R1.6 Cc1cccc(c1)CNCCCCl 3233ee142f6e45ffc2653a7fe60265a6 [0,2,0,0,0,0|2,0,0]=4 10519 B13R1.6 Cc1cccc(c1)CNCCCF 6fc8ba0c2eb27fdba65c2148c0663d01 [0,2,0,0,0,0|2,0,0]=4 10520 B13R1.6 Cc1cccc(c1)CNCCCO 3ee3579504ffef6b992fc8d5ef7bdc5d [0,2,0,0,0,0|2,0,0]=4 10521 B13R1.6 Cc1cccc(c1)CNCCCS 20ccdad930cd63316131dd07d0290026 [0,2,0,0,0,0|2,0,0]=4 10522 B13R1.6 Cc1cccc(c1)COCCCF f9731ab38c0321f8b4a62d34701eec8c [0,2,0,0,0,0|2,0,0]=4 10523 B13R1.6 Cc1cccc(c1)COCCCS 8cc3f7f3ed3f4669a07a2a94cb934417 [0,2,0,0,0,0|2,0,0]=4 10524 B13R1.6 Cc1cccc(c1)NCCCCCl 25d075dd899026645c1a6469b3357876 [0,2,0,0,0,0|2,0,0]=4 10525 B13R1.6 Cc1cccc(c1)NCCCCF 2fc3932f0f7b34a12b2ad49cd021f345 [0,2,0,0,0,0|2,0,0]=4 10526 B13R1.6 Cc1cccc(c1)NCCCCO 19dfbcc9d32ddb4a4b58ea061c53acd0 [0,2,0,0,0,0|2,0,0]=4 10527 B13R1.6 Cc1cccc(c1)NCCCCS dc16413fb09fe49ac4a9ba8b15d89810 [0,2,0,0,0,0|2,0,0]=4 10528 B13R1.6 Cc1cccc(c1)OCCCCF 3051fe9fb6e0df35b60fa85d0ab98d90 [0,2,0,0,0,0|2,0,0]=4 10529 B13R1.6 Cc1cccc(n1)CCCOCF 732e03355da9b6a95d87cb3a718fd5d1 [0,2,0,0,0,0|1,0,0]=3 10530 B13R1.6 Cc1cccc(n1)CCNCC#N 9eaf0f8610c54a21a9b444070c34a456 [0,2,0,0,0,0|1,0,1]=4 10531 B13R1.6 Cc1cccc(n1)CCNCC=O 23fecf81efd08686773d09d61d723b11 [0,2,0,0,0,0|1,0,1]=4 10532 B13R1.6 Cc1cccc(n1)CCNCCF 5cf812fe81eb51e373e0aab09f0357e2 [0,2,0,0,0,0|1,0,0]=3 10533 B13R1.6 Cc1cccc(n1)CCNCCO 48772d4c87767563fd99280c073038e0 [0,2,0,0,0,0|1,0,0]=3 10534 B13R1.6 Cc1cccc(n1)CCNCCS 3cae5e61af1a8caea716071d6c0e6e66 [0,2,0,0,0,0|1,0,0]=3 10535 B13R1.6 Cc1cccc(n1)CCOCC#N 9c133fcc2093cdabfff5cd3b88ca2412 [0,2,0,0,0,0|1,0,1]=4 10536 B13R1.6 Cc1cccc(n1)CCOCC=O f9798839d8bec47d9635a266e23e310d [0,2,0,0,0,0|1,0,1]=4 10537 B13R1.6 Cc1cccc(n1)CCOCCF 0f51c3220ed4f80eef999f6a1fa4dca4 [0,2,0,0,0,0|1,0,0]=3 10538 B13R1.6 Cc1cccc(n1)CCOCCS aae46cde2845043d081eea1ad12f056e [0,2,0,0,0,0|1,0,0]=3 10539 B13R1.6 Cc1cccc(n1)CNCCC#N a1f89fe136a97922e60910eab8b49266 [0,2,0,0,0,0|1,0,1]=4 10540 B13R1.6 Cc1cccc(n1)CNCCC=O cfc22c6324fdc86c763947c6ab496904 [0,2,0,0,0,0|1,0,1]=4 10541 B13R1.6 Cc1cccc(n1)CNCCCCl 2faabdbd7520f196e9845b3c1d721903 [0,2,0,0,0,0|1,0,0]=3 10542 B13R1.6 Cc1cccc(n1)CNCCCF e50c5b44f448671e52cff5d2cadad47f [0,2,0,0,0,0|1,0,0]=3 10543 B13R1.6 Cc1cccc(n1)CNCCCO 2bf2c04370b7ff077d42cff9f37eea41 [0,2,0,0,0,0|1,0,0]=3 10544 B13R1.6 Cc1cccc(n1)CNCCCS d0cd4db223dadc0d09d60dc3cd8eec8f [0,2,0,0,0,0|1,0,0]=3 10545 B13R1.6 Cc1cccc(n1)CNCCON 7211774f5ed36693c5c916754d1ad844 [0,2,0,0,0,0|2,0,0]=4 10546 B13R1.6 Cc1cccc(n1)COCCC#N 92358596ab7397604214c1e69a4a1cb2 [0,2,0,0,0,0|1,0,1]=4 10547 B13R1.6 Cc1cccc(n1)COCCC=O 31660c74b5e03d4b8f6d9853cc022d9a [0,2,0,0,0,0|1,0,1]=4 10548 B13R1.6 Cc1cccc(n1)COCCCF 30fa878f0753a17cd486bd76b8ac215e [0,2,0,0,0,0|1,0,0]=3 10549 B13R1.6 Cc1cccc(n1)COCCCS 9cc7f0a0dfe5e5d8f1d6ff723fec6fc2 [0,2,0,0,0,0|1,0,0]=3 10550 B13R1.6 Cc1cccc(n1)NCCCC#N 01d9eff5b3933584fa0e50b30285ce71 [0,2,0,0,0,0|1,0,1]=4 10551 B13R1.6 Cc1cccc(n1)NCCCC=O 0f99d65d96c5680de0056e7f165f006d [0,2,0,0,0,0|1,0,1]=4 10552 B13R1.6 Cc1cccc(n1)NCCCCCl 9093f48ad5ba09b75ea80e495b3be3e2 [0,2,0,0,0,0|1,0,0]=3 10553 B13R1.6 Cc1cccc(n1)NCCCCF 861f6e2d04669889e46fb5b51117a8e5 [0,2,0,0,0,0|1,0,0]=3 10554 B13R1.6 Cc1cccc(n1)NCCCCO d343387437c35e4322211c04143e94fe [0,2,0,0,0,0|1,0,0]=3 10555 B13R1.6 Cc1cccc(n1)NCCCCS 75bf0b23c79b8e5cbf87518a1517901f [0,2,0,0,0,0|1,0,0]=3 10556 B13R1.6 Cc1cccc(n1)OCCCC#N a0dbc686c27b626336db132a7b4db07f [0,2,0,0,0,0|1,0,1]=4 10557 B13R1.6 Cc1cccc(n1)OCCCC=O e22c27de73764b10d81adf4baa4a51ad [0,2,0,0,0,0|1,0,1]=4 10558 B13R1.6 Cc1cccc(n1)OCCCCF 7a3cb630e54b45d4926d09fa0c9aaddf [0,2,0,0,0,0|1,0,0]=3 10559 B13R1.6 Cc1ccnc(c1)CNCCC#N 473c2cf17b45186d6542e03e4f00c493 [0,2,0,0,0,0|1,0,1]=4 10560 B13R1.6 Cc1ccnc(c1)CNCCC=O 766783031c2a654d512d10c3bb7fca96 [0,2,0,0,0,0|1,0,1]=4 10561 B13R1.6 Cc1ccnc(c1)CNCCCCl 6d72369a262202ec7d1807977072f10b [0,2,0,0,0,0|1,0,0]=3 10562 B13R1.6 Cc1ccnc(c1)CNCCCF 0ced3e8fdf636bf5c179d4d16d701f5c [0,2,0,0,0,0|1,0,0]=3 10563 B13R1.6 Cc1ccnc(c1)CNCCCO 699a8ad1a07dbe2ee3ae473db0b53dbf [0,2,0,0,0,0|1,0,0]=3 10564 B13R1.6 Cc1ccnc(c1)CNCCCS 7a7e0e193d743c6464b8ac24ba42ef89 [0,2,0,0,0,0|1,0,0]=3 10565 B13R1.6 Cc1ccnc(c1)CNCCON 594c265f7e3f36f91e40d5d1df0a1d81 [0,2,0,0,0,0|2,0,0]=4 10566 B13R1.6 Cc1ccnc(c1)COCCC#N ab47b66f0d3be09f6c40bb314dee8fcf [0,2,0,0,0,0|1,0,1]=4 10567 B13R1.6 Cc1ccnc(c1)COCCC=O aa16f8018505733569673166b09f5034 [0,2,0,0,0,0|1,0,1]=4 10568 B13R1.6 Cc1ccnc(c1)COCCCF f0092d737d9347c53291644d7ee5361d [0,2,0,0,0,0|1,0,0]=3 10569 B13R1.6 Cc1ccnc(c1)COCCCS 2614da16cc55c668b4f8c357f8a343fa [0,2,0,0,0,0|1,0,0]=3 10570 B13R1.6 Cc1ccnc(c1)NCCCC#N 75b9c349a7bfae106c958dd9a49130ea [0,2,0,0,0,0|1,0,1]=4 10571 B13R1.6 Cc1ccnc(c1)NCCCC=O 6dc1cc9aa427161e84503933950fbfd4 [0,2,0,0,0,0|1,0,1]=4 10572 B13R1.6 Cc1ccnc(c1)NCCCCCl 6a64880fb3a35f456bb4865687a45f52 [0,2,0,0,0,0|1,0,0]=3 10573 B13R1.6 Cc1ccnc(c1)NCCCCF c0dfd1d23cc28f75f15f73e4c1223712 [0,2,0,0,0,0|1,0,0]=3 10574 B13R1.6 Cc1ccnc(c1)NCCCCO 444b0b8e4d9e1c519d621f242109c073 [0,2,0,0,0,0|1,0,0]=3 10575 B13R1.6 Cc1ccnc(c1)OCCCC#N b319f9405cd28e1e8f75b8ad94a0e535 [0,2,0,0,0,0|1,0,1]=4 10576 B13R1.6 Cc1ccnc(c1)OCCCC=O d8628047751b6f48f499792717a80199 [0,2,0,0,0,0|1,0,1]=4 10577 B13R1.6 Cc1ccnc(c1)OCCCCF 8023ef57a12c12832cddd7f1e088d369 [0,2,0,0,0,0|1,0,0]=3 10578 B13R1.6 Cc1ccnc(n1)CNCCCCl 32f10de5c169be28d113c40104a2dc56 [0,2,0,0,0,0|2,0,0]=4 10579 B13R1.6 Cc1ccnc(n1)CNCCCF 94533a40ac07015f12a419ff08b328ee [0,2,0,0,0,0|2,0,0]=4 10580 B13R1.6 Cc1ccnc(n1)CNCCCO 604e12aee148aca693b9fd7918169085 [0,2,0,0,0,0|2,0,0]=4 10581 B13R1.6 Cc1ccnc(n1)CNCCCS 22cbb3eedb0f445ec09087117d411333 [0,2,0,0,0,0|2,0,0]=4 10582 B13R1.6 Cc1ccnc(n1)COCCCF 8fec4e76ed9229ddb59570d79637e44f [0,2,0,0,0,0|2,0,0]=4 10583 B13R1.6 Cc1ccnc(n1)COCCCS d73efaf4d4fd261d3d2f516e1671178a [0,2,0,0,0,0|2,0,0]=4 10584 B13R1.6 Cc1ccnc(n1)NCCCCCl ae98556b8be2fa32fa51acf99a9a5572 [0,2,0,0,0,0|2,0,0]=4 10585 B13R1.6 Cc1ccnc(n1)NCCCCF ac07fe741d9ac32222461e81009db87f [0,2,0,0,0,0|2,0,0]=4 10586 B13R1.6 Cc1ccnc(n1)NCCCCO ed1661efe15fe3aacb6f688eef86cb95 [0,2,0,0,0,0|2,0,0]=4 10587 B13R1.6 Cc1cncc(n1)NCCCCF f1c660c05ee96f5f64c99a3b2a52b35d [0,2,0,0,0,0|2,0,0]=4 10588 B13R1.6 Cc1cncc(n1)NCCCCO 10c8fb1a6bb51942cb0f0ad5e461a9ff [0,2,0,0,0,0|2,0,0]=4 10589 B13R1.6 Cc1cncc(n1)OCCCCF db9156a578de2f844d2dc09ff8b63a5e [0,2,0,0,0,0|2,0,0]=4 10590 B13R1.6 Cc1cnnc(c1)CNCCCCl da1bb7576c6b263843ac6c4b38662bfb [0,2,0,0,0,0|2,0,0]=4 10591 B13R1.6 Cc1cnnc(c1)COCCCF babea80819aa2df1b46846bfa894f011 [0,2,0,0,0,0|2,0,0]=4 10592 B13R1.6 Cc1cnnc(c1)COCCCS 39e15e6b1f4c66895eb662f1a83a88ea [0,2,0,0,0,0|2,0,0]=4 10593 B13R1.6 Cc1cnnc(c1)NCCCCCl 0a8b60e20bd1a0936d112da1610d7f2b [0,2,0,0,0,0|2,0,0]=4 10594 B13R1.6 Cc1cnnc(c1)NCCCCF 9bdbaa624292357ff3c75844c6443939 [0,2,0,0,0,0|2,0,0]=4 10595 B13R1.6 Cc1cnnc(c1)NCCCCO 7a485993a92d0c0e3e59bf7893146690 [0,2,0,0,0,0|2,0,0]=4 10596 B13R1.6 Cc1nccc(n1)CNCCCF c23335528b1e24e174417f93f7eea1f1 [0,2,0,0,0,0|2,0,0]=4 10597 B13R1.6 Cc1nccc(n1)CNCCCO 9064a2e2d01871678f88dd36749bc419 [0,2,0,0,0,0|2,0,0]=4 10598 B13R1.6 Cc1nccc(n1)CNCCCS f0fb1a7a405bd188b23dc2bfe75e4d86 [0,2,0,0,0,0|2,0,0]=4 10599 B13R1.6 Cc1nccc(n1)COCCCF af47761b196fa828bd445ea6508e0466 [0,2,0,0,0,0|2,0,0]=4 10600 B13R1.6 Cc1nccc(n1)COCCCS 5c6db1008540557fca9851591ec3b5db [0,2,0,0,0,0|2,0,0]=4 10601 B13R1.6 Cc1nccc(n1)NCCCCF 1d2b90e9b6cc26f33ccdbe1e7d88898c [0,2,0,0,0,0|2,0,0]=4 10602 B13R1.6 Cc1nccc(n1)NCCCCO 8f52bbe07d55ee2640ded1becb73cfd6 [0,2,0,0,0,0|2,0,0]=4 10603 B13R1.6 Cc1nccc(n1)OCCCCF fcc56e7044f3fad1810918cdff7c1f70 [0,2,0,0,0,0|2,0,0]=4 10604 B13R1.6 ClCCCNCc1cc(ccn1)Br 4556fcbcbb6c64b1161fd78afceb3380 [0,2,0,0,0,0|1,0,0]=3 10605 B13R1.6 ClCCCNCc1cc(ccn1)Cl 27e5132fcf3644ba199626bb53085564 [0,2,0,0,0,0|1,0,0]=3 10606 B13R1.6 ClCCCNCc1cccc(c1)Br f3c336fbf068556db7793963f18fea47 [0,2,0,0,0,0|2,0,0]=4 10607 B13R1.6 ClCCCNCc1cccc(c1)Cl f668bb202a89cdba2b8ed87f15622a32 [0,2,0,0,0,0|2,0,0]=4 10608 B13R1.6 ClCCCNCc1cccc(c1)I 1aacd1cac692c1b1eef16017c8ce7131 [0,2,0,0,0,0|2,0,0]=4 10609 B13R1.6 ClCCCNCc1cccc(n1)Br c15cc7e487ae4033994ad383fe6b625e [0,2,0,0,0,0|1,0,0]=3 10610 B13R1.6 ClCCCNCc1cccc(n1)Cl 474b46cbd06b4b05ae55cdb091422bae [0,2,0,0,0,0|1,0,0]=3 10611 B13R1.6 ClCCCNCc1ccnc(n1)Cl 00553bcb31051976534f4a1107b646a4 [0,2,0,0,0,0|2,0,0]=4 10612 B13R1.6 ClCCCNCc1nccc(n1)Cl 3910d7c9c2750e3e150f0af7baf2895a [0,2,0,0,0,0|2,0,0]=4 10613 B13R1.6 Clc1cccc(c1)CCNCCBr 3bc9bfc769bc457a8107c7bcb877bcda [0,2,0,0,0,0|2,0,0]=4 10614 B13R1.6 Clc1cccc(c1)CCNCCI 3a2b12c7dec0ba2a14753c0a82232186 [0,2,0,0,0,0|2,0,0]=4 10615 B13R1.6 Clc1cncc(n1)CCNCCBr dd7e353d926596ae61bf73cd7f210715 [0,2,0,0,0,0|2,0,0]=4 10616 B13R1.6 Clc1cncc(n1)CCNCCI 4971023e57957dea2f9b8c9e3ef0051c [0,2,0,0,0,0|2,0,0]=4 10617 B13R1.6 FCCCCNc1cc(ccn1)Br b733cddd3df02def465e0e026757ccb8 [0,2,0,0,0,0|1,0,0]=3 10618 B13R1.6 FCCCCNc1cc(ccn1)Cl 0cec827587a870fcb6f326c6db6360b7 [0,2,0,0,0,0|1,0,0]=3 10619 B13R1.6 FCCCCNc1cc(ccn1)F d178502d181a2de8d439d4902c08ab1c [0,2,0,0,0,0|1,0,0]=3 10620 B13R1.6 FCCCCNc1cc(ccn1)I ab2d65b403d4be60cb711211c561b7f0 [0,2,0,0,0,0|1,0,0]=3 10621 B13R1.6 FCCCCNc1cc(cnn1)Br 2ac71399dbeecb2cd1bc779cb1866c20 [0,2,0,0,0,0|2,0,0]=4 10622 B13R1.6 FCCCCNc1cc(cnn1)Cl a643efae2c0cdefdb8cfb23595c7ec4e [0,2,0,0,0,0|2,0,0]=4 10623 B13R1.6 FCCCCNc1cc(ncn1)Br 469d2f62fb18797d1b8ddbb21353d441 [0,2,0,0,0,0|2,0,0]=4 10624 B13R1.6 FCCCCNc1cc(ncn1)Cl 41f1c120ff29765cba92f379e8d8a7d0 [0,2,0,0,0,0|2,0,0]=4 10625 B13R1.6 FCCCCNc1cc(ncn1)F f03907e4597df3a951f9465d682e7f83 [0,2,0,0,0,0|2,0,0]=4 10626 B13R1.6 FCCCCNc1cc(ncn1)I 6bd060ce8677107fa54a9461e8c194de [0,2,0,0,0,0|2,0,0]=4 10627 B13R1.6 FCCCCNc1cccc(c1)Br d1fb64d80bfcefb461db876d212a3fdd [0,2,0,0,0,0|2,0,0]=4 10628 B13R1.6 FCCCCNc1cccc(c1)Cl db691aad7d748004cc3f39ae89ede29a [0,2,0,0,0,0|2,0,0]=4 10629 B13R1.6 FCCCCNc1cccc(c1)F d2a1e515e2ca952ed93cb006a8d0675b [0,2,0,0,0,0|2,0,0]=4 10630 B13R1.6 FCCCCNc1cccc(c1)I dde344b8695f523acbab2bd02a90736c [0,2,0,0,0,0|2,0,0]=4 10631 B13R1.6 FCCCCNc1cccc(c1)S 20ebbed25aa3ca8853282e92220ed851 [0,2,0,0,0,0|2,0,0]=4 10632 B13R1.6 FCCCCNc1cccc(n1)Br 94b99f0f5889093cd27e0a7de034f935 [0,2,0,0,0,0|1,0,0]=3 10633 B13R1.6 FCCCCNc1cccc(n1)Cl 9b4b46e4d61a39608888afbee6a4bff9 [0,2,0,0,0,0|1,0,0]=3 10634 B13R1.6 FCCCCNc1cccc(n1)F 6cdc089c3376c7ccd8216183525a3faa [0,2,0,0,0,0|1,0,0]=3 10635 B13R1.6 FCCCCNc1cccc(n1)I 6716e544b3dba233688ec2318f2b5e83 [0,2,0,0,0,0|1,0,0]=3 10636 B13R1.6 FCCCCNc1ccnc(n1)Br 9e1a0a0cb6b32a38d55da55c5ed03071 [0,2,0,0,0,0|2,0,0]=4 10637 B13R1.6 FCCCCNc1ccnc(n1)Cl 166c302546be71d705f733c0cffe1cfb [0,2,0,0,0,0|2,0,0]=4 10638 B13R1.6 FCCCCNc1ccnc(n1)F 9c68ca034956984ac7882901eb521393 [0,2,0,0,0,0|2,0,0]=4 10639 B13R1.6 FCCCCNc1ccnc(n1)S 3d631fc8cace83c3518571366d2b5324 [0,2,0,0,0,0|2,0,0]=4 10640 B13R1.6 FCCCCNc1cncc(n1)Br 7bc22c2800e9627ab9d97e8018b1ce34 [0,2,0,0,0,0|2,0,0]=4 10641 B13R1.6 FCCCCNc1cncc(n1)Cl 76b030052e68fb01120485bffeff8073 [0,2,0,0,0,0|2,0,0]=4 10642 B13R1.6 FCCCCNc1cncc(n1)F 3afe0c5047c3af45accf72fa75fd2ed7 [0,2,0,0,0,0|2,0,0]=4 10643 B13R1.6 FCCCCNc1nccc(n1)Br 842f1d1c0114ee19cdae968bed2063ae [0,2,0,0,0,0|2,0,0]=4 10644 B13R1.6 FCCCCNc1nccc(n1)Cl 1b68d5c6cbabb4bc05161888d2fc3e6c [0,2,0,0,0,0|2,0,0]=4 10645 B13R1.6 FCCCCNc1nccc(n1)F f0688f6f4a5692ba1d18b6c77da61ca6 [0,2,0,0,0,0|2,0,0]=4 10646 B13R1.6 FCCCCNc1nccc(n1)I f29c9cf1cbcea56d41573b31eb84c9d6 [0,2,0,0,0,0|2,0,0]=4 10647 B13R1.6 FCCCCNc1nccc(n1)S 19716143e8cae7937017c2e63b633bf1 [0,2,0,0,0,0|2,0,0]=4 10648 B13R1.6 FCCCCOc1cc(ccn1)Br 6b8eaa0f88ef8ee72128434c25fd18ce [0,2,0,0,0,0|1,0,0]=3 10649 B13R1.6 FCCCCOc1cc(ccn1)Cl a39c45ea5dcdde9142ca423db458ad0d [0,2,0,0,0,0|1,0,0]=3 10650 B13R1.6 FCCCCOc1cc(ccn1)F 72b8d314394923a290089db70dc34402 [0,2,0,0,0,0|1,0,0]=3 10651 B13R1.6 FCCCCOc1cc(ncn1)Br 8cc96fded51ff01eb385eda575a0fa6c [0,2,0,0,0,0|2,0,0]=4 10652 B13R1.6 FCCCCOc1cc(ncn1)Cl fd34abce27c5807b4cbe261b31310202 [0,2,0,0,0,0|2,0,0]=4 10653 B13R1.6 FCCCCOc1cccc(c1)Br 1a2235a917390938b97bd239a830ba51 [0,2,0,0,0,0|2,0,0]=4 10654 B13R1.6 FCCCCOc1cccc(c1)Cl 19e0688245c32067efb78595ce540415 [0,2,0,0,0,0|2,0,0]=4 10655 B13R1.6 FCCCCOc1cccc(c1)F 7451d2cdb4e47786e5b0fabfa6479e7d [0,2,0,0,0,0|2,0,0]=4 10656 B13R1.6 FCCCCOc1cccc(c1)I f89da2435f8d6668c51d06f4430f5dfa [0,2,0,0,0,0|2,0,0]=4 10657 B13R1.6 FCCCCOc1cccc(c1)S 1e86c013542bce41e359200e0ac53d5d [0,2,0,0,0,0|2,0,0]=4 10658 B13R1.6 FCCCCOc1cccc(n1)Br f6af35382e7a5cafd2e30fedcdce5132 [0,2,0,0,0,0|1,0,0]=3 10659 B13R1.6 FCCCCOc1cccc(n1)F 70d025d6b0c2bbd96bd739e8fd18d423 [0,2,0,0,0,0|1,0,0]=3 10660 B13R1.6 FCCCCOc1ccnc(n1)Cl f4931e33c006c11d47d0a47ee602e857 [0,2,0,0,0,0|2,0,0]=4 10661 B13R1.6 FCCCCOc1cncc(n1)Br c95454feceacee4661d2bf5d0097851c [0,2,0,0,0,0|2,0,0]=4 10662 B13R1.6 FCCCCOc1cncc(n1)Cl 30467211bd188e362d0b4c7e247e7175 [0,2,0,0,0,0|2,0,0]=4 10663 B13R1.6 FCCCCOc1nccc(n1)Cl 29a5e10db05b756a3b4f63cc0391a0be [0,2,0,0,0,0|2,0,0]=4 10664 B13R1.6 FCCCCOc1nccc(n1)S 1af933333ebbe153ad0b35d92a839129 [0,2,0,0,0,0|2,0,0]=4 10665 B13R1.6 FCCCNCc1cc(ccn1)Br 98036d927f064168bf199a71c416c7f0 [0,2,0,0,0,0|1,0,0]=3 10666 B13R1.6 FCCCNCc1cc(ccn1)Cl 5de376c5501defb57ab3825e89c2a9de [0,2,0,0,0,0|1,0,0]=3 10667 B13R1.6 FCCCNCc1cccc(c1)Br 26f55822f0691e1aa3081c63bef6d059 [0,2,0,0,0,0|2,0,0]=4 10668 B13R1.6 FCCCNCc1cccc(c1)Cl 763107715f85e54cce0b2cbdd598f6d9 [0,2,0,0,0,0|2,0,0]=4 10669 B13R1.6 FCCCNCc1cccc(c1)F 218a961d41d6fba83f768613ea60f39b [0,2,0,0,0,0|2,0,0]=4 10670 B13R1.6 FCCCNCc1cccc(c1)I ad6900e45120efc47ead063710999edc [0,2,0,0,0,0|2,0,0]=4 10671 B13R1.6 FCCCNCc1cccc(n1)Br 370b07cf3e91be7facc356b6afd457f3 [0,2,0,0,0,0|1,0,0]=3 10672 B13R1.6 FCCCNCc1cccc(n1)Cl 991a50d394f06124d326ee001a61e169 [0,2,0,0,0,0|1,0,0]=3 10673 B13R1.6 FCCCNCc1cccc(n1)F 65001d2b13b335693af6e766139831fd [0,2,0,0,0,0|1,0,0]=3 10674 B13R1.6 FCCCNCc1cncc(n1)Cl e775b42aec0ef43bebed95d1ff39ccec [0,2,0,0,0,0|2,0,0]=4 10675 B13R1.6 FCCCNCc1nccc(n1)Cl b6381b2bc756d660e0d58c1d4571dfe4 [0,2,0,0,0,0|2,0,0]=4 10676 B13R1.6 FCCCOCc1cc(ccn1)Br b76129a254f31dfe4498e1f844e1ae9d [0,2,0,0,0,0|1,0,0]=3 10677 B13R1.6 FCCCOCc1cc(ccn1)Cl 972cea56a14b68cd61732bd2e854c410 [0,2,0,0,0,0|1,0,0]=3 10678 B13R1.6 FCCCOCc1cc(ccn1)F 53ecd8a091ca33ce310d351e5ff07292 [0,2,0,0,0,0|1,0,0]=3 10679 B13R1.6 FCCCOCc1cc(ccn1)I e70ab363309a6ee846f9a372d11d0542 [0,2,0,0,0,0|1,0,0]=3 10680 B13R1.6 FCCCOCc1cc(ncn1)Cl 94364bcda064409e275e093eeaa045e8 [0,2,0,0,0,0|2,0,0]=4 10681 B13R1.6 FCCCOCc1cccc(c1)Br 1f1b93a8e16dfd66a7c66d3021096aad [0,2,0,0,0,0|2,0,0]=4 10682 B13R1.6 FCCCOCc1cccc(c1)Cl e3a27f67dc10d894f9e961df6dd55e97 [0,2,0,0,0,0|2,0,0]=4 10683 B13R1.6 FCCCOCc1cccc(c1)F 943b43f6273e69cc483b3b150be79f05 [0,2,0,0,0,0|2,0,0]=4 10684 B13R1.6 FCCCOCc1cccc(c1)I 61b11b0a0559a5509b5cc8852ad8a85b [0,2,0,0,0,0|2,0,0]=4 10685 B13R1.6 FCCCOCc1cccc(n1)Br 90c67efa1b5b047eac51101360a1740b [0,2,0,0,0,0|1,0,0]=3 10686 B13R1.6 FCCCOCc1cccc(n1)Cl ce8f1e59a43db6914b5644edde459997 [0,2,0,0,0,0|1,0,0]=3 10687 B13R1.6 FCCCOCc1cccc(n1)F d0d798b1687d211f9fef6b3d94a1fe07 [0,2,0,0,0,0|1,0,0]=3 10688 B13R1.6 FCCCOCc1cccc(n1)I 2bf9526ab51e95b04992230b12f79e7f [0,2,0,0,0,0|1,0,0]=3 10689 B13R1.6 FCCCOCc1ccnc(n1)Cl cf4a2a5e5f4f2aedff99e62541a5ae84 [0,2,0,0,0,0|2,0,0]=4 10690 B13R1.6 FCCCOCc1cncc(n1)Br bc1f26daea04457f46eb8c6b2627c241 [0,2,0,0,0,0|2,0,0]=4 10691 B13R1.6 FCCCOCc1cncc(n1)Cl 5fe787bc60688fbd72c98d2c63932077 [0,2,0,0,0,0|2,0,0]=4 10692 B13R1.6 FCCCOCc1nccc(n1)Cl 961b0138d5a9d725d747a5df8b21a5b1 [0,2,0,0,0,0|2,0,0]=4 10693 B13R1.6 FCCNCCc1cccc(c1)Br 84b219d548f11c342f296fb3bcae92d8 [0,2,0,0,0,0|2,0,0]=4 10694 B13R1.6 FCCNCCc1cccc(c1)Cl 991f8b7df997ac76bd4aad5d2abe997c [0,2,0,0,0,0|2,0,0]=4 10695 B13R1.6 FCCNCCc1cccc(c1)F 3c09741826cc476f7b012bb424ecc26b [0,2,0,0,0,0|2,0,0]=4 10696 B13R1.6 FCCNCCc1cccc(c1)I 42b920acba63e6f150fc3d0ef9782e95 [0,2,0,0,0,0|2,0,0]=4 10697 B13R1.6 FCCNCCc1cncc(n1)Cl 83d2f16dbbf2e6a30a079ec31ecafd7d [0,2,0,0,0,0|2,0,0]=4 10698 B13R1.6 FCCOCCc1cc(ccn1)Br f709df0c2694ab160b75bf0e140bea53 [0,2,0,0,0,0|1,0,0]=3 10699 B13R1.6 FCCOCCc1cccc(c1)Br 50ea027d0deec32a12e42236da8f3dfc [0,2,0,0,0,0|2,0,0]=4 10700 B13R1.6 FCCOCCc1cccc(c1)Cl 7181393b9c7e1361fc30bd14467577f2 [0,2,0,0,0,0|2,0,0]=4 10701 B13R1.6 FCCOCCc1cccc(c1)F 0e4b3eb99de43eeb7b0e6d701a935daf [0,2,0,0,0,0|2,0,0]=4 10702 B13R1.6 FCCOCCc1cccc(c1)I c88a8270808c1c686af9f32173281004 [0,2,0,0,0,0|2,0,0]=4 10703 B13R1.6 FCCOCCc1cccc(n1)Br 40bd99fc5e9ed3d76075e6f6229a9463 [0,2,0,0,0,0|1,0,0]=3 10704 B13R1.6 FCCOCCc1cccc(n1)Cl 5f389e807852aa03c63be35ad852eb3f [0,2,0,0,0,0|1,0,0]=3 10705 B13R1.6 FCCOCCc1cncc(n1)Cl 3877125f0de25d0ef8d80352f1cf6705 [0,2,0,0,0,0|2,0,0]=4 10706 B13R1.6 FCNCCCc1cccc(c1)Br 6e29cbc6132fd7a7bcceac1febba69e9 [0,2,0,0,0,0|2,0,0]=4 10707 B13R1.6 FCNCCCc1cccc(c1)Cl 95b7e250a2f114eef2c087c209f24d2c [0,2,0,0,0,0|2,0,0]=4 10708 B13R1.6 FCNCCCc1cccc(c1)F 155a7d5917ea040902441f5821f6ad3a [0,2,0,0,0,0|2,0,0]=4 10709 B13R1.6 FCOCCCc1cccc(c1)Br 4bff539d87e8453b9ff1d09a993989a3 [0,2,0,0,0,0|2,0,0]=4 10710 B13R1.6 FCOCCCc1cccc(c1)Cl 7e7c41914253df1a105341daab3512c2 [0,2,0,0,0,0|2,0,0]=4 10711 B13R1.6 FCOCCCc1cccc(c1)F 2a81cd07bc3cb827c4790c295d5184a7 [0,2,0,0,0,0|2,0,0]=4 10712 B13R1.6 Fc1cccc(c1)CCNCCBr bdc7cefca7dd3569b0ee1747c7bb4c4a [0,2,0,0,0,0|2,0,0]=4 10713 B13R1.6 Fc1cccc(c1)CCNCCI 9c45f36934d94f392f474bdedf84db8e [0,2,0,0,0,0|2,0,0]=4 10714 B13R1.6 Fc1cccc(c1)CCNCCS 0c98ee561b1887763a78e2a045df6fe2 [0,2,0,0,0,0|2,0,0]=4 10715 B13R1.6 Fc1cccc(c1)CCOCCS ef2e3762ccae77fa9b58bbb35bb7880c [0,2,0,0,0,0|2,0,0]=4 10716 B13R1.6 Fc1cccc(c1)CNCCCCl 6339bd7ba0e296ab24f9d83c159ea5a9 [0,2,0,0,0,0|2,0,0]=4 10717 B13R1.6 Fc1cccc(c1)CNCCCS 55185871a74155f729df57ee8c35fa4b [0,2,0,0,0,0|2,0,0]=4 10718 B13R1.6 Fc1cccc(c1)COCCCS 164e6521a43996ac797c9cf81af78bbc [0,2,0,0,0,0|2,0,0]=4 10719 B13R1.6 Fc1cccc(c1)NCCCCCl fa9fe2e9a966bb790b442158fbb1599e [0,2,0,0,0,0|2,0,0]=4 10720 B13R1.6 Fc1cccc(c1)NCCCCS 3dc09984cf8c06898a1a88dc77c12d75 [0,2,0,0,0,0|2,0,0]=4 10721 B13R1.6 Fc1cccc(n1)CNCCCCl bf12785d8053240ad7a006ab716eb0a8 [0,2,0,0,0,0|1,0,0]=3 10722 B13R1.6 Fc1cccc(n1)CNCCCS dc6d26fe43fe5bb9c567a235b9e9a20c [0,2,0,0,0,0|1,0,0]=3 10723 B13R1.6 Fc1cccc(n1)COCCCS dd88872ce13ad7caa3a5439c0e361a8b [0,2,0,0,0,0|1,0,0]=3 10724 B13R1.6 Fc1cccc(n1)NCCCCCl d9c934bbedf30e3ea28d62f937c628d9 [0,2,0,0,0,0|1,0,0]=3 10725 B13R1.6 Fc1cccc(n1)NCCCCS 75595de2d46b9a5360fb08805f4bd2ef [0,2,0,0,0,0|1,0,0]=3 10726 B13R1.6 Fc1ccnc(c1)COCCCS f09c4b6e9d168b59c2f65e5df939b326 [0,2,0,0,0,0|1,0,0]=3 10727 B13R1.6 Fc1ccnc(c1)NCCCCCl cdd59e042b61f84fafb695484e08be9c [0,2,0,0,0,0|1,0,0]=3 10728 B13R1.6 Fc1ccnc(c1)NCCCCS 30ef6e76547554fabce47dba9e14bf8c [0,2,0,0,0,0|1,0,0]=3 10729 B13R1.6 Fc1cncc(n1)NCCCCCl 3c83d0e773affbc272df3e88971251a6 [0,2,0,0,0,0|2,0,0]=4 10730 B13R1.6 Fc1nccc(n1)NCCCCCl 4c1877ff40307243727dd84ac834d676 [0,2,0,0,0,0|2,0,0]=4 10731 B13R1.6 Fc1nccc(n1)NCCCCS 50f44ba4c463537101c2cee85d0ef1e2 [0,2,0,0,0,0|2,0,0]=4 10732 B13R1.6 N#CCCCNc1cc(ccn1)Br a9289ea71109c0d77dba3ee1dd1148f9 [0,2,0,0,0,0|1,0,1]=4 10733 B13R1.6 N#CCCCNc1cc(ccn1)Cl 3427165f72b2b057b86968b4d3c9c390 [0,2,0,0,0,0|1,0,1]=4 10734 B13R1.6 N#CCCCNc1cc(ccn1)F c10fc86c79b41bbbf8c31e345c9bacbc [0,2,0,0,0,0|1,0,1]=4 10735 B13R1.6 N#CCCCNc1cc(ccn1)I cbeea52e74d4a4902fe7faa5918ac81f [0,2,0,0,0,0|1,0,1]=4 10736 B13R1.6 N#CCCCNc1cccc(n1)Br 063b8aba6b5f7d30841ea792babef957 [0,2,0,0,0,0|1,0,1]=4 10737 B13R1.6 N#CCCCNc1cccc(n1)Cl 63c893d9f8bc0566ddf2276ea4409d91 [0,2,0,0,0,0|1,0,1]=4 10738 B13R1.6 N#CCCCNc1cccc(n1)F 53d790a6ea534ec49177cdbc125ffc45 [0,2,0,0,0,0|1,0,1]=4 10739 B13R1.6 N#CCCCNc1cccc(n1)I a3c44f1b6a8915b154bef980d04aee12 [0,2,0,0,0,0|1,0,1]=4 10740 B13R1.6 N#CCCCOc1cc(ccn1)Br 215126734d58c2a797a4c370d7f67eee [0,2,0,0,0,0|1,0,1]=4 10741 B13R1.6 N#CCCCOc1cc(ccn1)Cl 97486f0ab3af2cf39719dfc6b87b8421 [0,2,0,0,0,0|1,0,1]=4 10742 B13R1.6 N#CCCCOc1cc(ccn1)F de8a715af977eacf773ff1dc646c7012 [0,2,0,0,0,0|1,0,1]=4 10743 B13R1.6 N#CCCCOc1cccc(n1)Br a8b7adadef58520150d2be60ec59258b [0,2,0,0,0,0|1,0,1]=4 10744 B13R1.6 N#CCCCOc1cccc(n1)F 20bb74b069d02e67ed053e59f76653c1 [0,2,0,0,0,0|1,0,1]=4 10745 B13R1.6 N#CCCNCc1cc(ccn1)Br 38c7e19f7b3bc6d0f55d8bf48f9a8c0e [0,2,0,0,0,0|1,0,1]=4 10746 B13R1.6 N#CCCNCc1cc(ccn1)Cl 4f5742636937d446fb63148081cfa35d [0,2,0,0,0,0|1,0,1]=4 10747 B13R1.6 N#CCCNCc1cccc(n1)Br 02c520fb1bf2f747dea98cb3c059420b [0,2,0,0,0,0|1,0,1]=4 10748 B13R1.6 N#CCCNCc1cccc(n1)Cl 75d432f00426deaf270e9308ac51ab31 [0,2,0,0,0,0|1,0,1]=4 10749 B13R1.6 N#CCCNCc1cccc(n1)F 73778730dcbf2747b47594d89319e968 [0,2,0,0,0,0|1,0,1]=4 10750 B13R1.6 N#CCCOCc1cc(ccn1)Br 54eafccf9b5a72f9c0e709590be2aa08 [0,2,0,0,0,0|1,0,1]=4 10751 B13R1.6 N#CCCOCc1cc(ccn1)Cl e91d7166269d51fb855290b16d456ee3 [0,2,0,0,0,0|1,0,1]=4 10752 B13R1.6 N#CCCOCc1cc(ccn1)F 21be541e75018da381715ae280e69c24 [0,2,0,0,0,0|1,0,1]=4 10753 B13R1.6 N#CCCOCc1cc(ccn1)I 6d9a23be3441f473727c0ddee4f887e1 [0,2,0,0,0,0|1,0,1]=4 10754 B13R1.6 N#CCCOCc1cccc(n1)Br 9b724ee63743fd1d3f7d4aa40b00b7d8 [0,2,0,0,0,0|1,0,1]=4 10755 B13R1.6 N#CCCOCc1cccc(n1)Cl 67af6687b6bc2de24d77f550bedfd743 [0,2,0,0,0,0|1,0,1]=4 10756 B13R1.6 N#CCCOCc1cccc(n1)F 82ccd7fd1d422d33fa5663ec71b318e7 [0,2,0,0,0,0|1,0,1]=4 10757 B13R1.6 N#CCCOCc1cccc(n1)I d0ae02104f283deba1010d74bf5fc3bb [0,2,0,0,0,0|1,0,1]=4 10758 B13R1.6 N#CCOCCc1cc(ccn1)Br 046ae144c3a67c517ca56a6d78e8af34 [0,2,0,0,0,0|1,0,1]=4 10759 B13R1.6 N#CCOCCc1cccc(n1)Br 6bd188a2198523a060f83add92e6ee71 [0,2,0,0,0,0|1,0,1]=4 10760 B13R1.6 N#CCOCCc1cccc(n1)Cl c2476c00cf9f0dec5d7b460adb83b822 [0,2,0,0,0,0|1,0,1]=4 10761 B13R1.6 NOCCNCc1cc(ccn1)Br 4b9198bf935d99804d62134ffce50046 [0,2,0,0,0,0|2,0,0]=4 10762 B13R1.6 NOCCNCc1cc(ccn1)Cl 09531ca02b5abd0c42c6eb41099ef082 [0,2,0,0,0,0|2,0,0]=4 10763 B13R1.6 NOCCNCc1cccc(n1)Br 4e217e9d95f248d56776b54c0c702608 [0,2,0,0,0,0|2,0,0]=4 10764 B13R1.6 NOCCNCc1cccc(n1)Cl 1ccb0e858fd2dc22c929c5056b8d35a8 [0,2,0,0,0,0|2,0,0]=4 10765 B13R1.6 NOCCNCc1cccc(n1)F 1a5e1f47e8207ece3039aa2a45c7b65c [0,2,0,0,0,0|2,0,0]=4 10766 B13R1.6 O=CCCCNc1cc(ccn1)Br 289ec8ebfa41587d9a66ef8d3fedf2fa [0,2,0,0,0,0|1,0,1]=4 10767 B13R1.6 O=CCCCNc1cc(ccn1)Cl 536ce6e0988e8727f1ae00dba41d195a [0,2,0,0,0,0|1,0,1]=4 10768 B13R1.6 O=CCCCNc1cc(ccn1)F 445545fd3eaf0aea243794ac26607bcb [0,2,0,0,0,0|1,0,1]=4 10769 B13R1.6 O=CCCCNc1cc(ccn1)I d603af9d6ba6b9948af366976150ad02 [0,2,0,0,0,0|1,0,1]=4 10770 B13R1.6 O=CCCCNc1cccc(n1)Br 00c1b176ce88a722e4553545917ebad7 [0,2,0,0,0,0|1,0,1]=4 10771 B13R1.6 O=CCCCNc1cccc(n1)Cl 990082835c972f37f3a674f8d32562d4 [0,2,0,0,0,0|1,0,1]=4 10772 B13R1.6 O=CCCCNc1cccc(n1)F 6c057bb806dd3e50840609dc053c0e48 [0,2,0,0,0,0|1,0,1]=4 10773 B13R1.6 O=CCCCNc1cccc(n1)I 396ffb59eb4ff8327b67ad837d908dd3 [0,2,0,0,0,0|1,0,1]=4 10774 B13R1.6 O=CCCCOc1cc(ccn1)Br 23aa440a5e538af9efb7767cb8e898dd [0,2,0,0,0,0|1,0,1]=4 10775 B13R1.6 O=CCCCOc1cc(ccn1)Cl 7d90463dfa8c043b88886d3a5f26d4ed [0,2,0,0,0,0|1,0,1]=4 10776 B13R1.6 O=CCCCOc1cc(ccn1)F ffbb79b00b9cb3f90709cc1dd378f780 [0,2,0,0,0,0|1,0,1]=4 10777 B13R1.6 O=CCCCOc1cccc(n1)Br 4428db45b06764caf5661860e9d9f581 [0,2,0,0,0,0|1,0,1]=4 10778 B13R1.6 O=CCCCOc1cccc(n1)F e083caf4c861f12350d868424b5d1792 [0,2,0,0,0,0|1,0,1]=4 10779 B13R1.6 O=CCCNCc1cc(ccn1)Br 92919a418ed267f0fdc35485e627befb [0,2,0,0,0,0|1,0,1]=4 10780 B13R1.6 O=CCCNCc1cc(ccn1)Cl d16ccd3ebec0deb0a6eee26f78f83e20 [0,2,0,0,0,0|1,0,1]=4 10781 B13R1.6 O=CCCNCc1cccc(n1)Br 9bd2446cbcf2109b6cc33b37f1fc5605 [0,2,0,0,0,0|1,0,1]=4 10782 B13R1.6 O=CCCNCc1cccc(n1)Cl 0f0de64d30a992aa4ffcac6ce7bb4f4e [0,2,0,0,0,0|1,0,1]=4 10783 B13R1.6 O=CCCNCc1cccc(n1)F d28197056f29bdee95f1708bc18f3470 [0,2,0,0,0,0|1,0,1]=4 10784 B13R1.6 O=CCCOCc1cc(ccn1)Br ea183d5897f8ef8389f7da171de3e685 [0,2,0,0,0,0|1,0,1]=4 10785 B13R1.6 O=CCCOCc1cc(ccn1)Cl fe3da6eb39a7336f234f50d05ec1cd97 [0,2,0,0,0,0|1,0,1]=4 10786 B13R1.6 O=CCCOCc1cc(ccn1)F e77a5cd96d60b86c8625c202e6ea1968 [0,2,0,0,0,0|1,0,1]=4 10787 B13R1.6 O=CCCOCc1cc(ccn1)I 47b1f7281b265e7b5cb040fe750dda1c [0,2,0,0,0,0|1,0,1]=4 10788 B13R1.6 O=CCCOCc1cccc(n1)Br 3f3491acdb9d738fa4c6ecb9100b9b73 [0,2,0,0,0,0|1,0,1]=4 10789 B13R1.6 O=CCCOCc1cccc(n1)Cl da13669c1bb0e3a8c923f1fa0bdedfc2 [0,2,0,0,0,0|1,0,1]=4 10790 B13R1.6 O=CCCOCc1cccc(n1)F 7bcbae05ea9b90405c471571084f29c0 [0,2,0,0,0,0|1,0,1]=4 10791 B13R1.6 O=CCCOCc1cccc(n1)I cc7ef3122f601c863d9f16bccbe40167 [0,2,0,0,0,0|1,0,1]=4 10792 B13R1.6 O=CCOCCc1cc(ccn1)Br ed66a26c46b70663c254b383f32f4b97 [0,2,0,0,0,0|1,0,1]=4 10793 B13R1.6 O=CCOCCc1cccc(n1)Br a75657517174c62e2abe8b2de00743d5 [0,2,0,0,0,0|1,0,1]=4 10794 B13R1.6 O=CCOCCc1cccc(n1)Cl 6854cae182552c8454b40da9c8dfaa3a [0,2,0,0,0,0|1,0,1]=4 10795 B13R1.6 O=c1cccc([nH]1)NCCCCCl 16d7528bb9cb3e31a321632081da4dce [0,2,0,0,0,0|1,0,1]=4 10796 B13R1.6 O=c1cccc([nH]1)NCCCCO afef49aa78f93c7af4dd22579c5a95ff [0,2,0,0,0,0|1,0,1]=4 10797 B13R1.6 O=c1cccc([nH]1)NCCCCS 94079f6b682a11e7e2e1de19b668ff2d [0,2,0,0,0,0|1,0,1]=4 10798 B13R1.6 O=c1cccc([nH]1)OCCCCF e59c698a0ad7c7329b64dbaac60a06bc [0,2,0,0,0,0|1,0,1]=4 10799 B13R1.6 O=c1ccnc([nH]1)NCCCCF 692c87b98c8ff1de90e5ab8c0e68a947 [0,2,0,0,0,0|2,0,0]=4 10800 B13R1.6 O=c1ccnc([nH]1)NCCCCO 0803d55450c06cb4bae2200386042b74 [0,2,0,0,0,0|2,0,0]=4 10801 B13R1.6 O=c1nc(cc[nH]1)CNCCCF bb99bc67ef214310a46322aed022b35a [0,2,0,0,0,0|2,0,0]=4 10802 B13R1.6 O=c1nc(cc[nH]1)CNCCCO 381dabdf8faeea45321d1dc69c2fb099 [0,2,0,0,0,0|2,0,0]=4 10803 B13R1.6 O=c1nc(cc[nH]1)CNCCCS 2de9451ba43f0d2365b002bbfffe8e6a [0,2,0,0,0,0|2,0,0]=4 10804 B13R1.6 O=c1nc(cc[nH]1)NCCCCCl 4509e5abcc2bcbfcddd3e3eb6fbbe01a [0,2,0,0,0,0|2,0,0]=4 10805 B13R1.6 O=c1nc(cc[nH]1)NCCCCF 30cc2104a45f7d9988e6ee85b78f8d9f [0,2,0,0,0,0|2,0,0]=4 10806 B13R1.6 O=c1nc(cc[nH]1)NCCCCO ddebf3b409cf5e77ce2d35c5e9abe7de [0,2,0,0,0,0|2,0,0]=4 10807 B13R1.6 OCCCCNc1cc(ccn1)Br 8d19aa83f313e7e4fbc3d0e37d8618e7 [0,2,0,0,0,0|1,0,0]=3 10808 B13R1.6 OCCCCNc1cc(ccn1)Cl 0286cca477503be369ed6caae941e644 [0,2,0,0,0,0|1,0,0]=3 10809 B13R1.6 OCCCCNc1cc(ccn1)F a6b3a19fb2269d0350795f6c1ee2cb42 [0,2,0,0,0,0|1,0,0]=3 10810 B13R1.6 OCCCCNc1cc(ccn1)I e4de94017da3401f693e8e2174c9f068 [0,2,0,0,0,0|1,0,0]=3 10811 B13R1.6 OCCCCNc1cc(ccn1)O 299a1e900708116666bb4c49517fe691 [0,2,0,0,0,0|1,0,0]=3 10812 B13R1.6 OCCCCNc1cc(cnn1)Br ff3086aa2289d4c5df68a9a4e95bc505 [0,2,0,0,0,0|2,0,0]=4 10813 B13R1.6 OCCCCNc1cc(cnn1)Cl fa21e8389c9d055ba0d6ca7bc43b5650 [0,2,0,0,0,0|2,0,0]=4 10814 B13R1.6 OCCCCNc1cc(ncn1)Br eafa099bef49f8c9ddada918891c4c6b [0,2,0,0,0,0|2,0,0]=4 10815 B13R1.6 OCCCCNc1cc(ncn1)Cl c08f70e9652fe63a4ef610b5846edf92 [0,2,0,0,0,0|2,0,0]=4 10816 B13R1.6 OCCCCNc1cc(ncn1)F 1597f2ecfd8d8e41e3a8874eeb5a43cb [0,2,0,0,0,0|2,0,0]=4 10817 B13R1.6 OCCCCNc1cc(ncn1)I a71fbdaff70e3ff406f163da71f48522 [0,2,0,0,0,0|2,0,0]=4 10818 B13R1.6 OCCCCNc1cccc(c1)Br 43a0c54276da63426845fe412b7c0c06 [0,2,0,0,0,0|2,0,0]=4 10819 B13R1.6 OCCCCNc1cccc(c1)Cl 9eae0d3857f77697ff642ddc6338af5d [0,2,0,0,0,0|2,0,0]=4 10820 B13R1.6 OCCCCNc1cccc(c1)F 750a1d4f4519c7c9b4648a7d3bfec90a [0,2,0,0,0,0|2,0,0]=4 10821 B13R1.6 OCCCCNc1cccc(c1)I e3bce01c07f360503395bf3ac9998ee9 [0,2,0,0,0,0|2,0,0]=4 10822 B13R1.6 OCCCCNc1cccc(c1)O ebdb8487d208d6210957d8383af05aa2 [0,2,0,0,0,0|2,0,0]=4 10823 B13R1.6 OCCCCNc1cccc(c1)S a9faf216e6bb62ef32780c7bca18c1f0 [0,2,0,0,0,0|2,0,0]=4 10824 B13R1.6 OCCCCNc1cccc(n1)Br f8e05d7d0159efce80e66820eab4f797 [0,2,0,0,0,0|1,0,0]=3 10825 B13R1.6 OCCCCNc1cccc(n1)Cl 9cda911dc2f8d50689c9d2d2deba1ba5 [0,2,0,0,0,0|1,0,0]=3 10826 B13R1.6 OCCCCNc1cccc(n1)F eb41e44649938f9c8691a50705818f64 [0,2,0,0,0,0|1,0,0]=3 10827 B13R1.6 OCCCCNc1cccc(n1)I 1feba91bf37aed20b22bee96ca3fa63b [0,2,0,0,0,0|1,0,0]=3 10828 B13R1.6 OCCCCNc1ccnc(n1)Br f273b85e9a3fb6d7273c1395fa7599d5 [0,2,0,0,0,0|2,0,0]=4 10829 B13R1.6 OCCCCNc1ccnc(n1)Cl e5fb497e7531bf358cb9f7030ed75566 [0,2,0,0,0,0|2,0,0]=4 10830 B13R1.6 OCCCCNc1ccnc(n1)F 0cca0fe3f94eeea152f77114d5ca059f [0,2,0,0,0,0|2,0,0]=4 10831 B13R1.6 OCCCCNc1ccnc(n1)S b7b1cf15ebcde0b65be6baededba31bc [0,2,0,0,0,0|2,0,0]=4 10832 B13R1.6 OCCCCNc1cncc(n1)Br 77263d75b093102c3a2d6d01b40a22cf [0,2,0,0,0,0|2,0,0]=4 10833 B13R1.6 OCCCCNc1cncc(n1)Cl c72c268bcd8ee738c94c3278aa8b3eca [0,2,0,0,0,0|2,0,0]=4 10834 B13R1.6 OCCCCNc1cncc(n1)F 41c1b630175878c65e1059a2addf4dda [0,2,0,0,0,0|2,0,0]=4 10835 B13R1.6 OCCCCNc1nccc(n1)Br d51b0bcc0675cc930472f3f524973a1d [0,2,0,0,0,0|2,0,0]=4 10836 B13R1.6 OCCCCNc1nccc(n1)Cl 37e4fef9a398088994b6aad3d7ee3942 [0,2,0,0,0,0|2,0,0]=4 10837 B13R1.6 OCCCCNc1nccc(n1)F 413e3bcbbb6b65d9397ee320f5a992e2 [0,2,0,0,0,0|2,0,0]=4 10838 B13R1.6 OCCCCNc1nccc(n1)I d67158536c05f2ea951496d1145816a1 [0,2,0,0,0,0|2,0,0]=4 10839 B13R1.6 OCCCCNc1nccc(n1)S 30f28aa7db90592bced14c4ec9cb3a24 [0,2,0,0,0,0|2,0,0]=4 10840 B13R1.6 OCCCNCc1cc(ccn1)Br e0ef22585994678d2ac64a8c7808a82b [0,2,0,0,0,0|1,0,0]=3 10841 B13R1.6 OCCCNCc1cc(ccn1)Cl c01e69fead9fd08823dea04014592fe3 [0,2,0,0,0,0|1,0,0]=3 10842 B13R1.6 OCCCNCc1cccc(c1)Br c97b780093acc226c0310bc8cca33f97 [0,2,0,0,0,0|2,0,0]=4 10843 B13R1.6 OCCCNCc1cccc(c1)Cl 747816f95c135c172dee22fd4f953ac1 [0,2,0,0,0,0|2,0,0]=4 10844 B13R1.6 OCCCNCc1cccc(c1)F 1432658ffe5cfdcaebd74a1e582d3586 [0,2,0,0,0,0|2,0,0]=4 10845 B13R1.6 OCCCNCc1cccc(c1)I d9aae1de430091f8ed5039c2c72c7b6b [0,2,0,0,0,0|2,0,0]=4 10846 B13R1.6 OCCCNCc1cccc(n1)Br 401965c08dbaeb42784269a5274234ba [0,2,0,0,0,0|1,0,0]=3 10847 B13R1.6 OCCCNCc1cccc(n1)Cl f073c2fe85277b2c5a17d6f6f78e6231 [0,2,0,0,0,0|1,0,0]=3 10848 B13R1.6 OCCCNCc1cccc(n1)F bd22b343d20d7cdb1988db2c2c8764b5 [0,2,0,0,0,0|1,0,0]=3 10849 B13R1.6 OCCCNCc1ccnc(n1)Cl ca88145e03d9c1a45351a2e0ab4d59d5 [0,2,0,0,0,0|2,0,0]=4 10850 B13R1.6 OCCCNCc1cncc(n1)Cl aa739a0c18cd353e7da14af006627cc6 [0,2,0,0,0,0|2,0,0]=4 10851 B13R1.6 OCCCNCc1nccc(n1)Cl f91ce5f46819314b2ae814b197ae6aef [0,2,0,0,0,0|2,0,0]=4 10852 B13R1.6 OCCNCCc1cccc(c1)Br 39ad271be67b5e5ef235e15531216a1d [0,2,0,0,0,0|2,0,0]=4 10853 B13R1.6 OCCNCCc1cccc(c1)Cl e42c56f334ee50097b7f87a1e25adeb1 [0,2,0,0,0,0|2,0,0]=4 10854 B13R1.6 OCCNCCc1cccc(c1)F c034c838d4afa193d7d14d129c2dedd0 [0,2,0,0,0,0|2,0,0]=4 10855 B13R1.6 OCCNCCc1cccc(c1)I 95f6eba7b38abd748103d56cc81a7d75 [0,2,0,0,0,0|2,0,0]=4 10856 B13R1.6 OCCNCCc1cncc(n1)Cl 251e4872816030cad41d7c1b56b133f0 [0,2,0,0,0,0|2,0,0]=4 10857 B13R1.6 OCNCCCc1cccc(c1)Br 65c800fe3f3601a57b1dd736d280abb3 [0,2,0,0,0,0|2,0,0]=4 10858 B13R1.6 OCNCCCc1cccc(c1)Cl 510db3c0b9f5643b96262273e8869157 [0,2,0,0,0,0|2,0,0]=4 10859 B13R1.6 OCNCCCc1cccc(c1)F 9fae77799843fa3ab7952462f90386e5 [0,2,0,0,0,0|2,0,0]=4 10860 B13R1.6 Oc1cccc(c1)NCCCCCl f30cce8b74a44dd25db1bd7006515807 [0,2,0,0,0,0|2,0,0]=4 10861 B13R1.6 Oc1cccc(c1)NCCCCS d4948a9d0a47178281b2a2f4879e61bd [0,2,0,0,0,0|2,0,0]=4 10862 B13R1.6 Oc1ccnc(c1)NCCCCCl b9e88847301e0f7f65e9eeb8f7ff1735 [0,2,0,0,0,0|1,0,0]=3 10863 B13R1.6 SCCCCNc1cccc(c1)S 3fc143d6a3d625376febefef22527299 [0,2,0,0,0,0|2,0,0]=4 10864 B13R1.6 SCCCNCc1cc(ccn1)Br 64ab0545b0199c4596d6c62b750858fb [0,2,0,0,0,0|1,0,0]=3 10865 B13R1.6 SCCCNCc1cc(ccn1)Cl 74dc4b3bd6a36efd24f28b348ab285a0 [0,2,0,0,0,0|1,0,0]=3 10866 B13R1.6 SCCCNCc1cccc(c1)Br e1afa7ddc52147ca120fbd5d0ca71367 [0,2,0,0,0,0|2,0,0]=4 10867 B13R1.6 SCCCNCc1cccc(c1)Cl 1b2119823ee62273cdd382a55a379d02 [0,2,0,0,0,0|2,0,0]=4 10868 B13R1.6 SCCCNCc1cccc(c1)I f1b571a8ea38142804fd81a09926ec08 [0,2,0,0,0,0|2,0,0]=4 10869 B13R1.6 SCCCNCc1cccc(n1)Br cbf3727dcc880e1eea1811e58939eb89 [0,2,0,0,0,0|1,0,0]=3 10870 B13R1.6 SCCCNCc1cccc(n1)Cl 0f6be5b3949f314d0217d32bde225791 [0,2,0,0,0,0|1,0,0]=3 10871 B13R1.6 SCCCNCc1cncc(n1)Cl 0ea435b486161effc6aec75ae4d1a2fb [0,2,0,0,0,0|2,0,0]=4 10872 B13R1.6 SCCCNCc1nccc(n1)Cl 55a10bccbf6af73c6f648b9db0980024 [0,2,0,0,0,0|2,0,0]=4 10873 B13R1.6 SCCCOCc1cc(ccn1)Br b5c14c0174eec65a3ac784c396cb5c53 [0,2,0,0,0,0|1,0,0]=3 10874 B13R1.6 SCCCOCc1cc(ccn1)Cl cc6b0a039381c3c16688640bfd2434b8 [0,2,0,0,0,0|1,0,0]=3 10875 B13R1.6 SCCCOCc1cc(ccn1)I 3763e873c802b0d30baf5d3618d5b4ce [0,2,0,0,0,0|1,0,0]=3 10876 B13R1.6 SCCCOCc1cc(ncn1)Cl 091b19f9ea812e38884cbaf053ae0f73 [0,2,0,0,0,0|2,0,0]=4 10877 B13R1.6 SCCCOCc1cccc(c1)Br 02c0ef1429fe59aabcd0892b7eb28934 [0,2,0,0,0,0|2,0,0]=4 10878 B13R1.6 SCCCOCc1cccc(c1)Cl 0ce861e3682ee44d47545ed2b6785aed [0,2,0,0,0,0|2,0,0]=4 10879 B13R1.6 SCCCOCc1cccc(c1)I 29ac10321721caef9199b52991a15969 [0,2,0,0,0,0|2,0,0]=4 10880 B13R1.6 SCCCOCc1cccc(n1)Br e252bc4ff45c068ac41ab8dbefdeb0f2 [0,2,0,0,0,0|1,0,0]=3 10881 B13R1.6 SCCCOCc1cccc(n1)Cl 0aab8e38370361dac592752c94404046 [0,2,0,0,0,0|1,0,0]=3 10882 B13R1.6 SCCCOCc1cccc(n1)I 7dee4268de430c69cda017bff52b444a [0,2,0,0,0,0|1,0,0]=3 10883 B13R1.6 SCCCOCc1ccnc(n1)Cl 7c03ed5b61a9e59971055c42baf82d81 [0,2,0,0,0,0|2,0,0]=4 10884 B13R1.6 SCCCOCc1cncc(n1)Br d3388b9f27af027a38d8acb94b6de766 [0,2,0,0,0,0|2,0,0]=4 10885 B13R1.6 SCCCOCc1cncc(n1)Cl ef22d1e7960552eaf166de1e421f15f5 [0,2,0,0,0,0|2,0,0]=4 10886 B13R1.6 SCCCOCc1nccc(n1)Cl a661dafc8bfbedba0d82ad52f13be2a2 [0,2,0,0,0,0|2,0,0]=4 10887 B13R1.6 SCCNCCc1cccc(c1)Br f2dacb94426ed9c8c877b914d3e34479 [0,2,0,0,0,0|2,0,0]=4 10888 B13R1.6 SCCNCCc1cccc(c1)Cl 6b5e028f2bc224c65d3eccc5b29be0bf [0,2,0,0,0,0|2,0,0]=4 10889 B13R1.6 SCCNCCc1cccc(c1)I 3b44b4875777a5e9f870ec57d0c546b2 [0,2,0,0,0,0|2,0,0]=4 10890 B13R1.6 SCCNCCc1cncc(n1)Cl 18e42eae27c35d7c6d51dad54bc58083 [0,2,0,0,0,0|2,0,0]=4 10891 B13R1.6 SCCOCCc1cc(ccn1)Br ce2bd3bf34aa5b435cf4b14670b0933c [0,2,0,0,0,0|1,0,0]=3 10892 B13R1.6 SCCOCCc1cccc(c1)Br 84d5b5bcac19e79a553a5c352c937d35 [0,2,0,0,0,0|2,0,0]=4 10893 B13R1.6 SCCOCCc1cccc(c1)Cl a0d4ed60f158204a69f88423d271248b [0,2,0,0,0,0|2,0,0]=4 10894 B13R1.6 SCCOCCc1cccc(c1)I 97adc476452804140082e6f292cc4e7c [0,2,0,0,0,0|2,0,0]=4 10895 B13R1.6 SCCOCCc1cccc(n1)Br 2217663d919c221c77b4d191080bf4a5 [0,2,0,0,0,0|1,0,0]=3 10896 B13R1.6 SCCOCCc1cccc(n1)Cl 1e44f68c67967db4175a7b404bbd3c35 [0,2,0,0,0,0|1,0,0]=3 10897 B13R1.6 SCCOCCc1cncc(n1)Cl 5f2e1502ab7e79c3410dd5bae95637d6 [0,2,0,0,0,0|2,0,0]=4 10898 B13R1.6 Sc1cccc(c1)NCCCCCl 2019436268024a179c968c48f3540a25 [0,2,0,0,0,0|2,0,0]=4 10899 B13R1.6 [O-][n+]1ccnc(c1)NCCCCCl 1d01e041a91decbfbbcc0dcc76d2ea16 [0,2,0,0,0,0|2,0,0]=4 10900 B13R1.6 [O-][n+]1ccnc(c1)NCCCCO 545f12262bea64b091740d52820277eb [0,2,0,0,0,0|2,0,0]=4 10901 B13R1.24 C#CCCCN(C)c1ccccn1 468f0c43b8df41a11ff0fc6f70ed08b6 [0,2,0,0,0,0|0,0,2]=4 10902 B13R1.24 C#CCCNC(C)c1ccccn1 948f2d925e4eb2fe62fe83d5901dad07 [0,2,0,0,0,0|0,0,2]=4 10903 B13R1.24 C#CCCN[C@@H](C)c1ccccn1 715f0cd9cdd04f51b08141c678f71efe [0,2,0,0,0,0|0,0,2]=4 10904 B13R1.24 C#CCCN[C@H](C)c1ccccn1 97d314e6cf7f80651acf9de1ba66fcf3 [0,2,0,0,0,0|0,0,2]=4 10905 B13R1.24 C#CCCOC(C)c1ccccn1 044f51cef42dc7968e3d6e8b4dbfaf70 [0,2,0,0,0,0|0,0,2]=4 10906 B13R1.24 C#CCCO[C@@H](C)c1ccccn1 bf18c209b91d577fbc4c461a7d15cb5e [0,2,0,0,0,0|0,0,2]=4 10907 B13R1.24 C#CCCO[C@H](C)c1ccccn1 65f6b0b71f1a7892175d7f691d005d02 [0,2,0,0,0,0|0,0,2]=4 10908 B13R1.24 C#CCNCC(O)c1ccccn1 e92a2e6f7daeaf0a2d9c8f373fc6f518 [0,2,0,0,0,0|0,0,2]=4 10909 B13R1.24 C#CCOCC(C)c1ccccn1 487a99941bde0293a598abf2f914b3c4 [0,2,0,0,0,0|0,0,2]=4 10910 B13R1.24 C/C=C/CNC(C)c1ccccn1 ac158c38e420f76db87b3e50b987a6c9 [0,2,0,0,0,0|0,0,2]=4 10911 B13R1.24 C/C=C/CN[C@@H](C)c1ccccn1 4b7edf914cc70eea3425c497d5eab764 [0,2,0,0,0,0|0,0,2]=4 10912 B13R1.24 C/C=C/CN[C@H](C)c1ccccn1 f896aa629f1da27005b7282b8c85b672 [0,2,0,0,0,0|0,0,2]=4 10913 B13R1.24 C/C=C/COC(C)c1ccccn1 7f286497ef38dac605cec730a6b166a5 [0,2,0,0,0,0|0,0,2]=4 10914 B13R1.24 C/C=C/CO[C@@H](C)c1ccccn1 07a034b1c891ec6ac3854b862d953b42 [0,2,0,0,0,0|0,0,2]=4 10915 B13R1.24 C/C=C/CO[C@H](C)c1ccccn1 7e25c1dec3d50ff75d7556ffba0cc6f0 [0,2,0,0,0,0|0,0,2]=4 10916 B13R1.24 C/C=C\CNC(C)c1ccccn1 5538a46f30b17ad9dc3591002a2ce537 [0,2,0,0,0,0|0,0,2]=4 10917 B13R1.24 C/C=C\CN[C@@H](C)c1ccccn1 5f6b50289168fca7032093c32fe89baa [0,2,0,0,0,0|0,0,2]=4 10918 B13R1.24 C/C=C\CN[C@H](C)c1ccccn1 650a69252ea74199c5d897934477f5a2 [0,2,0,0,0,0|0,0,2]=4 10919 B13R1.24 C/C=C\COC(C)c1ccccn1 040614284c554e839ef2e02fdd6290bd [0,2,0,0,0,0|0,0,2]=4 10920 B13R1.24 C/C=C\CO[C@@H](C)c1ccccn1 94ef4ac1d155529281ec8bec1d73a53e [0,2,0,0,0,0|0,0,2]=4 10921 B13R1.24 C/C=C\CO[C@H](C)c1ccccn1 ab26f281a9897b8049f41e9c56a1a6a0 [0,2,0,0,0,0|0,0,2]=4 10922 B13R1.24 C=C(COCCC)c1ccccc1 f6317ef758d7b96aae38d82e773caa14 [0,2,0,0,0,0|1,0,1]=4 10923 B13R1.24 C=C(COCCC)c1ccccn1 bfdfd1ee190e6966d7dbccec91461a97 [0,2,0,0,0,0|0,0,1]=3 10924 B13R1.24 C=C(COCCF)c1ccccn1 1f7143dbc36836e76056bc6f0c407b58 [0,2,0,0,0,0|1,0,1]=4 10925 B13R1.24 C=C(COCCS)c1ccccn1 ba885817ed9e4a2b7ba4dd273a640327 [0,2,0,0,0,0|1,0,1]=4 10926 B13R1.24 C=C(COCOC)c1ccccn1 9a20df7742c1a9fb7fa90411cf0168ae [0,2,0,0,0,0|1,0,1]=4 10927 B13R1.24 C=C(COCSC)c1ccccn1 4eb4f4ee5d1a9c85aa5f5ed70330464d [0,2,0,0,0,0|1,0,1]=4 10928 B13R1.24 C=CCCCN(C)c1ccccn1 b0ba65cc7946c7b0e8f2e2b72de4b325 [0,2,0,0,0,0|0,0,2]=4 10929 B13R1.24 C=CCCNC(C)c1ccccn1 58870c47055f008ad60eef0220fe559b [0,2,0,0,0,0|0,0,2]=4 10930 B13R1.24 C=CCCN[C@@H](C)c1ccccn1 ecc013654cf1d63881bc73d9f0f293f0 [0,2,0,0,0,0|0,0,2]=4 10931 B13R1.24 C=CCCN[C@H](C)c1ccccn1 8e1d852ee37c700ed72a7fcc5515bc0f [0,2,0,0,0,0|0,0,2]=4 10932 B13R1.24 C=CCCOC(C)c1ccccn1 66a70d5e967894a608d51e8d0ec5245b [0,2,0,0,0,0|0,0,2]=4 10933 B13R1.24 C=CCCO[C@@H](C)c1ccccn1 881180a9cf782372a9775413cf74643d [0,2,0,0,0,0|0,0,2]=4 10934 B13R1.24 C=CCCO[C@H](C)c1ccccn1 474895e3c5d52bec8199edb43963bb31 [0,2,0,0,0,0|0,0,2]=4 10935 B13R1.24 C=CCNCC(O)c1ccccn1 04313befd453dc9db997611255aaca32 [0,2,0,0,0,0|0,0,2]=4 10936 B13R1.24 C=CCOCC(C)c1ccccn1 a5d1523fc7b9b71371f4b402564646ac [0,2,0,0,0,0|0,0,2]=4 10937 B13R1.24 CC(CCNCF)c1ccccc1 fef1ceee9259ccf71249843206209877 [0,2,0,0,0,0|2,0,0]=4 10938 B13R1.24 CC(CCNCO)c1ccccc1 6549339f4bb56a47530b12d8fc8cdbeb [0,2,0,0,0,0|2,0,0]=4 10939 B13R1.24 CC(CCOCF)c1ccccc1 fd8805e16f192de1276032dc5e4ca55c [0,2,0,0,0,0|2,0,0]=4 10940 B13R1.24 CC(CNCCBr)c1ccccc1 bf40bf3fe2d21f3c581769dcee162cd2 [0,2,0,0,0,0|2,0,0]=4 10941 B13R1.24 CC(CNCCF)c1ccccc1 7e6fcac42049d640d2996b526815a648 [0,2,0,0,0,0|2,0,0]=4 10942 B13R1.24 CC(CNCCI)c1ccccc1 809c8b497618c97249044faebb603602 [0,2,0,0,0,0|2,0,0]=4 10943 B13R1.24 CC(CNCCO)c1ccccc1 94b2c9ef07b25f704078b27481cae9d7 [0,2,0,0,0,0|2,0,0]=4 10944 B13R1.24 CC(CNCCS)c1ccccc1 694eb601575463f3d630b1250827a8a6 [0,2,0,0,0,0|2,0,0]=4 10945 B13R1.24 CC(COCC#N)c1ccccn1 72a0033b0c9b8b472d0cf31a542fcfbf [0,2,0,0,0,0|1,0,1]=4 10946 B13R1.24 CC(COCC=O)c1ccccn1 628672b2467761bb28aa11d54dc655be [0,2,0,0,0,0|1,0,1]=4 10947 B13R1.24 CC(COCCF)c1ccccc1 1ab6a9ce76fa1cad22f6bf56ebd4b522 [0,2,0,0,0,0|2,0,0]=4 10948 B13R1.24 CC(COCCF)c1ccccn1 797c284c92861b6f267bd25bb29d9495 [0,2,0,0,0,0|1,0,0]=3 10949 B13R1.24 CC(COCCS)c1ccccc1 1808903fda9d3732ab2bd3008964cbd2 [0,2,0,0,0,0|2,0,0]=4 10950 B13R1.24 CC(COCCS)c1ccccn1 57c2d7b6d58cd1ea76a797e299418aff [0,2,0,0,0,0|1,0,0]=3 10951 B13R1.24 CC(NCCC#N)c1ccccn1 6e88d2599b54af278851c46f8f8e88bf [0,2,0,0,0,0|1,0,1]=4 10952 B13R1.24 CC(NCCC=O)c1ccccn1 6dc3efb43ae0bdfd5bf7b2272deb12ff [0,2,0,0,0,0|1,0,1]=4 10953 B13R1.24 CC(NCCCF)c1ccccc1 707b70202f4f1ba3be1fdfcd2fa2e408 [0,2,0,0,0,0|2,0,0]=4 10954 B13R1.24 CC(NCCCF)c1ccccn1 a2dc0b0d2ac2189d42c40167f2d19138 [0,2,0,0,0,0|1,0,0]=3 10955 B13R1.24 CC(NCCCF)c1cccnn1 eec116e1d28d7779c2e0c7f6b3e1e7e7 [0,2,0,0,0,0|2,0,0]=4 10956 B13R1.24 CC(NCCCF)c1ccncn1 689240ec6e03f7e3fb9fb0f43d4a4f6e [0,2,0,0,0,0|2,0,0]=4 10957 B13R1.24 CC(NCCCF)c1cnccn1 c056a1ba7e94572641ff03d7cbf0f2af [0,2,0,0,0,0|2,0,0]=4 10958 B13R1.24 CC(NCCCF)c1ncccn1 9a8cc38d4de6c8f218a95fedc21706c0 [0,2,0,0,0,0|2,0,0]=4 10959 B13R1.24 CC(NCCCO)c1ccccn1 df4131688276c2f75e671aad9d7e97d1 [0,2,0,0,0,0|1,0,0]=3 10960 B13R1.24 CC(NCCCO)c1cccnn1 cf95c82bee6a8d7f23089c5d8246a5a7 [0,2,0,0,0,0|2,0,0]=4 10961 B13R1.24 CC(NCCCO)c1ccncn1 aaa4f19524aedac6dd86af6ec2b7e0db [0,2,0,0,0,0|2,0,0]=4 10962 B13R1.24 CC(NCCCO)c1cnccn1 76716568ae8eced38c41016490964532 [0,2,0,0,0,0|2,0,0]=4 10963 B13R1.24 CC(NCCCO)c1ncccn1 1e71e9fabef6d37af42edc0df73a38eb [0,2,0,0,0,0|2,0,0]=4 10964 B13R1.24 CC(NCCCS)c1ccccc1 02945c5dc66ab962443151909d7d4e83 [0,2,0,0,0,0|2,0,0]=4 10965 B13R1.24 CC(NCCCS)c1ccccn1 88bb78e1eea0ce4f4a9cd3878064040d [0,2,0,0,0,0|1,0,0]=3 10966 B13R1.24 CC(NCCCS)c1cccnn1 a0f891f67da0a43c77c2424005c7edd2 [0,2,0,0,0,0|2,0,0]=4 10967 B13R1.24 CC(NCCCS)c1ccncn1 e06e612711f13d38db529253c34e4e32 [0,2,0,0,0,0|2,0,0]=4 10968 B13R1.24 CC(NCCCS)c1cnccn1 1b4f4943d5e3e8eb92efb55bc82d7bda [0,2,0,0,0,0|2,0,0]=4 10969 B13R1.24 CC(NCCCS)c1ncccn1 50e5058b80936fd1e79a72a0695d18b1 [0,2,0,0,0,0|2,0,0]=4 10970 B13R1.24 CC(OCCC#N)c1ccccn1 632c161035fd7e810049c466cba6abcd [0,2,0,0,0,0|1,0,1]=4 10971 B13R1.24 CC(OCCC=O)c1ccccn1 8db7f5aef3e16540e1c8f58d6161e578 [0,2,0,0,0,0|1,0,1]=4 10972 B13R1.24 CC(OCCCF)c1ccccc1 da6636e75ac33040de8989875fad3e1e [0,2,0,0,0,0|2,0,0]=4 10973 B13R1.24 CC(OCCCF)c1ccccn1 abde4a2ec164c87d22469903e6a03606 [0,2,0,0,0,0|1,0,0]=3 10974 B13R1.24 CC(OCCCF)c1cccnn1 670214ec39ca3de0acc0738d5f136d33 [0,2,0,0,0,0|2,0,0]=4 10975 B13R1.24 CC(OCCCF)c1cnccn1 39295311cfbdefcd18f288dc6652e732 [0,2,0,0,0,0|2,0,0]=4 10976 B13R1.24 CC(OCCCF)c1ncccn1 63856686e664e1880e33c2185874c04d [0,2,0,0,0,0|2,0,0]=4 10977 B13R1.24 CC(OCCCS)c1ccccc1 73d023d8f78e1d608d7c4c459a4426b8 [0,2,0,0,0,0|2,0,0]=4 10978 B13R1.24 CC(OCCCS)c1ccccn1 930b74ff36abc49aaf80b0f3785dac25 [0,2,0,0,0,0|1,0,0]=3 10979 B13R1.24 CC(OCCCS)c1cccnn1 d1f3f2a0b7b180607d9639fd9b4c9593 [0,2,0,0,0,0|2,0,0]=4 10980 B13R1.24 CC(OCCCS)c1cnccn1 bee9042fae28768e8a893b4b66dd8629 [0,2,0,0,0,0|2,0,0]=4 10981 B13R1.24 CC(OCCCS)c1ncccn1 0973e89d79ea79531205ddf17d8d7661 [0,2,0,0,0,0|2,0,0]=4 10982 B13R1.24 CC/C=C/CN(C)c1ccccn1 169ed7d8e5ffeb5661dc0a8de7f73b64 [0,2,0,0,0,0|0,0,2]=4 10983 B13R1.24 CC=CCNC(C)c1ccccn1 8145935cf1c5764346ce38ce7daae298 [0,2,0,0,0,0|0,0,2]=4 10984 B13R1.24 CCCCCN(C)c1ccccc1 8e838ed249d36a49c1970673664302dd [0,2,0,0,0,0|1,0,0]=3 10985 B13R1.24 CCCCCN(C)c1cccnc1 52aa3b2b426ab5dc59b65dd5a6c8ddc9 [0,2,0,0,0,0|2,0,0]=4 10986 B13R1.24 CCCCCN(C)c1ccncn1 308c24350d145208f400d5dfcd68ee09 [0,2,0,0,0,0|1,0,0]=3 10987 B13R1.24 CCCCCN(C)c1cnccn1 17c03f229444d5ee542f5c70d1c9a218 [0,2,0,0,0,0|1,0,0]=3 10988 B13R1.24 CCCCCN(C)c1ncccn1 70458288997868cd265a2d950ba7b2e0 [0,2,0,0,0,0|1,0,0]=3 10989 B13R1.24 CCCCCN(C)c1nccnn1 52935200fa1fb49fb07b542682ea700b [0,2,0,0,0,0|2,0,0]=4 10990 B13R1.24 CCCCNC(=O)c1ccccc1 99aac20acff97b38b71835a38991434c [0,2,0,0,0,0|1,0,1]=4 10991 B13R1.24 CCCCNC(=O)c1ccccn1 e2650feea24ca80c17dfb4597476b32e [0,2,0,0,0,0|0,0,1]=3 10992 B13R1.24 CCCCNC(=O)c1cccnn1 20671d13c38b461d166b4b3c5601571a [0,2,0,0,0,0|1,0,1]=4 10993 B13R1.24 CCCCNC(=O)c1ccncn1 9a6afe219495ce65351c2778efb405e6 [0,2,0,0,0,0|1,0,1]=4 10994 B13R1.24 CCCCNC(=O)c1cnccn1 2554572218c7a866fd282cf109509ed2 [0,2,0,0,0,0|1,0,1]=4 10995 B13R1.24 CCCCNC(=O)c1ncccn1 035039239778cd88b8992366b1f44283 [0,2,0,0,0,0|1,0,1]=4 10996 B13R1.24 CCCCNC(C)c1ccccc1 ba9da65c92ba7fc468e0c4b78ba99ccc [0,2,0,0,0,0|1,0,0]=3 10997 B13R1.24 CCCCNC(C)c1ccccn1 fe9f05efea480959840e0a18da829fca [0,2,0,0,0,0|0,0,0]=2 10998 B13R1.24 CCCCNC(C)c1cccnc1 218a75e39d96e89f8d1190f7477f1e65 [0,2,0,0,0,0|2,0,0]=4 10999 B13R1.24 CCCCNC(C)c1cccnn1 16b9bc3074194826ee94caedb106a8ab [0,2,0,0,0,0|1,0,0]=3 11000 B13R1.24 CCCCNC(C)c1ccncc1 a987aa7ed549bd67f361f35be6248d4e [0,2,0,0,0,0|2,0,0]=4 11001 B13R1.24 CCCCNC(C)c1ccncn1 f301c10c6915572c86e8b2db1a6aa77c [0,2,0,0,0,0|1,0,0]=3 11002 B13R1.24 CCCCNC(C)c1cnccn1 2dfe831bf264fa1369356dce2e5282c6 [0,2,0,0,0,0|1,0,0]=3 11003 B13R1.24 CCCCNC(C)c1ncccn1 20a7efddfa771bf3c27a062ad6fb98b7 [0,2,0,0,0,0|1,0,0]=3 11004 B13R1.24 CCCCN[C@@H](C)c1ccccc1 57b5e3ebff75ef31a64a222a6226a276 [0,2,0,0,0,0|1,0,0]=3 11005 B13R1.24 CCCCN[C@@H](C)c1ccccn1 343d6d4660d110198c1e6ec2467188d4 [0,2,0,0,0,0|0,0,0]=2 11006 B13R1.24 CCCCN[C@@H](C)c1cccnc1 bef95405f01950ed3999d608bbd1b879 [0,2,0,0,0,0|2,0,0]=4 11007 B13R1.24 CCCCN[C@@H](C)c1ccncc1 53d89e44c13639334e18617b81e2a1c4 [0,2,0,0,0,0|2,0,0]=4 11008 B13R1.24 CCCCN[C@H](C)c1ccccc1 24dfb549a40c55400336ed3b2bc45c90 [0,2,0,0,0,0|1,0,0]=3 11009 B13R1.24 CCCCN[C@H](C)c1ccccn1 bb7b8fb961b98d4b1b6e53dbc5602bc9 [0,2,0,0,0,0|0,0,0]=2 11010 B13R1.24 CCCCN[C@H](C)c1cccnc1 fdb6dec34bc839f674b6daf22caa8500 [0,2,0,0,0,0|2,0,0]=4 11011 B13R1.24 CCCCN[C@H](C)c1ccncc1 dad4e335f88fc5755efbc336a3a131cd [0,2,0,0,0,0|2,0,0]=4 11012 B13R1.24 CCCCOC(C)c1ccccc1 116618646832f472e55dfbe2113618bc [0,2,0,0,0,0|1,0,0]=3 11013 B13R1.24 CCCCOC(C)c1ccccn1 d8d8b1fdb7e1679deff0be9f2bd1add7 [0,2,0,0,0,0|0,0,0]=2 11014 B13R1.24 CCCCOC(C)c1cccnc1 d8d90c22c3ac47c5d360edf0db3a22b7 [0,2,0,0,0,0|2,0,0]=4 11015 B13R1.24 CCCCOC(C)c1cccnn1 ca91491639a13f47b8fca766039ce642 [0,2,0,0,0,0|1,0,0]=3 11016 B13R1.24 CCCCOC(C)c1ccncc1 af66dccbcb79f0de6dd1cbff2bc9aad3 [0,2,0,0,0,0|2,0,0]=4 11017 B13R1.24 CCCCOC(C)c1cnccn1 394a1f6a461a6721b255a63f81db7885 [0,2,0,0,0,0|1,0,0]=3 11018 B13R1.24 CCCCOC(C)c1ncccn1 703b984c89a7ee0df28a9228270c0517 [0,2,0,0,0,0|1,0,0]=3 11019 B13R1.24 CCCCO[C@@H](C)c1ccccc1 93a610cc42c8d64b3ebf86e26c026ac9 [0,2,0,0,0,0|1,0,0]=3 11020 B13R1.24 CCCCO[C@@H](C)c1ccccn1 106781f495bc53bb4686d7b599400a73 [0,2,0,0,0,0|0,0,0]=2 11021 B13R1.24 CCCCO[C@@H](C)c1cccnc1 c5babf5ce2d39050f077b08eebdf6564 [0,2,0,0,0,0|2,0,0]=4 11022 B13R1.24 CCCCO[C@@H](C)c1ccncc1 60f517e41e44a93a4ad6cb2cf0c3e50e [0,2,0,0,0,0|2,0,0]=4 11023 B13R1.24 CCCCO[C@@H](C)c1ccncn1 5c98c39c16308f9f613d6da5a12af7f0 [0,2,0,0,0,0|1,0,0]=3 11024 B13R1.24 CCCCO[C@@H](C)c1cnccn1 3095911778fa74cea85b18de33475463 [0,2,0,0,0,0|1,0,0]=3 11025 B13R1.24 CCCCO[C@@H](C)c1ncccn1 101982d8d8d752ec358001057e21e2da [0,2,0,0,0,0|1,0,0]=3 11026 B13R1.24 CCCCO[C@H](C)c1ccccc1 11ad6d63bfec5cb3281b9eb95b5e04f0 [0,2,0,0,0,0|1,0,0]=3 11027 B13R1.24 CCCCO[C@H](C)c1ccccn1 f68f52c8b361bf4c92ec03a37fb11380 [0,2,0,0,0,0|0,0,0]=2 11028 B13R1.24 CCCCO[C@H](C)c1cccnc1 4b0959b6d4020e1c900887a52003f1b4 [0,2,0,0,0,0|2,0,0]=4 11029 B13R1.24 CCCCO[C@H](C)c1cccnn1 f8d8cc1f76e2b5691b0b936174989a2a [0,2,0,0,0,0|1,0,0]=3 11030 B13R1.24 CCCCO[C@H](C)c1ccncc1 fb806943dc0c52c04200eff617e0bc47 [0,2,0,0,0,0|2,0,0]=4 11031 B13R1.24 CCCCO[C@H](C)c1cnccn1 98fe9b97a488f3670cc4877942f30711 [0,2,0,0,0,0|1,0,0]=3 11032 B13R1.24 CCCCO[C@H](C)c1ncccn1 f003d48afa7b66cabf42ae7e091e91f1 [0,2,0,0,0,0|1,0,0]=3 11033 B13R1.24 CCCNCC(=O)c1ccccc1 48fbf30db6382cb4b2aad3c23f152050 [0,2,0,0,0,0|1,0,1]=4 11034 B13R1.24 CCCNCC(=O)c1ccccn1 b5b83294351e5de62eefe79416e3decf [0,2,0,0,0,0|0,0,1]=3 11035 B13R1.24 CCCNCC(=O)c1ccncn1 760e3c4767ba235c27685866e304f057 [0,2,0,0,0,0|1,0,1]=4 11036 B13R1.24 CCCNCC(=O)c1cnccn1 3af6040d822d2ce5966f2093ed8607fb [0,2,0,0,0,0|1,0,1]=4 11037 B13R1.24 CCCNCC(C)c1ccccc1 5b9cbaa046214e464daaab40bbcd3312 [0,2,0,0,0,0|1,0,0]=3 11038 B13R1.24 CCCNCC(F)c1ccccc1 449b2015434bbd5b2836355939132d1a [0,2,0,0,0,0|1,0,0]=3 11039 B13R1.24 CCCNCC(O)c1ccccc1 d38eaae1b19c710adc21500685b8cd9a [0,2,0,0,0,0|1,0,0]=3 11040 B13R1.24 CCCNCC(O)c1ccccn1 19ce185a02a8a1325d6c69f94c6b75db [0,2,0,0,0,0|0,0,0]=2 11041 B13R1.24 CCCNCC(O)c1cccnc1 ae0ac118e936f7cb2d5ebc8e1d7b2bec [0,2,0,0,0,0|2,0,0]=4 11042 B13R1.24 CCCNCC(O)c1ccncc1 77561eb712726d224e80da4ffd36fa24 [0,2,0,0,0,0|2,0,0]=4 11043 B13R1.24 CCCNCC(O)c1cnccn1 2245b16fc74ac1755a819bd9ad1557b8 [0,2,0,0,0,0|1,0,0]=3 11044 B13R1.24 CCCNC[C@@H](C)c1ccccc1 2308071747b02f56b924597b3ca017fa [0,2,0,0,0,0|1,0,0]=3 11045 B13R1.24 CCCNC[C@@H](O)c1ccccc1 ba1c94e938904bb5f8f256428bfd49c0 [0,2,0,0,0,0|1,0,0]=3 11046 B13R1.24 CCCNC[C@H](C)c1ccccc1 a93645e2df2d6a08f03c1dad967aea05 [0,2,0,0,0,0|1,0,0]=3 11047 B13R1.24 CCCNC[C@H](O)c1ccccc1 100bd33b1479296525e93adedc4476d6 [0,2,0,0,0,0|1,0,0]=3 11048 B13R1.24 CCCOCC(=O)c1ccccc1 fafbf9582888297afc92283765371327 [0,2,0,0,0,0|1,0,1]=4 11049 B13R1.24 CCCOCC(=O)c1ccccn1 1744139d5574e9d85a93e82b301f11fe [0,2,0,0,0,0|0,0,1]=3 11050 B13R1.24 CCCOCC(=O)c1ccncn1 28befb1769f78a529845c220137c2161 [0,2,0,0,0,0|1,0,1]=4 11051 B13R1.24 CCCOCC(=O)c1cnccn1 f1664dd670cfb982a517863580aa8e1f [0,2,0,0,0,0|1,0,1]=4 11052 B13R1.24 CCCOCC(C)c1ccccc1 e679fb9dffb2d4c68eea61790de794fe [0,2,0,0,0,0|1,0,0]=3 11053 B13R1.24 CCCOCC(C)c1ccccn1 d456deae7ee7987a382d758efb120969 [0,2,0,0,0,0|0,0,0]=2 11054 B13R1.24 CCCOC[C@@H](C)c1ccccc1 8177c97a0f970e08f4bd9fbe91982acc [0,2,0,0,0,0|1,0,0]=3 11055 B13R1.24 CCCOC[C@H](C)c1ccccc1 5d43a358407c1950ccdd8a99e845d676 [0,2,0,0,0,0|1,0,0]=3 11056 B13R1.24 CCNCCC(C)c1ccccc1 ed81c2bb78ca6182229e1ff90805d458 [0,2,0,0,0,0|1,0,0]=3 11057 B13R1.24 CCNCCC(O)c1ccccc1 999492f51f98f44134773ecaec349081 [0,2,0,0,0,0|1,0,0]=3 11058 B13R1.24 CCNCCC(O)c1cccnc1 2cca1f060ce30db7229b77502867d80b [0,2,0,0,0,0|2,0,0]=4 11059 B13R1.24 CCNCCN(C)c1ccccc1 30082bd21898abd739be951c6494ea16 [0,2,0,0,0,0|2,0,0]=4 11060 B13R1.24 CCNCC[C@@H](O)c1ccccc1 eea91830cc140499ddf8fc516d41f951 [0,2,0,0,0,0|1,0,0]=3 11061 B13R1.24 CCNCC[C@H](O)c1ccccc1 2589a73e054dbd92a4efc9e5ec82be1a [0,2,0,0,0,0|1,0,0]=3 11062 B13R1.24 CCOC/C=C(\C)/c1ccccn1 806dd9a3ee56b91dd701860c06a1204a [0,2,0,0,0,0|0,0,2]=4 11063 B13R1.24 CCOCCC(=O)c1ccccc1 a6e0d6be21888dbba948192f59c92561 [0,2,0,0,0,0|1,0,1]=4 11064 B13R1.24 CCOCCC(C)c1ccccc1 b507e430268e133923b92502bce58be6 [0,2,0,0,0,0|1,0,0]=3 11065 B13R1.24 CCOCCC(C)c1ccncc1 4d51165735351000599d14d80cdb0774 [0,2,0,0,0,0|2,0,0]=4 11066 B13R1.24 CCOCCN(C)c1ccccc1 0a1308e941e0232d05dad64ad4cdf881 [0,2,0,0,0,0|2,0,0]=4 11067 B13R1.24 CCOCCN(C)c1ccccn1 62fe74caea52536d43b53daca899c46a [0,2,0,0,0,0|1,0,0]=3 11068 B13R1.24 CCOCCN(C)c1cccnn1 e5b1132eefd1451aba31e80c0801891d [0,2,0,0,0,0|2,0,0]=4 11069 B13R1.24 CCOCCN(C)c1ccncn1 406326f1f6943a29c314d854434b3f81 [0,2,0,0,0,0|2,0,0]=4 11070 B13R1.24 CCOCCN(C)c1cnccn1 8ec655c90b913b7b7f43880bef9aeb2e [0,2,0,0,0,0|2,0,0]=4 11071 B13R1.24 CCOCCN(C)c1ncccn1 a19a158dcc48bc5b24828081736022c4 [0,2,0,0,0,0|2,0,0]=4 11072 B13R1.24 CCOCCS(=O)c1ccccc1 9a9b7f91a079702892d7981c8f731eba [0,2,0,0,0,0|2,0,0]=4 11073 B13R1.24 CCOCNC(C)c1ccccc1 43e854261718f26338edd1c9cfe9440f [0,2,0,0,0,0|2,0,0]=4 11074 B13R1.24 CCOCNC(C)c1ccccn1 3a9912118c892a00a5eba2b4623083e5 [0,2,0,0,0,0|1,0,0]=3 11075 B13R1.24 CCOCNC(C)c1cccnn1 1617cdab3e8afa9004abff48bd5ddf22 [0,2,0,0,0,0|2,0,0]=4 11076 B13R1.24 CCOCNC(C)c1ccncn1 67c03027d2aa0d04310e73ac6c37647f [0,2,0,0,0,0|2,0,0]=4 11077 B13R1.24 CCOCNC(C)c1cnccn1 ede070c249e0d6643484445e10e75dde [0,2,0,0,0,0|2,0,0]=4 11078 B13R1.24 CCOCNC(C)c1ncccn1 5769cdf3bf89cc3096356c04d3f7d969 [0,2,0,0,0,0|2,0,0]=4 11079 B13R1.24 CCOCN[C@@H](C)c1ccccc1 d8445fce5d6253e8f5271c53876afd8e [0,2,0,0,0,0|2,0,0]=4 11080 B13R1.24 CCOCN[C@@H](C)c1ccccn1 425811c54bbcbfdf975ecb74c2e54efe [0,2,0,0,0,0|1,0,0]=3 11081 B13R1.24 CCOCN[C@H](C)c1ccccc1 b7dc7113b2b5bcd070a69ab867786a69 [0,2,0,0,0,0|2,0,0]=4 11082 B13R1.24 CCOCN[C@H](C)c1ccccn1 db7be33844b87c2d531b868115e59eb3 [0,2,0,0,0,0|1,0,0]=3 11083 B13R1.24 CCOCOC(C)c1ncccn1 3cba28beaaa7daa861521ba88082d0ca [0,2,0,0,0,0|2,0,0]=4 11084 B13R1.24 CCOCO[C@@H](C)c1ncccn1 5ecb52a9b47624e68131d816f71e70b6 [0,2,0,0,0,0|2,0,0]=4 11085 B13R1.24 CCOCO[C@H](C)c1ncccn1 09b856e42a376b28a9f75348f7e8b0e5 [0,2,0,0,0,0|2,0,0]=4 11086 B13R1.24 CCSCCN(C)c1ccccc1 b7c1c42a1a90a76678554e8a18cc2f8f [0,2,0,0,0,0|2,0,0]=4 11087 B13R1.24 CCSCCN(C)c1ccccn1 1581912385bd5f083808e5d7c0a7a1df [0,2,0,0,0,0|1,0,0]=3 11088 B13R1.24 CCSCCN(C)c1cccnn1 e28c93d2ac36850496fab62efe6b052e [0,2,0,0,0,0|2,0,0]=4 11089 B13R1.24 CCSCCN(C)c1ccncn1 bc37db163838df844e97fc410f5bc6ce [0,2,0,0,0,0|2,0,0]=4 11090 B13R1.24 CCSCCN(C)c1cnccn1 2bab4204ed80e25f42969620e98238ae [0,2,0,0,0,0|2,0,0]=4 11091 B13R1.24 CCSCCN(C)c1ncccn1 57d1af3bcac333f56ac86bf0e3f08971 [0,2,0,0,0,0|2,0,0]=4 11092 B13R1.24 CN(CCCC#N)c1ccccn1 b55533c11e5db93c0af8be594e38266d [0,2,0,0,0,0|1,0,1]=4 11093 B13R1.24 CN(CCCC=O)c1ccccn1 6959844fb035fb6ec99b70de7d020739 [0,2,0,0,0,0|1,0,1]=4 11094 B13R1.24 CN(CCCCF)c1ccccn1 e16b7f51883dcf69846005a50404263e [0,2,0,0,0,0|1,0,0]=3 11095 B13R1.24 CN(CCCCF)c1cccnn1 8f74467cc900e27296cc154a6db109a6 [0,2,0,0,0,0|2,0,0]=4 11096 B13R1.24 CN(CCCCF)c1ccncn1 147373337eba7ca4be0c30289e4ddef8 [0,2,0,0,0,0|2,0,0]=4 11097 B13R1.24 CN(CCCCF)c1cnccn1 6e216a2567be12b74ddae39638b227c1 [0,2,0,0,0,0|2,0,0]=4 11098 B13R1.24 CN(CCCCF)c1ncccn1 935f65372f7c4014ded0c9acd41f9594 [0,2,0,0,0,0|2,0,0]=4 11099 B13R1.24 CN(CCCCO)c1ccccc1 b512e8c8c040f0a54f14a1fff20a083f [0,2,0,0,0,0|2,0,0]=4 11100 B13R1.24 CN(CCCCO)c1ccccn1 bd4d7f4ff3fb3235d21376815715bc0b [0,2,0,0,0,0|1,0,0]=3 11101 B13R1.24 CN(CCCCO)c1cccnn1 0a99c62eef35df10a1e5c0eeda58e83d [0,2,0,0,0,0|2,0,0]=4 11102 B13R1.24 CN(CCCCO)c1ccncn1 5879f1e399ccd8f01388d1d1989ca35a [0,2,0,0,0,0|2,0,0]=4 11103 B13R1.24 CN(CCCCO)c1cnccn1 3760ac3404272c6589fefac6f569c78f [0,2,0,0,0,0|2,0,0]=4 11104 B13R1.24 CN(CCCCO)c1ncccn1 301eff783e42a8416116d6895006bf1b [0,2,0,0,0,0|2,0,0]=4 11105 B13R1.24 CN(CCOCF)c1ccccn1 fd94b9e544b5b9e495f9e26ad5430afc [0,2,0,0,0,0|2,0,0]=4 11106 B13R1.24 COCCCN(C)c1ccccc1 5f73e2a28bb1582889cb04a4d73a5118 [0,2,0,0,0,0|2,0,0]=4 11107 B13R1.24 COCCCN(C)c1ccccn1 02c52057613ee970f776176d69de2ade [0,2,0,0,0,0|1,0,0]=3 11108 B13R1.24 COCCCN(C)c1cccnn1 191edda093cfa3e774e87faf29952d17 [0,2,0,0,0,0|2,0,0]=4 11109 B13R1.24 COCCCN(C)c1ccncn1 b96db69f5c2e9e976d17cbc09d63d15a [0,2,0,0,0,0|2,0,0]=4 11110 B13R1.24 COCCCN(C)c1cnccn1 1122cb42103d0663f43c42cd3efe6fa1 [0,2,0,0,0,0|2,0,0]=4 11111 B13R1.24 COCCCN(C)c1ncccn1 5ca8c9f1d81fada5af7f1641c21dc4c2 [0,2,0,0,0,0|2,0,0]=4 11112 B13R1.24 COCCNC(=O)c1ccccn1 71dce32a99bc1ed7bfc479a764a118c0 [0,2,0,0,0,0|1,0,1]=4 11113 B13R1.24 COCCNC(C)c1ccccc1 c2cdf9a7d68c2b14dbc1f47818328785 [0,2,0,0,0,0|2,0,0]=4 11114 B13R1.24 COCCNC(C)c1ccccn1 574a24ce8dde27b25d774210684eeded [0,2,0,0,0,0|1,0,0]=3 11115 B13R1.24 COCCNC(C)c1cccnn1 78d63ff9bd46d250a7830373fc2b7dc1 [0,2,0,0,0,0|2,0,0]=4 11116 B13R1.24 COCCNC(C)c1ccncn1 b2f32c55d220bea440c2c3445425491c [0,2,0,0,0,0|2,0,0]=4 11117 B13R1.24 COCCNC(C)c1cnccn1 563965d5f8245f96d79ee3593449a545 [0,2,0,0,0,0|2,0,0]=4 11118 B13R1.24 COCCNC(C)c1ncccn1 382a432afac07e8bf62d7bf635e31869 [0,2,0,0,0,0|2,0,0]=4 11119 B13R1.24 COCCN[C@@H](C)c1ccccc1 3d6e84133668a2c88f91040a51faba59 [0,2,0,0,0,0|2,0,0]=4 11120 B13R1.24 COCCN[C@@H](C)c1ccccn1 ee7130bec814657c9b8074162c57457f [0,2,0,0,0,0|1,0,0]=3 11121 B13R1.24 COCCN[C@H](C)c1ccccc1 070b4ca2a1a16c22225dae328c415de7 [0,2,0,0,0,0|2,0,0]=4 11122 B13R1.24 COCCN[C@H](C)c1ccccn1 f499221d9894d80316d7cbfabf7c68dc [0,2,0,0,0,0|1,0,0]=3 11123 B13R1.24 COCCOC(C)c1ccccc1 4eda4eb3d7f458c7b1efd0302710d954 [0,2,0,0,0,0|2,0,0]=4 11124 B13R1.24 COCCOC(C)c1ccccn1 fe3e606a6befde9299ade7792122176f [0,2,0,0,0,0|1,0,0]=3 11125 B13R1.24 COCCOC(C)c1cccnn1 27fad64f802366a0bc00e37580b5848e [0,2,0,0,0,0|2,0,0]=4 11126 B13R1.24 COCCOC(C)c1cnccn1 ba692e07242a3af05a4291fba51c1757 [0,2,0,0,0,0|2,0,0]=4 11127 B13R1.24 COCCOC(C)c1ncccn1 20dffadf77aecf0e10e0939c02d0252b [0,2,0,0,0,0|2,0,0]=4 11128 B13R1.24 COCCO[C@@H](C)c1ccccc1 c4708c03f597f180562f17c23f61a0f0 [0,2,0,0,0,0|2,0,0]=4 11129 B13R1.24 COCCO[C@@H](C)c1ccccn1 417864c41f496f2b73bc3a620c435875 [0,2,0,0,0,0|1,0,0]=3 11130 B13R1.24 COCCO[C@@H](C)c1ccncn1 a466fa8e74a9dd449f560ed05b6dbb65 [0,2,0,0,0,0|2,0,0]=4 11131 B13R1.24 COCCO[C@@H](C)c1cnccn1 c89977e363b3f0b7ce7d21c6d1d32f9d [0,2,0,0,0,0|2,0,0]=4 11132 B13R1.24 COCCO[C@@H](C)c1ncccn1 dcdc2f0ca036207f69e05d9496d05d47 [0,2,0,0,0,0|2,0,0]=4 11133 B13R1.24 COCCO[C@H](C)c1ccccc1 dc187aa1e60f01c074c0643788e8e1ed [0,2,0,0,0,0|2,0,0]=4 11134 B13R1.24 COCCO[C@H](C)c1ccccn1 10f781b6ba68b87d15e9f423515f4ed1 [0,2,0,0,0,0|1,0,0]=3 11135 B13R1.24 COCCO[C@H](C)c1cccnn1 1029811167ff581f704d56506ebf9bc3 [0,2,0,0,0,0|2,0,0]=4 11136 B13R1.24 COCCO[C@H](C)c1cnccn1 ebd5770b60efaba9a82dab2c9b1375d0 [0,2,0,0,0,0|2,0,0]=4 11137 B13R1.24 COCCO[C@H](C)c1ncccn1 27f9b1831b0eb366a07b7a136d66a0ae [0,2,0,0,0,0|2,0,0]=4 11138 B13R1.24 COCNCC(C)c1ccccc1 95f492c76836eaa0617bd64a5dd74814 [0,2,0,0,0,0|2,0,0]=4 11139 B13R1.24 COCNCC(O)c1ccccc1 065ed39397a57935c54004af38914e1d [0,2,0,0,0,0|2,0,0]=4 11140 B13R1.24 COCNCC(O)c1ccccn1 53699900c4bcbbd4d02bb059350fe079 [0,2,0,0,0,0|1,0,0]=3 11141 B13R1.24 COCNC[C@@H](C)c1ccccc1 f06f2951cb91325b7937fd46428e92ba [0,2,0,0,0,0|2,0,0]=4 11142 B13R1.24 COCNC[C@@H](O)c1ccccc1 99f245690db50bc87571291f7a525272 [0,2,0,0,0,0|2,0,0]=4 11143 B13R1.24 COCNC[C@H](C)c1ccccc1 57285bc15af07ec43285adc3d53c41c6 [0,2,0,0,0,0|2,0,0]=4 11144 B13R1.24 COCNC[C@H](O)c1ccccc1 f07ee66c3ed1bc3a22b8d380d72f19ab [0,2,0,0,0,0|2,0,0]=4 11145 B13R1.24 COCOCC(=O)c1ccccn1 7d5f1cae4c0969f0d18d551fa0f6c85b [0,2,0,0,0,0|1,0,1]=4 11146 B13R1.24 COCOCC(C)c1ccccc1 b89f330fdbdc63ded1d3a8e48f1cbf65 [0,2,0,0,0,0|2,0,0]=4 11147 B13R1.24 COCOCC(C)c1ccccn1 809820534266686938b8daa409d730dc [0,2,0,0,0,0|1,0,0]=3 11148 B13R1.24 COCOCC(F)c1ccccc1 e92835afffb5bb59ac2f640e4fa48f68 [0,2,0,0,0,0|2,0,0]=4 11149 B13R1.24 COCOC[C@@H](C)c1ccccc1 97c6c6d972d0281fe50c3b5bd45d4f4f [0,2,0,0,0,0|2,0,0]=4 11150 B13R1.24 COCOC[C@H](C)c1ccccc1 5223a540f9e7b2df0773863ef787a5b3 [0,2,0,0,0,0|2,0,0]=4 11151 B13R1.24 CSCCCN(C)c1ccccc1 70a4ea61a5f22a45c1f81f730e05ad5f [0,2,0,0,0,0|2,0,0]=4 11152 B13R1.24 CSCCCN(C)c1ccccn1 c56eecce5bb4ee9e793c5f8db55932eb [0,2,0,0,0,0|1,0,0]=3 11153 B13R1.24 CSCCCN(C)c1cccnn1 19a63ed48765959d124329424f9dea64 [0,2,0,0,0,0|2,0,0]=4 11154 B13R1.24 CSCCCN(C)c1ccncn1 2834d46e5592ecc072d78fbb19476a2e [0,2,0,0,0,0|2,0,0]=4 11155 B13R1.24 CSCCCN(C)c1cnccn1 380a58801cf137cbf41a50891fb265c0 [0,2,0,0,0,0|2,0,0]=4 11156 B13R1.24 CSCCCN(C)c1ncccn1 60774c6b802749a62c9c7dcfe5221978 [0,2,0,0,0,0|2,0,0]=4 11157 B13R1.24 CSCCNC(=O)c1ccccn1 664d6a119038593884e34213a1f20c6d [0,2,0,0,0,0|1,0,1]=4 11158 B13R1.24 CSCCNC(C)c1ccccc1 cb2710bbb1863e422cacbcdfa29043b3 [0,2,0,0,0,0|2,0,0]=4 11159 B13R1.24 CSCCNC(C)c1ccccn1 224e2c4d238573b052bbd9cc367f49cc [0,2,0,0,0,0|1,0,0]=3 11160 B13R1.24 CSCCNC(C)c1cccnn1 7d83cf888710e2a86cf77b3743e64d76 [0,2,0,0,0,0|2,0,0]=4 11161 B13R1.24 CSCCNC(C)c1ccncn1 7fceecb0296ef20ed4fccf5242f81a3d [0,2,0,0,0,0|2,0,0]=4 11162 B13R1.24 CSCCNC(C)c1cnccn1 8c32b43d6abb4d62ea78af7411fabfdb [0,2,0,0,0,0|2,0,0]=4 11163 B13R1.24 CSCCNC(C)c1ncccn1 eb15f703eb73b2729fa737d0039eda83 [0,2,0,0,0,0|2,0,0]=4 11164 B13R1.24 CSCCN[C@@H](C)c1ccccc1 e1d4d63ca98297e3a741380b222379e5 [0,2,0,0,0,0|2,0,0]=4 11165 B13R1.24 CSCCN[C@@H](C)c1ccccn1 2c8afee548643b1924ccabdc1cb3be06 [0,2,0,0,0,0|1,0,0]=3 11166 B13R1.24 CSCCN[C@H](C)c1ccccc1 e79e5bfe51901f7fde96679e7cad33c7 [0,2,0,0,0,0|2,0,0]=4 11167 B13R1.24 CSCCN[C@H](C)c1ccccn1 6d9241e0dcccd30e84980d526480d77f [0,2,0,0,0,0|1,0,0]=3 11168 B13R1.24 CSCCOC(C)c1ccccc1 6e6c64ccd8ec19b44304bbd6ee665b03 [0,2,0,0,0,0|2,0,0]=4 11169 B13R1.24 CSCCOC(C)c1ccccn1 11287f48f8f73b8962000d0f8cf0f85a [0,2,0,0,0,0|1,0,0]=3 11170 B13R1.24 CSCCOC(C)c1cccnn1 4fb3586c4390e3d1017402e169ae0e66 [0,2,0,0,0,0|2,0,0]=4 11171 B13R1.24 CSCCOC(C)c1cnccn1 c8a883faee83e9294937d7cf0ce5cf17 [0,2,0,0,0,0|2,0,0]=4 11172 B13R1.24 CSCCOC(C)c1ncccn1 a34a2e6005bf3d9d5f30e093e4a88d2c [0,2,0,0,0,0|2,0,0]=4 11173 B13R1.24 CSCCO[C@@H](C)c1ccccc1 e19c25ae9a5b36339342948c99b13ae5 [0,2,0,0,0,0|2,0,0]=4 11174 B13R1.24 CSCCO[C@@H](C)c1ccccn1 94448e3d365603dabccf356746f6b2af [0,2,0,0,0,0|1,0,0]=3 11175 B13R1.24 CSCCO[C@@H](C)c1ccncn1 bd3c566a54c01ffec2d95b0e003930cf [0,2,0,0,0,0|2,0,0]=4 11176 B13R1.24 CSCCO[C@@H](C)c1cnccn1 b6f8e8b9e7c9c51ecbcdc40393367b79 [0,2,0,0,0,0|2,0,0]=4 11177 B13R1.24 CSCCO[C@@H](C)c1ncccn1 1ce6674c2229f15cf92c4de4e9d33dfd [0,2,0,0,0,0|2,0,0]=4 11178 B13R1.24 CSCCO[C@H](C)c1ccccc1 e2b65e08fdc1fe59baafd7046d39c4fe [0,2,0,0,0,0|2,0,0]=4 11179 B13R1.24 CSCCO[C@H](C)c1ccccn1 aa75f45c45b2bda0e0c44f44ef59e643 [0,2,0,0,0,0|1,0,0]=3 11180 B13R1.24 CSCCO[C@H](C)c1cccnn1 60d50c7232dd9e67d38c7f75de2e23ff [0,2,0,0,0,0|2,0,0]=4 11181 B13R1.24 CSCCO[C@H](C)c1cnccn1 3b18ac464e063f6fcdc1ddb8fd5c62e4 [0,2,0,0,0,0|2,0,0]=4 11182 B13R1.24 CSCCO[C@H](C)c1ncccn1 7545f4b8b60ecafa81d756b63ee32366 [0,2,0,0,0,0|2,0,0]=4 11183 B13R1.24 CSCNCC(C)c1ccccc1 4da0913a5f64e9ade826a166fcb72b53 [0,2,0,0,0,0|2,0,0]=4 11184 B13R1.24 CSCNCC(O)c1ccccc1 510d27c64a6763f59907d1415781445d [0,2,0,0,0,0|2,0,0]=4 11185 B13R1.24 CSCNCC(O)c1ccccn1 cbb54c8782818d3408ea5b286563266b [0,2,0,0,0,0|1,0,0]=3 11186 B13R1.24 CSCNC[C@@H](C)c1ccccc1 05f8b44eb8a446121092cb42bb6734aa [0,2,0,0,0,0|2,0,0]=4 11187 B13R1.24 CSCNC[C@@H](O)c1ccccc1 846e48584412a12fbb2838d0dab12dc8 [0,2,0,0,0,0|2,0,0]=4 11188 B13R1.24 CSCNC[C@H](C)c1ccccc1 38fa65b867b355fb7275143eaef46ee6 [0,2,0,0,0,0|2,0,0]=4 11189 B13R1.24 CSCNC[C@H](O)c1ccccc1 610ded1cda0391fbd3f816ce595d11db [0,2,0,0,0,0|2,0,0]=4 11190 B13R1.24 CSCOCC(=O)c1ccccn1 2f0413109a6a6e3989881c54c0a0664a [0,2,0,0,0,0|1,0,1]=4 11191 B13R1.24 CSCOCC(C)c1ccccc1 759be960294ea2ad3e1e233b92abf2b0 [0,2,0,0,0,0|2,0,0]=4 11192 B13R1.24 CSCOCC(C)c1ccccn1 edf49eeed71b861ebb44097e0f58aaa9 [0,2,0,0,0,0|1,0,0]=3 11193 B13R1.24 CSCOC[C@@H](C)c1ccccc1 38c84389657e8fa2bd056ac05830df0d [0,2,0,0,0,0|2,0,0]=4 11194 B13R1.24 CSCOC[C@H](C)c1ccccc1 e0f68a34045a419aa415aa6e1684f0f3 [0,2,0,0,0,0|2,0,0]=4 11195 B13R1.24 C[C@@H](CNCCF)c1ccccc1 f80f5e9c9fa4d04cbb54f3fb3e6f7bb6 [0,2,0,0,0,0|2,0,0]=4 11196 B13R1.24 C[C@@H](CNCCO)c1ccccc1 1f27c1e40a5781f555c0013d3f72bc8c [0,2,0,0,0,0|2,0,0]=4 11197 B13R1.24 C[C@@H](CNCCS)c1ccccc1 841a623e2b9fa226364a37948b51e918 [0,2,0,0,0,0|2,0,0]=4 11198 B13R1.24 C[C@@H](COCCF)c1ccccc1 a49d81364485c0b294bc87d646fe9316 [0,2,0,0,0,0|2,0,0]=4 11199 B13R1.24 C[C@@H](COCCS)c1ccccc1 22329a7e54796f077ab8eacc889089b0 [0,2,0,0,0,0|2,0,0]=4 11200 B13R1.24 C[C@@H](NCCC#N)c1ccccn1 c28b1d8e4707f1ace11b9082e1fb1dd9 [0,2,0,0,0,0|1,0,1]=4 11201 B13R1.24 C[C@@H](NCCC=O)c1ccccn1 159a899fa11e268e235e3b427ba81df8 [0,2,0,0,0,0|1,0,1]=4 11202 B13R1.24 C[C@@H](NCCCF)c1ccccc1 bfa543be3f68166fe2f57a5689bb07e6 [0,2,0,0,0,0|2,0,0]=4 11203 B13R1.24 C[C@@H](NCCCF)c1ccccn1 f214bee7fe48feb7f1032b442233c2bf [0,2,0,0,0,0|1,0,0]=3 11204 B13R1.24 C[C@@H](NCCCO)c1ccccn1 6d2e38a0f70c8089959e42d127994c72 [0,2,0,0,0,0|1,0,0]=3 11205 B13R1.24 C[C@@H](NCCCS)c1ccccc1 0116293cdbc170d5d0b056ff05b140c5 [0,2,0,0,0,0|2,0,0]=4 11206 B13R1.24 C[C@@H](NCCCS)c1ccccn1 4cc5e438bc9470eab63476dab3be0627 [0,2,0,0,0,0|1,0,0]=3 11207 B13R1.24 C[C@@H](OCCC#N)c1ccccn1 260cf308969eda7252b6518db007bf5b [0,2,0,0,0,0|1,0,1]=4 11208 B13R1.24 C[C@@H](OCCC=O)c1ccccn1 2221b39a8290dc8dcd65e4014c02205b [0,2,0,0,0,0|1,0,1]=4 11209 B13R1.24 C[C@@H](OCCCF)c1ccccc1 3b543601bb26cccb69be38b500af6085 [0,2,0,0,0,0|2,0,0]=4 11210 B13R1.24 C[C@@H](OCCCF)c1ccccn1 b7e512babf3da018d24b856ad321a86e [0,2,0,0,0,0|1,0,0]=3 11211 B13R1.24 C[C@@H](OCCCF)c1cccnn1 43fe2cbe8c9435d0dd26f2149c16d880 [0,2,0,0,0,0|2,0,0]=4 11212 B13R1.24 C[C@@H](OCCCF)c1cnccn1 a7d1470ed1c7e7a2f86ba5aac8ced55d [0,2,0,0,0,0|2,0,0]=4 11213 B13R1.24 C[C@@H](OCCCF)c1ncccn1 2b2cd7a234e2780eb8500b41bf78abbf [0,2,0,0,0,0|2,0,0]=4 11214 B13R1.24 C[C@@H](OCCCS)c1ccccc1 ae96e9b0fd3eff44194d70b9add97b2f [0,2,0,0,0,0|2,0,0]=4 11215 B13R1.24 C[C@@H](OCCCS)c1ccccn1 bef32a5d9c2c115834993af2e438fea7 [0,2,0,0,0,0|1,0,0]=3 11216 B13R1.24 C[C@@H](OCCCS)c1cccnn1 32e22ecdb72f78ec34dd81b0ca2d65e1 [0,2,0,0,0,0|2,0,0]=4 11217 B13R1.24 C[C@@H](OCCCS)c1cnccn1 5ce24042805040dda9bf1a86172f7d26 [0,2,0,0,0,0|2,0,0]=4 11218 B13R1.24 C[C@@H](OCCCS)c1ncccn1 c6152058b5e068a9dc5ba7e9e1986cea [0,2,0,0,0,0|2,0,0]=4 11219 B13R1.24 C[C@H](CNCCBr)c1ccccc1 94329264b3e0f8607112d3544dc3a4dd [0,2,0,0,0,0|2,0,0]=4 11220 B13R1.24 C[C@H](CNCCF)c1ccccc1 2b984b754dfcda5cb1f2b232f72ccbf4 [0,2,0,0,0,0|2,0,0]=4 11221 B13R1.24 C[C@H](CNCCI)c1ccccc1 35dc7c64f97f43d550f904b1c7152fee [0,2,0,0,0,0|2,0,0]=4 11222 B13R1.24 C[C@H](CNCCO)c1ccccc1 95217ad922337e4b6f106b8b81119245 [0,2,0,0,0,0|2,0,0]=4 11223 B13R1.24 C[C@H](CNCCS)c1ccccc1 c5d3a1119e994926c63b3fd0f972c506 [0,2,0,0,0,0|2,0,0]=4 11224 B13R1.24 C[C@H](COCCF)c1ccccc1 ee713de5248c1ec3caa3d86a122a571c [0,2,0,0,0,0|2,0,0]=4 11225 B13R1.24 C[C@H](COCCS)c1ccccc1 4729a21e047873a2308c5c19507aaf05 [0,2,0,0,0,0|2,0,0]=4 11226 B13R1.24 C[C@H](NCCC#N)c1ccccn1 b2b31a9655647c6d642a1124840e0d30 [0,2,0,0,0,0|1,0,1]=4 11227 B13R1.24 C[C@H](NCCC=O)c1ccccn1 3b34349c425bf94fc3334a843a4b961e [0,2,0,0,0,0|1,0,1]=4 11228 B13R1.24 C[C@H](NCCCF)c1ccccc1 2c3c38f14ff8256234e4e10570b90490 [0,2,0,0,0,0|2,0,0]=4 11229 B13R1.24 C[C@H](NCCCF)c1ccccn1 91eb30146d2ab73a27836b107a6d4dee [0,2,0,0,0,0|1,0,0]=3 11230 B13R1.24 C[C@H](NCCCO)c1ccccn1 436cf65ef0b6ed37b9f230b305194318 [0,2,0,0,0,0|1,0,0]=3 11231 B13R1.24 C[C@H](NCCCS)c1ccccc1 b2a62d10fe03e141185275af72c2be8f [0,2,0,0,0,0|2,0,0]=4 11232 B13R1.24 C[C@H](NCCCS)c1ccccn1 54a18e461c1b8401c601d45b0bbac2f4 [0,2,0,0,0,0|1,0,0]=3 11233 B13R1.24 C[C@H](OCCC#N)c1ccccn1 c506061870840db7b5bace231015b206 [0,2,0,0,0,0|1,0,1]=4 11234 B13R1.24 C[C@H](OCCC=O)c1ccccn1 0116fc2fe38f538252f30479e7e53bb6 [0,2,0,0,0,0|1,0,1]=4 11235 B13R1.24 C[C@H](OCCCF)c1ccccc1 59e3eb993feab5d5c53b054ac83e6316 [0,2,0,0,0,0|2,0,0]=4 11236 B13R1.24 C[C@H](OCCCF)c1ccccn1 47aaa2ff36feca3095901c44dc1489b5 [0,2,0,0,0,0|1,0,0]=3 11237 B13R1.24 C[C@H](OCCCF)c1ccncn1 8fb27cb0ff6443432551aa5efc6d9f6f [0,2,0,0,0,0|2,0,0]=4 11238 B13R1.24 C[C@H](OCCCF)c1cnccn1 9a5cea31dbe968c001935218a92d562a [0,2,0,0,0,0|2,0,0]=4 11239 B13R1.24 C[C@H](OCCCF)c1ncccn1 191984a6aede71162e7347f07d92920e [0,2,0,0,0,0|2,0,0]=4 11240 B13R1.24 C[C@H](OCCCS)c1ccccc1 d75904c4401b78653bc0213f295ecc4d [0,2,0,0,0,0|2,0,0]=4 11241 B13R1.24 C[C@H](OCCCS)c1ccccn1 c258a6b7448b15e1bcd25c465aeafec3 [0,2,0,0,0,0|1,0,0]=3 11242 B13R1.24 C[C@H](OCCCS)c1ccncn1 a0743f88cf6391625fa7eaaa5ce41d97 [0,2,0,0,0,0|2,0,0]=4 11243 B13R1.24 C[C@H](OCCCS)c1cnccn1 28f8ee3692b2f00834adeb03c06b5415 [0,2,0,0,0,0|2,0,0]=4 11244 B13R1.24 C[C@H](OCCCS)c1ncccn1 36b98d135155026d51b67448c3aee6bd [0,2,0,0,0,0|2,0,0]=4 11245 B13R1.24 FC(CNCCBr)c1ccccc1 ffbd02c1ec22ab19b84180ae596b7e25 [0,2,0,0,0,0|2,0,0]=4 11246 B13R1.24 FC(CNCCI)c1ccccc1 e9a2b55380dec5a7dfed2f2b59b84230 [0,2,0,0,0,0|2,0,0]=4 11247 B13R1.24 FC(CNCCS)c1ccccc1 e953c2b26e038196e82835882e1cbb43 [0,2,0,0,0,0|2,0,0]=4 11248 B13R1.24 FC(COCCS)c1ccccc1 5e067201f3480fcba5635d49e9bf1bc3 [0,2,0,0,0,0|2,0,0]=4 11249 B13R1.24 FCCNCC(F)c1ccccc1 cf2604b7778e986fbff9472a0d62c960 [0,2,0,0,0,0|2,0,0]=4 11250 B13R1.24 FCCOCC(F)c1ccccc1 414189d0e8637eccd93c638f64641f00 [0,2,0,0,0,0|2,0,0]=4 11251 B13R1.24 N#CCNCC(O)c1ccccn1 afda99a7baa724a5ee18fd5fe8e2ac00 [0,2,0,0,0,0|1,0,1]=4 11252 B13R1.24 O=C(CNCCBr)c1ccccn1 e0e1b35b315dcde2321e7fc030e26f5e [0,2,0,0,0,0|1,0,1]=4 11253 B13R1.24 O=C(CNCCF)c1ccccn1 3957001fb94a0b57d16e09fd88c05ea3 [0,2,0,0,0,0|1,0,1]=4 11254 B13R1.24 O=C(CNCCI)c1ccccn1 26ab07659f210f89840d59aecac9aad6 [0,2,0,0,0,0|1,0,1]=4 11255 B13R1.24 O=C(CNCCO)c1ccccn1 60855de0200401f14660a6037705cb80 [0,2,0,0,0,0|1,0,1]=4 11256 B13R1.24 O=C(CNCCS)c1ccccn1 cf510bd2c6131c735929a7588c89c504 [0,2,0,0,0,0|1,0,1]=4 11257 B13R1.24 O=C(COCCF)c1ccccn1 eb9e3acd489528842648cd61a8472704 [0,2,0,0,0,0|1,0,1]=4 11258 B13R1.24 O=C(COCCS)c1ccccn1 7842bae49b523e63c9cf780c12435547 [0,2,0,0,0,0|1,0,1]=4 11259 B13R1.24 O=C(NCCCCl)c1ccccn1 7ba68c4976998f1fc38d3d04e9be8231 [0,2,0,0,0,0|1,0,1]=4 11260 B13R1.24 O=C(NCCCO)c1ccccn1 0c4114e0a2b3f9b1513b7dedd480325c [0,2,0,0,0,0|1,0,1]=4 11261 B13R1.24 O=CCNCC(O)c1ccccn1 102c2809f3c2419903c08c8ec26822f6 [0,2,0,0,0,0|1,0,1]=4 11262 B13R1.24 OC(CCNCF)c1ccccc1 a9cd192c8b295cca0aced9b1fbb626a5 [0,2,0,0,0,0|2,0,0]=4 11263 B13R1.24 OC(CNCCBr)c1ccccc1 896601dbc217c1c45c8f685191b44a7f [0,2,0,0,0,0|2,0,0]=4 11264 B13R1.24 OC(CNCCBr)c1cnccn1 7ddb0d4bfabc1329fc88bdaac4d9b19b [0,2,0,0,0,0|2,0,0]=4 11265 B13R1.24 OC(CNCCF)c1ccccc1 31a6285c54121b191791d804c462964b [0,2,0,0,0,0|2,0,0]=4 11266 B13R1.24 OC(CNCCF)c1ccccn1 ef21b6161cf4dccf28de43da46d8c8bc [0,2,0,0,0,0|1,0,0]=3 11267 B13R1.24 OC(CNCCF)c1cnccn1 02bebb39a754115c8ca6fb874b222d15 [0,2,0,0,0,0|2,0,0]=4 11268 B13R1.24 OC(CNCCI)c1ccccc1 09fc842e23ff6591276d0bf34e258b9a [0,2,0,0,0,0|2,0,0]=4 11269 B13R1.24 OC(CNCCI)c1cnccn1 86865f2600ea42fb01cdaced16217ac1 [0,2,0,0,0,0|2,0,0]=4 11270 B13R1.24 OC(CNCCS)c1ccccc1 b1791679d5e010ccd60596c52ed24116 [0,2,0,0,0,0|2,0,0]=4 11271 B13R1.24 OC(CNCCS)c1ccccn1 7e568a4cc675c8a94fc7d3a16df98996 [0,2,0,0,0,0|1,0,0]=3 11272 B13R1.24 OC(CNCCS)c1cnccn1 ccc53129d5a6cea402f7216001fb32b3 [0,2,0,0,0,0|2,0,0]=4 11273 B13R1.24 OCCNCC(F)c1ccccc1 c80ba370153a87927244587c4f7cd93d [0,2,0,0,0,0|2,0,0]=4 11274 B13R1.24 OCCNCC(O)c1ccccc1 acf4a9260f4ea573a1af24dca8fdcfb9 [0,2,0,0,0,0|2,0,0]=4 11275 B13R1.24 OCCNCC(O)c1ccccn1 66101ccb618d3c93993ec8b835d8d2c3 [0,2,0,0,0,0|1,0,0]=3 11276 B13R1.24 OCCNCC(O)c1cnccn1 19b114ded2ee1ac7c8b9d31a7991fff0 [0,2,0,0,0,0|2,0,0]=4 11277 B13R1.24 OCCNC[C@@H](O)c1ccccc1 2db31fd01bec3e4b9cd289e5820eab50 [0,2,0,0,0,0|2,0,0]=4 11278 B13R1.24 OCCNC[C@H](O)c1ccccc1 e4e021aba2fa7e6ada44e3621e0c2a23 [0,2,0,0,0,0|2,0,0]=4 11279 B13R1.24 OCNCCC(O)c1ccccc1 4ee45296d60f4d0bf5cad0061fc06381 [0,2,0,0,0,0|2,0,0]=4 11280 B13R1.24 OCNCC[C@@H](O)c1ccccc1 3a782370b23e7457c065c9fd6b4d51fe [0,2,0,0,0,0|2,0,0]=4 11281 B13R1.24 OCNCC[C@H](O)c1ccccc1 ca2c26a32a78f6014b8840a23956c5eb [0,2,0,0,0,0|2,0,0]=4 11282 B13R1.24 O[C@@H](CCNCF)c1ccccc1 4fe435f519d1494c989b79f1b64c7f3d [0,2,0,0,0,0|2,0,0]=4 11283 B13R1.24 O[C@@H](CNCCF)c1ccccc1 694f7c9308bd34297b9ff90f9cec952b [0,2,0,0,0,0|2,0,0]=4 11284 B13R1.24 O[C@@H](CNCCS)c1ccccc1 d6a7f9c6e6a3d1be1b02cb86b9baad2d [0,2,0,0,0,0|2,0,0]=4 11285 B13R1.24 O[C@H](CCNCF)c1ccccc1 26a23d902f4d317deecaf6735dfed3a7 [0,2,0,0,0,0|2,0,0]=4 11286 B13R1.24 O[C@H](CNCCF)c1ccccc1 774bdce8e92b2e0c9ab91c9c2c882957 [0,2,0,0,0,0|2,0,0]=4 11287 B13R1.24 O[C@H](CNCCS)c1ccccc1 4e112c01042cd269c0529c1eaad18a78 [0,2,0,0,0,0|2,0,0]=4 11288 B13R1.28 BrCCNCCCc1ccccc1 fb0882a7609c333d856402492106c5a3 [0,2,0,0,0,0|1,0,0]=3 11289 B13R1.28 BrCCNCCCc1ccccn1 99decb6bfc6cc770dedd347e0f63edba [0,2,0,0,0,0|0,0,0]=2 11290 B13R1.28 BrCCNCCCc1cccnc1 56d948162c4c2d947fb8a1397ddb50b6 [0,2,0,0,0,0|2,0,0]=4 11291 B13R1.28 BrCCNCCCc1ccncc1 543812e0484bdc6ec7682b53c54dabbc [0,2,0,0,0,0|2,0,0]=4 11292 B13R1.28 BrCCNCCOc1ccccc1 9b6ecbdf8afdd4773fe4ffea82ac3ebd [0,2,0,0,0,0|2,0,0]=4 11293 B13R1.28 BrCCNCOCc1ccccc1 8936fc970bed88d5950ce68ed5c801d1 [0,2,0,0,0,0|2,0,0]=4 11294 B13R1.28 BrCCNCSCc1ccccc1 33975880453862053d785e8874c70514 [0,2,0,0,0,0|2,0,0]=4 11295 B13R1.28 C#CCCCCNc1ccccc1 59cf6929ff72a0b75b32776dbcc4b29c [0,2,0,0,0,0|1,0,1]=4 11296 B13R1.28 C#CCCCCNc1ccccn1 6a2fb1a1032b5fca1e29fe1eb7a7fa50 [0,2,0,0,0,0|0,0,1]=3 11297 B13R1.28 C#CCCCCNc1cccnn1 15ac73d4dad4e1301aec49e0a021eca7 [0,2,0,0,0,0|1,0,1]=4 11298 B13R1.28 C#CCCCCNc1ccncn1 e9ee73adab8da8739b74e59e87752ad1 [0,2,0,0,0,0|1,0,1]=4 11299 B13R1.28 C#CCCCCNc1cnccn1 d4d1017d50b58faec6852a1923421ddf [0,2,0,0,0,0|1,0,1]=4 11300 B13R1.28 C#CCCCCNc1ncccn1 e6442f18bb77335fa7159e1a41cd9dd4 [0,2,0,0,0,0|1,0,1]=4 11301 B13R1.28 C#CCCCCOc1ccccn1 47ec0f9f50ced216207f05edc33d6a9e [0,2,0,0,0,0|0,0,1]=3 11302 B13R1.28 C#CCCCCOc1cnccn1 729c3f942983fcab8b54d8b842ba7d7c [0,2,0,0,0,0|1,0,1]=4 11303 B13R1.28 C#CCCCCOc1ncccn1 485b524eb38231a749165d0a5264d8bc [0,2,0,0,0,0|1,0,1]=4 11304 B13R1.28 C#CCCCNCc1ccccc1 4837778bf57f0f007311ca79aeaf2798 [0,2,0,0,0,0|1,0,1]=4 11305 B13R1.28 C#CCCCNCc1ccccn1 aab7c25790852ec25fe6ecb1628e2ee2 [0,2,0,0,0,0|0,0,1]=3 11306 B13R1.28 C#CCCCNCc1cccnn1 a9fc4020986466c4d4b3bb61988f7ea5 [0,2,0,0,0,0|1,0,1]=4 11307 B13R1.28 C#CCCCNCc1ccncn1 9a5e75ec2aa567ef883028e9c017032f [0,2,0,0,0,0|1,0,1]=4 11308 B13R1.28 C#CCCCNCc1cnccn1 e89f303072e870849796999cd9446b81 [0,2,0,0,0,0|1,0,1]=4 11309 B13R1.28 C#CCCCNCc1ncccn1 d17a1fdb80cf647a6e9113f288e8ee80 [0,2,0,0,0,0|1,0,1]=4 11310 B13R1.28 C#CCCCOCc1ccccc1 7935093ccb44f98e6ed4bb43a138ee68 [0,2,0,0,0,0|1,0,1]=4 11311 B13R1.28 C#CCCCOCc1ccccn1 cc1cc5a17907c7c02d1aace2d1d500c6 [0,2,0,0,0,0|0,0,1]=3 11312 B13R1.28 C#CCCCOCc1cccnn1 4a0392cc9f2f207fe3399c9c98974513 [0,2,0,0,0,0|1,0,1]=4 11313 B13R1.28 C#CCCCOCc1ccncn1 85a7c31de36d031b6f63dfd9090a5649 [0,2,0,0,0,0|1,0,1]=4 11314 B13R1.28 C#CCCCOCc1cnccn1 0fb473024a7b5b7bba6d45078c8df093 [0,2,0,0,0,0|1,0,1]=4 11315 B13R1.28 C#CCCCOCc1ncccn1 1926ab86dcd71392184bf3dd300149d0 [0,2,0,0,0,0|1,0,1]=4 11316 B13R1.28 C#CCCNCCc1ccccc1 ba4e6142b00f25f1120c157b0e091968 [0,2,0,0,0,0|1,0,1]=4 11317 B13R1.28 C#CCCNCCc1ccccn1 9aed18edb088cceda10fc44a3a21f70c [0,2,0,0,0,0|0,0,1]=3 11318 B13R1.28 C#CCCNCCc1ccncn1 0c55a11a3189b541e886a1b4baf80278 [0,2,0,0,0,0|1,0,1]=4 11319 B13R1.28 C#CCCNCCc1cnccn1 461ad0dbc23266fb6646e1c39f634886 [0,2,0,0,0,0|1,0,1]=4 11320 B13R1.28 C#CCCNCCc1ncccn1 7fc875675a129d920553d8679b8cc681 [0,2,0,0,0,0|1,0,1]=4 11321 B13R1.28 C#CCCOCCc1ccccc1 2473fb5b9492389aba998db0130cdb05 [0,2,0,0,0,0|1,0,1]=4 11322 B13R1.28 C#CCCOCCc1ccccn1 75dbfd0f0ea437c67afd53f8572f5d92 [0,2,0,0,0,0|0,0,1]=3 11323 B13R1.28 C#CCCOCCc1ccncn1 64c549b99a59fcebb5883b05ecb903d6 [0,2,0,0,0,0|1,0,1]=4 11324 B13R1.28 C#CCCOCCc1cnccn1 bc26d61b14bee57c4215ad0a63c22fbe [0,2,0,0,0,0|1,0,1]=4 11325 B13R1.28 C#CCCOCCc1ncccn1 99ba75e9606c0b32609c34d14fde529f [0,2,0,0,0,0|1,0,1]=4 11326 B13R1.28 C#CCNCCCc1ccccc1 6acacfaec246091e6f551f07310acae1 [0,2,0,0,0,0|1,0,1]=4 11327 B13R1.28 C#CCNCCCc1ccccn1 0999002fb170b8e13815432d7d6baca9 [0,2,0,0,0,0|0,0,1]=3 11328 B13R1.28 C#CCNCCOc1ccccn1 d6053bad7e03922ff82bedb904595c80 [0,2,0,0,0,0|0,0,2]=4 11329 B13R1.28 C#CCOCCCc1ccccc1 29ba9ed7b869d71a88e4046e21db6d22 [0,2,0,0,0,0|1,0,1]=4 11330 B13R1.28 C#CCOCCCc1ccccn1 8f0d1f5d4ca3cea743002e5d49b6d287 [0,2,0,0,0,0|0,0,1]=3 11331 B13R1.28 C#CCOCCCc1cnccn1 8940ccc31a5f9567801b326fe708d9bb [0,2,0,0,0,0|1,0,1]=4 11332 B13R1.28 C#CCOCCCc1ncccn1 23fd51ebc53311418a5b297bd63bc0c0 [0,2,0,0,0,0|1,0,1]=4 11333 B13R1.28 C#CCOCCNc1ccccn1 f7c54a5a01c8fafaced4701fba189d39 [0,2,0,0,0,0|0,0,2]=4 11334 B13R1.28 C#CCOCCOc1ccccn1 41decb120ee70dfb228a29d6cd6ccf38 [0,2,0,0,0,0|0,0,2]=4 11335 B13R1.28 C#CCOCCSc1ccccn1 e4ad9d3bdd7de6e6869db83680d13e7a [0,2,0,0,0,0|0,0,2]=4 11336 B13R1.28 C/C=C/CCOCc1ccccc1 01e961355a391578e6b988e0f8572f3c [0,2,0,0,0,0|1,0,1]=4 11337 B13R1.28 C/C=C/CCOCc1ccccn1 e6d53ce84daebe92a3c312af2bdf69b6 [0,2,0,0,0,0|0,0,1]=3 11338 B13R1.28 C/C=C/CCOCc1cccnn1 d1960672a3a08b22d1cd7f769a6120ec [0,2,0,0,0,0|1,0,1]=4 11339 B13R1.28 C/C=C/CCOCc1ccncn1 4e2cb60d6312e362f0b764f3d7fdf3d1 [0,2,0,0,0,0|1,0,1]=4 11340 B13R1.28 C/C=C/CCOCc1ncccn1 b07d2223b6b8fae2162fec1f07b895fc [0,2,0,0,0,0|1,0,1]=4 11341 B13R1.28 C/C=C/CNCCc1ccccc1 8ab93d592e75368b33e0c84307ec6acf [0,2,0,0,0,0|1,0,1]=4 11342 B13R1.28 C/C=C/CNCCc1ccccn1 5fb94ba9a9a3b1efeef3e328c6a5618f [0,2,0,0,0,0|0,0,1]=3 11343 B13R1.28 C/C=C/CNCCc1ccncn1 4d1515bd7efc0d64d6d135b1053ab1b1 [0,2,0,0,0,0|1,0,1]=4 11344 B13R1.28 C/C=C/CNCCc1cnccn1 79a6d3406508de92310d3c51a633deb4 [0,2,0,0,0,0|1,0,1]=4 11345 B13R1.28 C/C=C/CNCCc1ncccn1 e5e144cf09b680c0b04ca9f6ea794c93 [0,2,0,0,0,0|1,0,1]=4 11346 B13R1.28 C/C=C/COCCc1ccccc1 caa1c2484a9d868c35520da71e94ba06 [0,2,0,0,0,0|1,0,1]=4 11347 B13R1.28 C/C=C/COCCc1ccccn1 cfb87908fcf10d61eac57f21a4d74e06 [0,2,0,0,0,0|0,0,1]=3 11348 B13R1.28 C/C=C/COCCc1ccncn1 14f526b34a3668571fae7bfc7cdd1624 [0,2,0,0,0,0|1,0,1]=4 11349 B13R1.28 C/C=C/COCCc1cnccn1 4ba899d7da0bcd5cb9f62a1b15bf0938 [0,2,0,0,0,0|1,0,1]=4 11350 B13R1.28 C/C=C/COCCc1ncccn1 0b1a14a80f4113bd1b765290203e2d77 [0,2,0,0,0,0|1,0,1]=4 11351 B13R1.28 C/C=C\CCCNc1ccccc1 55e5670287f80f241dd84e4168dfc118 [0,2,0,0,0,0|1,0,1]=4 11352 B13R1.28 C/C=C\CCCNc1ccccn1 517fd5238a2ed3718b5dea041e3a9e8b [0,2,0,0,0,0|0,0,1]=3 11353 B13R1.28 C/C=C\CCCNc1cccnn1 f5fbf7cfdb6bfd3b05f04ff29d40cd9b [0,2,0,0,0,0|1,0,1]=4 11354 B13R1.28 C/C=C\CCCNc1ccncn1 70a83075635e23ac383b5c7f6bdd7bd2 [0,2,0,0,0,0|1,0,1]=4 11355 B13R1.28 C/C=C\CCCNc1cnccn1 e02bcbb3f4e1e79d8690d330e2d58119 [0,2,0,0,0,0|1,0,1]=4 11356 B13R1.28 C/C=C\CCCNc1ncccn1 a05e6e8dc884b6a365f3dfc80d3393bf [0,2,0,0,0,0|1,0,1]=4 11357 B13R1.28 C/C=C\CCCOc1ccccn1 916946e33675136eb703c338929d0800 [0,2,0,0,0,0|0,0,1]=3 11358 B13R1.28 C/C=C\CCCOc1cnccn1 c658040a7d51236e07315a600fdb5151 [0,2,0,0,0,0|1,0,1]=4 11359 B13R1.28 C/C=C\CCCOc1ncccn1 3a16c8b3425e1313eb43ae8fd99bb51a [0,2,0,0,0,0|1,0,1]=4 11360 B13R1.28 C/C=C\CNCCc1ccccc1 ccc17e854afc1e38f1474c2c8240832c [0,2,0,0,0,0|1,0,1]=4 11361 B13R1.28 C/C=C\CNCCc1ccccn1 61a9f357310040f1bdd3689e1375a43a [0,2,0,0,0,0|0,0,1]=3 11362 B13R1.28 C/C=C\CNCCc1ccncn1 11b1a3ae63d0458ba881626813b1cd7e [0,2,0,0,0,0|1,0,1]=4 11363 B13R1.28 C/C=C\CNCCc1cnccn1 19e404de70d0471a79d37a16a7228e2e [0,2,0,0,0,0|1,0,1]=4 11364 B13R1.28 C/C=C\CNCCc1ncccn1 8cb5689aebb3fb931a7a710658459821 [0,2,0,0,0,0|1,0,1]=4 11365 B13R1.28 C/C=C\COCCc1ccccc1 ea16e20f83f23a3ec853939ea68edcc4 [0,2,0,0,0,0|1,0,1]=4 11366 B13R1.28 C/C=C\COCCc1ccccn1 85197e68def0e7583331cec68c3342b8 [0,2,0,0,0,0|0,0,1]=3 11367 B13R1.28 C/C=C\COCCc1ccncn1 9abda0f0f9e0d6ef86220b3fff2d196d [0,2,0,0,0,0|1,0,1]=4 11368 B13R1.28 C/C=C\COCCc1cnccn1 5efce4482b9e077b35ac0aa37b29d205 [0,2,0,0,0,0|1,0,1]=4 11369 B13R1.28 C/C=C\COCCc1ncccn1 bd07f93f67d7ce913a759fcb89f173ee [0,2,0,0,0,0|1,0,1]=4 11370 B13R1.28 C=C=CCCOCc1ccccn1 4d5e23ebc1fbab694bb96603549936d7 [0,2,0,0,0,0|0,0,2]=4 11371 B13R1.28 C=CCCCCNc1ccccc1 a19e8df0c16866d6303a173d7a4ee2ef [0,2,0,0,0,0|1,0,1]=4 11372 B13R1.28 C=CCCCCNc1ccccn1 f309dfcbbbecb3c88188384170510d78 [0,2,0,0,0,0|0,0,1]=3 11373 B13R1.28 C=CCCCCNc1cccnn1 56aa9c01ee113e3b21a118ef4d1e53a3 [0,2,0,0,0,0|1,0,1]=4 11374 B13R1.28 C=CCCCCNc1ccncn1 83aff2e6a5124c100cc0f6f8439223e5 [0,2,0,0,0,0|1,0,1]=4 11375 B13R1.28 C=CCCCCNc1cnccn1 f1cb08b8bbf25dc448d4d1e3484e8b0b [0,2,0,0,0,0|1,0,1]=4 11376 B13R1.28 C=CCCCCNc1ncccn1 d324fd5a8ceb459410067c2d76572fed [0,2,0,0,0,0|1,0,1]=4 11377 B13R1.28 C=CCCCCOc1ccccn1 981e285ddcad16bae17b048c51884700 [0,2,0,0,0,0|0,0,1]=3 11378 B13R1.28 C=CCCCCOc1cnccn1 69bee55f983f0ee3d77c0d2cdb044168 [0,2,0,0,0,0|1,0,1]=4 11379 B13R1.28 C=CCCCCOc1ncccn1 85dede299e0c914d48d09c20bb435052 [0,2,0,0,0,0|1,0,1]=4 11380 B13R1.28 C=CCCCNCc1ccccc1 9466ea9aa2b917155fccf2efd40027a2 [0,2,0,0,0,0|1,0,1]=4 11381 B13R1.28 C=CCCCNCc1ccccn1 2ddc5f73dd1381bf697b4f7c437a9ca8 [0,2,0,0,0,0|0,0,1]=3 11382 B13R1.28 C=CCCCNCc1cccnn1 c5f8972e728b6c8bfb950df9190d8126 [0,2,0,0,0,0|1,0,1]=4 11383 B13R1.28 C=CCCCNCc1ccncn1 31710bd3c41d28b1ae065de854b89bab [0,2,0,0,0,0|1,0,1]=4 11384 B13R1.28 C=CCCCNCc1cnccn1 b61ab6ceff2b9286ac2ab8e40e20b1b1 [0,2,0,0,0,0|1,0,1]=4 11385 B13R1.28 C=CCCCNCc1ncccn1 fbd6675dad45c07ab144ad88b6be0b35 [0,2,0,0,0,0|1,0,1]=4 11386 B13R1.28 C=CCCCOCc1ccccc1 17a72b194f82db745cd6af77efe35c97 [0,2,0,0,0,0|1,0,1]=4 11387 B13R1.28 C=CCCCOCc1ccccn1 470a336f14735701f38404080b153ed9 [0,2,0,0,0,0|0,0,1]=3 11388 B13R1.28 C=CCCCOCc1cccnn1 9a920350ac812905b0797321f89e15c6 [0,2,0,0,0,0|1,0,1]=4 11389 B13R1.28 C=CCCCOCc1ccncn1 255c66dfe123c558b6b858513737b1b6 [0,2,0,0,0,0|1,0,1]=4 11390 B13R1.28 C=CCCCOCc1cnccn1 fbf9d7b7fdfb69eecf5a92234bbdd38a [0,2,0,0,0,0|1,0,1]=4 11391 B13R1.28 C=CCCCOCc1ncccn1 47aa7a34faa9cf719302fb06e872da25 [0,2,0,0,0,0|1,0,1]=4 11392 B13R1.28 C=CCCNCCc1ccccc1 1bee2ece4dbc08762090f3ec21103a73 [0,2,0,0,0,0|1,0,1]=4 11393 B13R1.28 C=CCCNCCc1ccccn1 a04f1f2fd606729b0e5f5cb83f5c7b09 [0,2,0,0,0,0|0,0,1]=3 11394 B13R1.28 C=CCCNCCc1ccncn1 d02b7ca09774451ffd893849e5283651 [0,2,0,0,0,0|1,0,1]=4 11395 B13R1.28 C=CCCNCCc1cnccn1 49d6c53f15942180f7c7c6f4a8a54400 [0,2,0,0,0,0|1,0,1]=4 11396 B13R1.28 C=CCCNCCc1ncccn1 81d902f0539c8273da133e65f8f0f53b [0,2,0,0,0,0|1,0,1]=4 11397 B13R1.28 C=CCCOCCc1ccccc1 ed89b0fdfd623bafacd1b7e12b445391 [0,2,0,0,0,0|1,0,1]=4 11398 B13R1.28 C=CCCOCCc1ccccn1 df46c08652d226f4447518b2c75831b0 [0,2,0,0,0,0|0,0,1]=3 11399 B13R1.28 C=CCCOCCc1ccncn1 2045d0f6ee81e80bd4a36943e28b4f7a [0,2,0,0,0,0|1,0,1]=4 11400 B13R1.28 C=CCCOCCc1cnccn1 9ab2048873a51146faf48b65c31b6f61 [0,2,0,0,0,0|1,0,1]=4 11401 B13R1.28 C=CCCOCCc1ncccn1 c9ceeccc4dd857d0f2af7d01b328e786 [0,2,0,0,0,0|1,0,1]=4 11402 B13R1.28 C=CCNCCCc1ccccc1 ada32855b93d76cbf22fbd270d9c4178 [0,2,0,0,0,0|1,0,1]=4 11403 B13R1.28 C=CCNCCCc1ccccn1 ecbb718d1914e95c2c063d9a2d08642e [0,2,0,0,0,0|0,0,1]=3 11404 B13R1.28 C=CCNCCOc1ccccn1 718f762c342dc05eb359391a78448495 [0,2,0,0,0,0|0,0,2]=4 11405 B13R1.28 C=CCOCCCc1ccccc1 dfe1406d734e511f6f4c7781c1e5d797 [0,2,0,0,0,0|1,0,1]=4 11406 B13R1.28 C=CCOCCCc1ccccn1 67604e0e42c8353b843be916a4481959 [0,2,0,0,0,0|0,0,1]=3 11407 B13R1.28 C=CCOCCCc1cnccn1 47d881e42d8c6099ff551502cff5d8b8 [0,2,0,0,0,0|1,0,1]=4 11408 B13R1.28 C=CCOCCCc1ncccn1 ea8e7ec972f70307ce2cf4c2e0cfdfa7 [0,2,0,0,0,0|1,0,1]=4 11409 B13R1.28 C=CCOCCNc1ccccn1 fa4c5a3f2af2b0fb266eb9ad202333dc [0,2,0,0,0,0|0,0,2]=4 11410 B13R1.28 C=CCOCCOc1ccccn1 75a7bcceb96ce6deffeb17a95e6211d9 [0,2,0,0,0,0|0,0,2]=4 11411 B13R1.28 C=CCOCCSc1ccccn1 65ec16eb288958576843d843bfa65fc5 [0,2,0,0,0,0|0,0,2]=4 11412 B13R1.28 C=COCCCNc1ccccn1 9304a38b798c48ca6a07eb8ada0fa3fa [0,2,0,0,0,0|0,0,2]=4 11413 B13R1.28 C=COCCNCc1ccccn1 38edd9760fdbdfb301166b3966b019c1 [0,2,0,0,0,0|0,0,2]=4 11414 B13R1.28 C=COCCOCc1ccccn1 e051cc120e04fa64a5b0964920845651 [0,2,0,0,0,0|0,0,2]=4 11415 B13R1.28 CC#CCCOCc1ccccc1 f343d6a26b15541c56af553035374457 [0,2,0,0,0,0|1,0,1]=4 11416 B13R1.28 CC#CCCOCc1ccccn1 c2d80aa6f855397311f2e746b2378d2c [0,2,0,0,0,0|0,0,1]=3 11417 B13R1.28 CC#CCCOCc1cccnn1 2eb6d02c249bfdb708488d31aa9d5a4f [0,2,0,0,0,0|1,0,1]=4 11418 B13R1.28 CC#CCCOCc1ccncn1 edc4cc8df07bdabf69be8bea50019acd [0,2,0,0,0,0|1,0,1]=4 11419 B13R1.28 CC#CCCOCc1ncccn1 c75edea534607c3c95eb84f485f2f0ad [0,2,0,0,0,0|1,0,1]=4 11420 B13R1.28 CC#CCNCCc1ccccc1 3200d428941e231d1c02fdfdd15f937b [0,2,0,0,0,0|1,0,1]=4 11421 B13R1.28 CC#CCNCCc1ccccn1 aefe3b08d1ce7308826797462978cb18 [0,2,0,0,0,0|0,0,1]=3 11422 B13R1.28 CC#CCOCCc1ccccc1 8be36d9d37581ff09656d51c03d46024 [0,2,0,0,0,0|1,0,1]=4 11423 B13R1.28 CC#CCOCCc1ccccn1 c94e20d585bba76b1b07efec07c77f63 [0,2,0,0,0,0|0,0,1]=3 11424 B13R1.28 CC/C=C/CNCc1ccccc1 03c193035a3be2e4cd018c8e895f9718 [0,2,0,0,0,0|1,0,1]=4 11425 B13R1.28 CC/C=C/CNCc1ccccn1 ba3d9be0e94902d43c4514b094353fe9 [0,2,0,0,0,0|0,0,1]=3 11426 B13R1.28 CC/C=C/CNCc1cccnn1 008c362653dc238f842d70346a846372 [0,2,0,0,0,0|1,0,1]=4 11427 B13R1.28 CC/C=C/CNCc1ccncn1 9ed91d31d3a9abd5287aeb59e2814592 [0,2,0,0,0,0|1,0,1]=4 11428 B13R1.28 CC/C=C/CNCc1cnccn1 bab3a1d369954ba13b947356119b2a44 [0,2,0,0,0,0|1,0,1]=4 11429 B13R1.28 CC/C=C/CNCc1ncccn1 fbdadc1fc89f2b5c179d374316c0fffd [0,2,0,0,0,0|1,0,1]=4 11430 B13R1.28 CC/C=C/COCc1ccccc1 dfb2ae6a0ae6f14a55bfd885fdf0e230 [0,2,0,0,0,0|1,0,1]=4 11431 B13R1.28 CC/C=C/COCc1ccccn1 158d565f2181c2f40d04a27e3b268905 [0,2,0,0,0,0|0,0,1]=3 11432 B13R1.28 CC/C=C/COCc1cccnn1 5e8e50090feac46f64e2f381e11898fb [0,2,0,0,0,0|1,0,1]=4 11433 B13R1.28 CC/C=C/COCc1ccncn1 83fc299a952d7425b68376a0ec8ffd9b [0,2,0,0,0,0|1,0,1]=4 11434 B13R1.28 CC/C=C/COCc1cnccn1 835a6c73dd832328d2d044a9302170f5 [0,2,0,0,0,0|1,0,1]=4 11435 B13R1.28 CC/C=C/COCc1ncccn1 d2a547f8be48a022d3b9f921a0759010 [0,2,0,0,0,0|1,0,1]=4 11436 B13R1.28 CC/C=C\CCNc1ccccc1 9095e60ac046070d645d235c5e833297 [0,2,0,0,0,0|1,0,1]=4 11437 B13R1.28 CC/C=C\CCNc1ccccn1 f618de7de0bfb873fe95499dd782b984 [0,2,0,0,0,0|0,0,1]=3 11438 B13R1.28 CC/C=C\CCNc1cccnn1 41ab9428b183dae334c0ada7ce2f191f [0,2,0,0,0,0|1,0,1]=4 11439 B13R1.28 CC/C=C\CCNc1ccncn1 687b07d2a4d9eaf5b8ce920ede5fee89 [0,2,0,0,0,0|1,0,1]=4 11440 B13R1.28 CC/C=C\CCNc1cnccn1 2102d456e002d6f77e0cc452b3a7b15f [0,2,0,0,0,0|1,0,1]=4 11441 B13R1.28 CC/C=C\CCNc1ncccn1 2c2c467283f5c9dd7ee9d45b4325d791 [0,2,0,0,0,0|1,0,1]=4 11442 B13R1.28 CC/C=C\CCOc1ccccn1 86b5abb92ead33b7cf06dc5efecea201 [0,2,0,0,0,0|0,0,1]=3 11443 B13R1.28 CC/C=C\CCOc1cnccn1 bf80626788ba4b48f551a60938c930c1 [0,2,0,0,0,0|1,0,1]=4 11444 B13R1.28 CC/C=C\CCOc1ncccn1 f77eacffb5dea375930efd6b2e5542bb [0,2,0,0,0,0|1,0,1]=4 11445 B13R1.28 CC/C=C\COCc1ccccc1 227d9d8dc3d7269476ed2e9ccabe1339 [0,2,0,0,0,0|1,0,1]=4 11446 B13R1.28 CC/C=C\COCc1ccccn1 0f39470c52b24c4e9169c7b0c7bd1516 [0,2,0,0,0,0|0,0,1]=3 11447 B13R1.28 CC/C=C\COCc1cccnn1 55e2a9de064367339c83d600635b1a74 [0,2,0,0,0,0|1,0,1]=4 11448 B13R1.28 CC/C=C\COCc1ccncn1 4fcb1a4b010524e52583230b5b32e635 [0,2,0,0,0,0|1,0,1]=4 11449 B13R1.28 CC/C=C\COCc1ncccn1 75ad2788905041798142c0b0601162db [0,2,0,0,0,0|1,0,1]=4 11450 B13R1.28 CC=CCNCCc1ccccc1 2ec03ba54d73acb5a097cf711f5d1973 [0,2,0,0,0,0|1,0,1]=4 11451 B13R1.28 CC=CCNCCc1ccccn1 2aa13c02c66b09e04668b49945c3a9e9 [0,2,0,0,0,0|0,0,1]=3 11452 B13R1.28 CC=CCOCCc1ccccc1 8d796ae46c7648e0096c050736554725 [0,2,0,0,0,0|1,0,1]=4 11453 B13R1.28 CC=CCOCCc1ccccn1 cf820d45fbaa660beef174bc35982485 [0,2,0,0,0,0|0,0,1]=3 11454 B13R1.28 CCC#CCNCc1ccccn1 cdbbda5f1ecd58762beb9c4dac986eb0 [0,2,0,0,0,0|0,0,1]=3 11455 B13R1.28 CCC#CCNCc1cccnn1 3bcbfab10be69f5a4bc37053aeb2542e [0,2,0,0,0,0|1,0,1]=4 11456 B13R1.28 CCC#CCNCc1ccncn1 3cd28eb80e90f8ebb4af40b3a4b59ea0 [0,2,0,0,0,0|1,0,1]=4 11457 B13R1.28 CCC#CCNCc1cnccn1 3e607e514fd5e33b189b56d1ec0aa595 [0,2,0,0,0,0|1,0,1]=4 11458 B13R1.28 CCC#CCOCc1ccccc1 7830d2e4ba5efdb871a86b3956f152e9 [0,2,0,0,0,0|1,0,1]=4 11459 B13R1.28 CCC#CCOCc1ccccn1 fd21800df03af55c84b7ca5ab27b5aa6 [0,2,0,0,0,0|0,0,1]=3 11460 B13R1.28 CCC#CCOCc1cccnn1 90828802163b2f841573d8c324d4baf3 [0,2,0,0,0,0|1,0,1]=4 11461 B13R1.28 CCC#CCOCc1ccncn1 a2299fecd068117b224c36f2bd705947 [0,2,0,0,0,0|1,0,1]=4 11462 B13R1.28 CCC#CCOCc1ncccn1 d6a441b44e64ff7f087e0fcce87d4b10 [0,2,0,0,0,0|1,0,1]=4 11463 B13R1.28 CCC/C=C/CNc1ccccc1 6170b9ac51b73737086b09b380e25fe1 [0,2,0,0,0,0|1,0,1]=4 11464 B13R1.28 CCC/C=C/CNc1ccccn1 3525e0d991d1c4fc6d33aa5dea6e90e8 [0,2,0,0,0,0|0,0,1]=3 11465 B13R1.28 CCC/C=C/CNc1cccnn1 eafe1bcebbbb2eaa8c18a60fafa01096 [0,2,0,0,0,0|1,0,1]=4 11466 B13R1.28 CCC/C=C/CNc1ccncn1 d68dbc7e4a823012b3eb6bf9eea1fa5c [0,2,0,0,0,0|1,0,1]=4 11467 B13R1.28 CCC/C=C/CNc1cnccn1 646169b0bd6d0cb1a6c21420d6c760d2 [0,2,0,0,0,0|1,0,1]=4 11468 B13R1.28 CCC/C=C/CNc1ncccn1 c80ca0ae9f5364e22135a50ec03fc290 [0,2,0,0,0,0|1,0,1]=4 11469 B13R1.28 CCC/C=C/COc1ccccn1 ceab76a3a99358b40bbb1a5feb985d85 [0,2,0,0,0,0|0,0,1]=3 11470 B13R1.28 CCC/C=C/COc1cnccn1 d23ac224317349173baee9bcffb6011c [0,2,0,0,0,0|1,0,1]=4 11471 B13R1.28 CCC/C=C/COc1ncccn1 e8f7c761ff16567fcd5fd833ae27a476 [0,2,0,0,0,0|1,0,1]=4 11472 B13R1.28 CCC/C=C\CNc1ccccc1 ad1453b8d2ab4df82b0247ef93dbf237 [0,2,0,0,0,0|1,0,1]=4 11473 B13R1.28 CCC/C=C\CNc1ccccn1 5367f6b1c24c1c47ab10fdc1691aef3c [0,2,0,0,0,0|0,0,1]=3 11474 B13R1.28 CCC/C=C\CNc1cccnn1 960dc661264e169a99799af05b4f161e [0,2,0,0,0,0|1,0,1]=4 11475 B13R1.28 CCC/C=C\CNc1ccncn1 231c500b1b7daa6f9796f2135963f896 [0,2,0,0,0,0|1,0,1]=4 11476 B13R1.28 CCC/C=C\CNc1cnccn1 01f5a216d75da52971a92d05525363f3 [0,2,0,0,0,0|1,0,1]=4 11477 B13R1.28 CCC/C=C\CNc1ncccn1 31e91fbdaa80400636108a6322cbd9eb [0,2,0,0,0,0|1,0,1]=4 11478 B13R1.28 CCC/C=C\COc1ccccn1 0821436d45459eea1dbd34ab1301249d [0,2,0,0,0,0|0,0,1]=3 11479 B13R1.28 CCC/C=C\COc1cnccn1 944f497b121c2b73f7ba586541082b1b [0,2,0,0,0,0|1,0,1]=4 11480 B13R1.28 CCC/C=C\COc1ncccn1 4f3a7962965cbc432f0671e6e6d3b0b0 [0,2,0,0,0,0|1,0,1]=4 11481 B13R1.28 CCCCCCNc1ccccc1 048baa466684ceb36ce0ec04def923a7 [0,2,0,0,0,0|1,0,0]=3 11482 B13R1.28 CCCCCCNc1ccccn1 ea586188b0fe3baf5bdb7887dd5a5702 [0,2,0,0,0,0|0,0,0]=2 11483 B13R1.28 CCCCCCNc1cccnc1 7d1c621510db8e702966edda94a42213 [0,2,0,0,0,0|2,0,0]=4 11484 B13R1.28 CCCCCCNc1cccnn1 636a30df00d9cc910bfbc9fefc143b60 [0,2,0,0,0,0|1,0,0]=3 11485 B13R1.28 CCCCCCNc1ccncc1 57a244ed12e2aaacade906ad479d0009 [0,2,0,0,0,0|2,0,0]=4 11486 B13R1.28 CCCCCCNc1ccncn1 1d76d17f683a1b972dfa6cd0ddc0be16 [0,2,0,0,0,0|1,0,0]=3 11487 B13R1.28 CCCCCCNc1cnccn1 6b11896ad3c0fb38eb48f43cd7b17a0a [0,2,0,0,0,0|1,0,0]=3 11488 B13R1.28 CCCCCCNc1cnncn1 67f45f06f551f56a90434de33946bb35 [0,2,0,0,0,0|2,0,0]=4 11489 B13R1.28 CCCCCCNc1ncccn1 910c42138adc354fafaf1eb059de9b96 [0,2,0,0,0,0|1,0,0]=3 11490 B13R1.28 CCCCCCNc1nccnn1 0ba8f2bd49555aff46798580cf85cbac [0,2,0,0,0,0|2,0,0]=4 11491 B13R1.28 CCCCCCNc1ncncn1 8dc2d2ea47dbb1ba8841f113e8194444 [0,2,0,0,0,0|2,0,0]=4 11492 B13R1.28 CCCCCCOc1ccccn1 d0fcd2e50a7cdeef600d7d7c11ff9582 [0,2,0,0,0,0|0,0,0]=2 11493 B13R1.28 CCCCCCOc1cccnc1 76e4a0b1ac556aa9e477636e1f8dd89a [0,2,0,0,0,0|2,0,0]=4 11494 B13R1.28 CCCCCCOc1ccncc1 31cc026bbc8708ee3022eca19ac7e8d0 [0,2,0,0,0,0|2,0,0]=4 11495 B13R1.28 CCCCCCOc1cnccn1 49ea171243eb3f5b4fcbb85aae0aa50c [0,2,0,0,0,0|1,0,0]=3 11496 B13R1.28 CCCCCCOc1cncnn1 452622f2dad6702b52dbf1b98fbf29a9 [0,2,0,0,0,0|2,0,0]=4 11497 B13R1.28 CCCCCCOc1ncccn1 bf7c57a2397c4a6fb8c0eab8d68ef7a8 [0,2,0,0,0,0|1,0,0]=3 11498 B13R1.28 CCCCCNCc1ccccc1 ceac33fb77d66ab1855d13c360a20a4d [0,2,0,0,0,0|1,0,0]=3 11499 B13R1.28 CCCCCNCc1ccccn1 27be1a171a28c70fc1c0e94d8437dafc [0,2,0,0,0,0|0,0,0]=2 11500 B13R1.28 CCCCCNCc1cccnc1 d2c766da9f03582c9a771ea0eff25d00 [0,2,0,0,0,0|2,0,0]=4 11501 B13R1.28 CCCCCNCc1cccnn1 3e262b08015b5028bf20f42dc9a8d302 [0,2,0,0,0,0|1,0,0]=3 11502 B13R1.28 CCCCCNCc1ccncc1 29e83b88b4ece089aec9527c6ff3f3e9 [0,2,0,0,0,0|2,0,0]=4 11503 B13R1.28 CCCCCNCc1ccncn1 1b13d6b750d7809230e0daabda274b71 [0,2,0,0,0,0|1,0,0]=3 11504 B13R1.28 CCCCCNCc1cnccn1 afd69870241628ec1b34d569f1cd3144 [0,2,0,0,0,0|1,0,0]=3 11505 B13R1.28 CCCCCNCc1ncccn1 145962832c63198408d515043a13d8ac [0,2,0,0,0,0|1,0,0]=3 11506 B13R1.28 CCCCCOCc1ccccc1 7cca4ff4b2d15a92f4795dbfa1992899 [0,2,0,0,0,0|1,0,0]=3 11507 B13R1.28 CCCCCOCc1ccccn1 0ba417f448bc1245af8da2a6e3d648f6 [0,2,0,0,0,0|0,0,0]=2 11508 B13R1.28 CCCCCOCc1cccnc1 cc529a7f196852dcb1bb1033e3a71e59 [0,2,0,0,0,0|2,0,0]=4 11509 B13R1.28 CCCCCOCc1cccnn1 ce97228cef2286e5b02af79124ae4e7f [0,2,0,0,0,0|1,0,0]=3 11510 B13R1.28 CCCCCOCc1ccncc1 0625b58747449f61f7743dde19c0769c [0,2,0,0,0,0|2,0,0]=4 11511 B13R1.28 CCCCCOCc1ccncn1 a0e43a3fd458478e4c347dbd3c17478d [0,2,0,0,0,0|1,0,0]=3 11512 B13R1.28 CCCCCOCc1cnccn1 e7d5bd56a3cee2e5eee88fda4f12e7c1 [0,2,0,0,0,0|1,0,0]=3 11513 B13R1.28 CCCCCOCc1ncccn1 a08f0393338b6b6657232697a783aba4 [0,2,0,0,0,0|1,0,0]=3 11514 B13R1.28 CCCCNCCc1ccccc1 0109fb426bf3ff59afa8f634257d80f2 [0,2,0,0,0,0|1,0,0]=3 11515 B13R1.28 CCCCNCCc1ccccn1 6fa0337fac491ba903a4185efc251d57 [0,2,0,0,0,0|0,0,0]=2 11516 B13R1.28 CCCCNCCc1cccnc1 458045a7155983806741ceffb93e3916 [0,2,0,0,0,0|2,0,0]=4 11517 B13R1.28 CCCCNCCc1ccncc1 7e2b41101486e3e923459c5f5e15840b [0,2,0,0,0,0|2,0,0]=4 11518 B13R1.28 CCCCNCCc1ccncn1 d5dfd0566fd4e4843d9502794cdada90 [0,2,0,0,0,0|1,0,0]=3 11519 B13R1.28 CCCCNCCc1cnccn1 ddd8e54013d023bc00bf95f3eb586105 [0,2,0,0,0,0|1,0,0]=3 11520 B13R1.28 CCCCNCCc1ncccn1 2070d5ddb809c29a5b6a046d521f637e [0,2,0,0,0,0|1,0,0]=3 11521 B13R1.28 CCCCOCCc1ccccc1 9579249358ed59a0332ebffafb432191 [0,2,0,0,0,0|1,0,0]=3 11522 B13R1.28 CCCCOCCc1ccccn1 f5bb843c066a5a457e856626fef0f0d8 [0,2,0,0,0,0|0,0,0]=2 11523 B13R1.28 CCCCOCCc1cccnc1 9ae2a1a7b876b5913444bc16d2e2b001 [0,2,0,0,0,0|2,0,0]=4 11524 B13R1.28 CCCCOCCc1ccncc1 fbfcf7d6d3394c78234724482a6fbd17 [0,2,0,0,0,0|2,0,0]=4 11525 B13R1.28 CCCCOCCc1ccncn1 17180b599ae1252c4f6fafeb5b1b444b [0,2,0,0,0,0|1,0,0]=3 11526 B13R1.28 CCCCOCCc1cnccn1 e2323fc4c0b3b6733bf22db19e588be2 [0,2,0,0,0,0|1,0,0]=3 11527 B13R1.28 CCCCOCCc1ncccn1 4d46c1d88b1740738842b5e1e49df0df [0,2,0,0,0,0|1,0,0]=3 11528 B13R1.28 CCCCOCNc1ccccc1 58afdac690557bc2f9492d390ebdd20f [0,2,0,0,0,0|1,0,0]=3 11529 B13R1.28 CCCCOCNc1ccccn1 1ab60e8e80e7c15fe273913a40d71db8 [0,2,0,0,0,0|0,0,0]=2 11530 B13R1.28 CCCCOCNc1cccnc1 a5af7704b7ff37484ce3cb5589289a57 [0,2,0,0,0,0|2,0,0]=4 11531 B13R1.28 CCCCOCNc1cccnn1 0dd26de7a2901e8901eee6ae21fa07e4 [0,2,0,0,0,0|1,0,0]=3 11532 B13R1.28 CCCCOCNc1ccncc1 63c081aca29df98ce6e33929a97420b0 [0,2,0,0,0,0|2,0,0]=4 11533 B13R1.28 CCCCOCNc1ccncn1 060db8429f767f14c0b2bf17ed37af79 [0,2,0,0,0,0|1,0,0]=3 11534 B13R1.28 CCCCOCNc1cnccn1 b01f57451b96548865392347f290acc0 [0,2,0,0,0,0|1,0,0]=3 11535 B13R1.28 CCCCOCNc1cnncn1 f7c5eca8c1686293361d76a904a1dfc9 [0,2,0,0,0,0|2,0,0]=4 11536 B13R1.28 CCCCOCNc1ncccn1 6b078a64f927688fa3f775efafca178d [0,2,0,0,0,0|1,0,0]=3 11537 B13R1.28 CCCCOCNc1nccnn1 01b4de0005260fd02a50be6eba7cba10 [0,2,0,0,0,0|2,0,0]=4 11538 B13R1.28 CCCCOCNc1ncncn1 6daa89f28ab7b8596e0390a0671b8089 [0,2,0,0,0,0|2,0,0]=4 11539 B13R1.28 CCCCOCOc1ccccn1 9ff0cfe902ba813d8299b205adff7e2c [0,2,0,0,0,0|0,0,0]=2 11540 B13R1.28 CCCCOCOc1cccnc1 2eacdff2a1d9af5b36f4054e3204de03 [0,2,0,0,0,0|2,0,0]=4 11541 B13R1.28 CCCCOCOc1ccncc1 b9650943f2a1e668f3d2144a0662d151 [0,2,0,0,0,0|2,0,0]=4 11542 B13R1.28 CCCCOCOc1cnccn1 6c57ff037290b117c2f08501567e8778 [0,2,0,0,0,0|1,0,0]=3 11543 B13R1.28 CCCCOCOc1cncnn1 0905129c7ab270d4f072bc17030c370d [0,2,0,0,0,0|2,0,0]=4 11544 B13R1.28 CCCCOCOc1ncccn1 d8bb2628e0857c3363cea7a867b7ec7f [0,2,0,0,0,0|1,0,0]=3 11545 B13R1.28 CCCNC/C=C/c1ccccc1 0f131056fcef7b81d083ae6154c2f752 [0,2,0,0,0,0|1,0,1]=4 11546 B13R1.28 CCCNCCCc1ccccc1 5f33b3d16423cf0638bca02ea5d6c817 [0,2,0,0,0,0|1,0,0]=3 11547 B13R1.28 CCCNCCCc1ccccn1 736f00498b1c57aa3c18030daf0a5e40 [0,2,0,0,0,0|0,0,0]=2 11548 B13R1.28 CCCNCCCc1cccnc1 b885d3263dc883c7f7cac13987aaa14f [0,2,0,0,0,0|2,0,0]=4 11549 B13R1.28 CCCNCCCc1ccncc1 33397f42f6725a82191f046015021356 [0,2,0,0,0,0|2,0,0]=4 11550 B13R1.28 CCCNCCOc1ccccc1 06184b73079e1278e398ef36adb88360 [0,2,0,0,0,0|1,0,0]=3 11551 B13R1.28 CCCNCCOc1ccccn1 ca069553132cbd69b9536450ab2d33b1 [0,2,0,0,0,0|0,0,0]=2 11552 B13R1.28 CCCNCCOc1cccnc1 bcff883eb13097bbdb88baca399a8907 [0,2,0,0,0,0|2,0,0]=4 11553 B13R1.28 CCCOC/C=C/c1ccccc1 28247541af14b4d0978af4a7a31a6e56 [0,2,0,0,0,0|1,0,1]=4 11554 B13R1.28 CCCOC/C=C/c1ccccn1 7b15c6e010866fa64aeb12a5c6d7dc62 [0,2,0,0,0,0|0,0,1]=3 11555 B13R1.28 CCCOC/C=C\c1ccccc1 e2915b273a825531ccbc15ca740665c7 [0,2,0,0,0,0|1,0,1]=4 11556 B13R1.28 CCCOCC#Cc1ccccc1 9d6b84353a6b4c649668bd56f70765cb [0,2,0,0,0,0|1,0,1]=4 11557 B13R1.28 CCCOCC#Cc1ccccn1 4f63921b9965c5731b7c6b4bf5a1463e [0,2,0,0,0,0|0,0,1]=3 11558 B13R1.28 CCCOCC=Cc1ccccc1 7e801731f67fe56756a9b0772d9097db [0,2,0,0,0,0|1,0,1]=4 11559 B13R1.28 CCCOCCCC1=CCC=CC1 0e618e7d081ca3a205e1b9c0bc3c6605 [0,2,0,0,0,0|1,0,1]=4 11560 B13R1.28 CCCOCCCc1ccccc1 c076ca63eede7ffa17c8465c98023cf9 [0,2,0,0,0,0|1,0,0]=3 11561 B13R1.28 CCCOCCCc1ccccn1 d30f1210dbf9f0d178e907496ddfb5e2 [0,2,0,0,0,0|0,0,0]=2 11562 B13R1.28 CCCOCCCc1cccnc1 876197c7a9f77e0345c541594c748ea7 [0,2,0,0,0,0|2,0,0]=4 11563 B13R1.28 CCCOCCCc1ccncc1 2e28ea755e72a924d88c061f29c7cfd6 [0,2,0,0,0,0|2,0,0]=4 11564 B13R1.28 CCCOCCCc1cnccn1 c1ec608e9e41316750a426ba507708cc [0,2,0,0,0,0|1,0,0]=3 11565 B13R1.28 CCCOCCCc1ncccn1 365b4af2f70849a97de9bb69513fa002 [0,2,0,0,0,0|1,0,0]=3 11566 B13R1.28 CCCOCCNc1ccccc1 e211ec8e58646c8d8b6932bf2937cc35 [0,2,0,0,0,0|1,0,0]=3 11567 B13R1.28 CCCOCCNc1ccccn1 bf40e261dde7685f4d4792981807054a [0,2,0,0,0,0|0,0,0]=2 11568 B13R1.28 CCCOCCNc1cccnc1 436c716e1928c677f79e419e3943ff0a [0,2,0,0,0,0|2,0,0]=4 11569 B13R1.28 CCCOCCNc1cccnn1 c61ad2751a74a069114305c3d4fb1458 [0,2,0,0,0,0|1,0,0]=3 11570 B13R1.28 CCCOCCNc1ccncc1 534ebcb3907f14dd0f3edbadf9948e85 [0,2,0,0,0,0|2,0,0]=4 11571 B13R1.28 CCCOCCNc1ccncn1 89cb7578f508f93113cd28a19e3a6f2c [0,2,0,0,0,0|1,0,0]=3 11572 B13R1.28 CCCOCCNc1cnccn1 7ad638136458ad57d31400e561a3878d [0,2,0,0,0,0|1,0,0]=3 11573 B13R1.28 CCCOCCNc1cncnn1 7f15966175cda85223ae7dbbe480c5ed [0,2,0,0,0,0|2,0,0]=4 11574 B13R1.28 CCCOCCNc1cnncn1 b8236420442b73e08df1d581ae407bdb [0,2,0,0,0,0|2,0,0]=4 11575 B13R1.28 CCCOCCNc1ncccn1 aa1180bf4c838a4ab83b21948d959dc5 [0,2,0,0,0,0|1,0,0]=3 11576 B13R1.28 CCCOCCNc1nccnn1 330aaa3935519509c9f4c6b27d893832 [0,2,0,0,0,0|2,0,0]=4 11577 B13R1.28 CCCOCCNc1ncncn1 9689ac4020cc8aac0015dc81271c7a22 [0,2,0,0,0,0|2,0,0]=4 11578 B13R1.28 CCCOCCOc1ccccc1 3aa0f9a231fbc547c5dc537bd93c941d [0,2,0,0,0,0|1,0,0]=3 11579 B13R1.28 CCCOCCOc1ccccn1 40f7c903094682ce5283878321083496 [0,2,0,0,0,0|0,0,0]=2 11580 B13R1.28 CCCOCCOc1cccnc1 9910d5f59c86fb6a95f8da6bc1c2bf7a [0,2,0,0,0,0|2,0,0]=4 11581 B13R1.28 CCCOCCOc1ccncc1 e39a11a5e91b817ec965caf366e95821 [0,2,0,0,0,0|2,0,0]=4 11582 B13R1.28 CCCOCCOc1cnccn1 187e65862cfa61fb1f3636c72f06cc35 [0,2,0,0,0,0|1,0,0]=3 11583 B13R1.28 CCCOCCOc1cncnn1 3b66778e85f175a300791b22c6879876 [0,2,0,0,0,0|2,0,0]=4 11584 B13R1.28 CCCOCCOc1ncccn1 4143adf3affb86bb0891783bff3a2130 [0,2,0,0,0,0|1,0,0]=3 11585 B13R1.28 CCCOCCSc1ccccc1 d76a87a5dbcc7f9ae05dc56de64b2364 [0,2,0,0,0,0|1,0,0]=3 11586 B13R1.28 CCCOCCSc1ccccn1 85da77bfd743b0a20da89ae4051cbd91 [0,2,0,0,0,0|0,0,0]=2 11587 B13R1.28 CCNCC/C=C/c1ccccc1 e2a23c0864e33e9b2de6354a72cb9762 [0,2,0,0,0,0|1,0,1]=4 11588 B13R1.28 CCNCCCCc1ccccc1 0282fc60fa78241a55156a48d7ec01f1 [0,2,0,0,0,0|1,0,0]=3 11589 B13R1.28 CCNCCCCc1ccccn1 a832ea271b925377d62b0f3ab715dda6 [0,2,0,0,0,0|0,0,0]=2 11590 B13R1.28 CCNCCCOc1ccccc1 3727f99c3be5d27cfdb90b361ca95f52 [0,2,0,0,0,0|1,0,0]=3 11591 B13R1.28 CCNCCCOc1ccccn1 fee701232feda333b3ea6eda8f5f11e8 [0,2,0,0,0,0|0,0,0]=2 11592 B13R1.28 CCNCCCOc1cccnc1 fcba12104465b6cf3041943be9274091 [0,2,0,0,0,0|2,0,0]=4 11593 B13R1.28 CCNCCOCc1ccccc1 1510815a698923cadc0f69cbfb039804 [0,2,0,0,0,0|1,0,0]=3 11594 B13R1.28 CCNCCSSc1ccccn1 0c65cc0f638b08fb2b77a717a6952c55 [0,2,0,0,0,0|1,0,0]=3 11595 B13R1.28 CCOCCC#Cc1ccccc1 f69d5c48e5a018efc064d14595a591f7 [0,2,0,0,0,0|1,0,1]=4 11596 B13R1.28 CCOCCC#Cc1ccccn1 b4b1a9eaabf1df52fad5bad90d7e8429 [0,2,0,0,0,0|0,0,1]=3 11597 B13R1.28 CCOCCCCc1ccccc1 ea19cd42cab00d72c00f828af735e7ef [0,2,0,0,0,0|1,0,0]=3 11598 B13R1.28 CCOCCCCc1ccccn1 1d7ef2095639622a555d547edbb08c51 [0,2,0,0,0,0|0,0,0]=2 11599 B13R1.28 CCOCCCCc1cccnc1 a48db43d8f249931cd3b475ffb705964 [0,2,0,0,0,0|2,0,0]=4 11600 B13R1.28 CCOCCCCc1ccncc1 82750c58451969018ab35a6bc44b00c3 [0,2,0,0,0,0|2,0,0]=4 11601 B13R1.28 CCOCCCCc1cnccn1 9343b0bac9cf38ded0f1b90ff66b5b3f [0,2,0,0,0,0|1,0,0]=3 11602 B13R1.28 CCOCCCNc1ccccc1 f7037d100465397bc9870a07e0a6460f [0,2,0,0,0,0|1,0,0]=3 11603 B13R1.28 CCOCCCNc1ccccn1 35fcb2fac00caa5df52c9467048b2560 [0,2,0,0,0,0|0,0,0]=2 11604 B13R1.28 CCOCCCNc1cccnc1 5b13c9a67fd5aec8f1488de40a9139ad [0,2,0,0,0,0|2,0,0]=4 11605 B13R1.28 CCOCCCNc1cccnn1 c5339bd4218f625fc9d790cb51c1ed5c [0,2,0,0,0,0|1,0,0]=3 11606 B13R1.28 CCOCCCNc1ccncc1 5910bcf65e6aedb62a482a0a02c3c6ea [0,2,0,0,0,0|2,0,0]=4 11607 B13R1.28 CCOCCCNc1ccncn1 b62d91172ea24b46f4651f5afcbd5707 [0,2,0,0,0,0|1,0,0]=3 11608 B13R1.28 CCOCCCNc1cnccn1 7b2dd3f8476909efab84bd01c7d3b21c [0,2,0,0,0,0|1,0,0]=3 11609 B13R1.28 CCOCCCNc1cnncn1 d0e097c8941e18b972076298fc5e3dae [0,2,0,0,0,0|2,0,0]=4 11610 B13R1.28 CCOCCCNc1ncccn1 fd4451b296eafd40078db61a0aa726b2 [0,2,0,0,0,0|1,0,0]=3 11611 B13R1.28 CCOCCCNc1nccnn1 9d826e7a4c17b6cf23d33a87bcdae9a3 [0,2,0,0,0,0|2,0,0]=4 11612 B13R1.28 CCOCCCNc1ncncn1 9272c60698f177339199410bbb34f95f [0,2,0,0,0,0|2,0,0]=4 11613 B13R1.28 CCOCCCOc1ccccc1 7326db3541a7a8308790a9d6ce5fbce1 [0,2,0,0,0,0|1,0,0]=3 11614 B13R1.28 CCOCCCOc1ccccn1 931dc237c0a912c518eb5fd3c773b292 [0,2,0,0,0,0|0,0,0]=2 11615 B13R1.28 CCOCCCOc1cccnc1 11c3a9fdc9574103d954705056ce0816 [0,2,0,0,0,0|2,0,0]=4 11616 B13R1.28 CCOCCCOc1ccncc1 6185f58b94531f27184cfb83efb97caf [0,2,0,0,0,0|2,0,0]=4 11617 B13R1.28 CCOCCCOc1cnccn1 f3c45942b8972c7aa34791cad0d07c61 [0,2,0,0,0,0|1,0,0]=3 11618 B13R1.28 CCOCCCOc1cncnn1 3a406bfb22fd828f3e00d0382fb78352 [0,2,0,0,0,0|2,0,0]=4 11619 B13R1.28 CCOCCCOc1ncccn1 8b08305fe542b9c6cd7def77a21558fd [0,2,0,0,0,0|1,0,0]=3 11620 B13R1.28 CCOCCCSc1ccccc1 d995d954b5cf5746d4e00d02b32b007d [0,2,0,0,0,0|1,0,0]=3 11621 B13R1.28 CCOCCNCc1ccccc1 679ae42afd26804642891b83b0c87211 [0,2,0,0,0,0|1,0,0]=3 11622 B13R1.28 CCOCCNCc1ccccn1 ee1ffb8ae17272df677b09d3952e14de [0,2,0,0,0,0|0,0,0]=2 11623 B13R1.28 CCOCCNCc1cccnc1 e23c145ef5046d685fce449a7f480c4f [0,2,0,0,0,0|2,0,0]=4 11624 B13R1.28 CCOCCNCc1cccnn1 2f2f9516383b289816c696a17363433f [0,2,0,0,0,0|1,0,0]=3 11625 B13R1.28 CCOCCNCc1ccncc1 4adaec4e2ea87dad139808130442256f [0,2,0,0,0,0|2,0,0]=4 11626 B13R1.28 CCOCCNCc1ccncn1 a4542070c1269a1643518e4dc932482c [0,2,0,0,0,0|1,0,0]=3 11627 B13R1.28 CCOCCNCc1cnccn1 8b464375d58b9250198c0cba10ef797a [0,2,0,0,0,0|1,0,0]=3 11628 B13R1.28 CCOCCNCc1ncccn1 774d85828022b7a7a5610b07aa9df050 [0,2,0,0,0,0|1,0,0]=3 11629 B13R1.28 CCOCCOCc1ccccc1 0e4b7394449b597fb1689d77c822d1e4 [0,2,0,0,0,0|1,0,0]=3 11630 B13R1.28 CCOCCOCc1ccccn1 703848015482372a26f98e1a5b640b9c [0,2,0,0,0,0|0,0,0]=2 11631 B13R1.28 CCOCCOCc1cccnc1 f1a4aa299bd1069efc4a949dcffc4c72 [0,2,0,0,0,0|2,0,0]=4 11632 B13R1.28 CCOCCOCc1cccnn1 302ed3edd976cf4e502c0da1524ef3db [0,2,0,0,0,0|1,0,0]=3 11633 B13R1.28 CCOCCOCc1ccncc1 979e0a4c730a6570585b4f6e8881fbe0 [0,2,0,0,0,0|2,0,0]=4 11634 B13R1.28 CCOCCOCc1ccncn1 b504db30150e86d73b6ef9397be5c584 [0,2,0,0,0,0|1,0,0]=3 11635 B13R1.28 CCOCCOCc1cnccn1 e3e4f3a558ff9694b924ad49714eee83 [0,2,0,0,0,0|1,0,0]=3 11636 B13R1.28 CCOCCOCc1ncccn1 48d8b50ede267f87904e90abc69e2e05 [0,2,0,0,0,0|1,0,0]=3 11637 B13R1.28 CCOCCSCc1ccccc1 e5377b926ac9dc03580517e6b92fbe54 [0,2,0,0,0,0|1,0,0]=3 11638 B13R1.28 CCOCCSSc1ccccn1 e9561360447f3b299ac45a0b3aae9447 [0,2,0,0,0,0|1,0,0]=3 11639 B13R1.28 CCOCNCCc1ccccc1 fd2bb8bab8f3f676911889def8b946c8 [0,2,0,0,0,0|1,0,0]=3 11640 B13R1.28 CCOCNCCc1ccccn1 e30a88aecb6e125052d05eb73bc24c53 [0,2,0,0,0,0|0,0,0]=2 11641 B13R1.28 CCOCNCCc1cccnc1 790e844119a59419fe92858e542f77fc [0,2,0,0,0,0|2,0,0]=4 11642 B13R1.28 CCOCNCCc1ccncc1 58b5acc75822fca812cf99f7909b3243 [0,2,0,0,0,0|2,0,0]=4 11643 B13R1.28 CCOCNCCc1ccncn1 f4fe21c62cdc29a6de9e07f03a641f95 [0,2,0,0,0,0|1,0,0]=3 11644 B13R1.28 CCOCNCCc1cnccn1 c6c7a9aea546a5432e0461912cc7db63 [0,2,0,0,0,0|1,0,0]=3 11645 B13R1.28 CCOCNCCc1ncccn1 a5338572a3f20d51094e2707b9c2113f [0,2,0,0,0,0|1,0,0]=3 11646 B13R1.28 CCOCOCCc1ccccc1 6e706ae95e9bd277c3e539c0a4db03a7 [0,2,0,0,0,0|1,0,0]=3 11647 B13R1.28 CCOCOCCc1ccccn1 1feefac32e70d59ed7ab5b860b8f8892 [0,2,0,0,0,0|0,0,0]=2 11648 B13R1.28 CCOCOCCc1cccnc1 6307831f15fdb5e5edf3eda5e4d460a6 [0,2,0,0,0,0|2,0,0]=4 11649 B13R1.28 CCOCOCCc1ccncc1 af0b610389970d1e537a7ac78e8c0dce [0,2,0,0,0,0|2,0,0]=4 11650 B13R1.28 CCOCOCCc1ccncn1 60d96f265d48514f95277cb85e6f5049 [0,2,0,0,0,0|1,0,0]=3 11651 B13R1.28 CCOCOCCc1cnccn1 c9ba8142cf1d01f2fa264e49dcd06161 [0,2,0,0,0,0|1,0,0]=3 11652 B13R1.28 CCOCOCCc1ncccn1 156e29fe99114610c2614ccedd9ac71e [0,2,0,0,0,0|1,0,0]=3 11653 B13R1.28 CCSCCCNc1ccccc1 e25c7841146cdbd831103e2ade51ae85 [0,2,0,0,0,0|1,0,0]=3 11654 B13R1.28 CCSCCCNc1ccccn1 979f3c6a2957ce79c94a975e320ace03 [0,2,0,0,0,0|0,0,0]=2 11655 B13R1.28 CCSCCCNc1cccnc1 c5ac95670dc587fdfbcaa69a8fb1982a [0,2,0,0,0,0|2,0,0]=4 11656 B13R1.28 CCSCCCNc1cccnn1 b84a1946a9a86c7a98c8ecca18d82c49 [0,2,0,0,0,0|1,0,0]=3 11657 B13R1.28 CCSCCCNc1ccncc1 8031fec7e16e178f0ba484d9f9699ec8 [0,2,0,0,0,0|2,0,0]=4 11658 B13R1.28 CCSCCCNc1ccncn1 f999195db7a7676b836082f4720929d5 [0,2,0,0,0,0|1,0,0]=3 11659 B13R1.28 CCSCCCNc1cnccn1 a883493bf64d4031d6d4b6e58effc392 [0,2,0,0,0,0|1,0,0]=3 11660 B13R1.28 CCSCCCNc1cnncn1 dafd4cb1b1ed9613d7e4a6edd7b2d283 [0,2,0,0,0,0|2,0,0]=4 11661 B13R1.28 CCSCCCNc1ncccn1 176074a2edb97df6d35b8dde150a50d0 [0,2,0,0,0,0|1,0,0]=3 11662 B13R1.28 CCSCCCNc1nccnn1 d016748456aef6512d9a93fd3239caf7 [0,2,0,0,0,0|2,0,0]=4 11663 B13R1.28 CCSCCCNc1ncncn1 6be16ec9a499734fc97c75e60e95eee8 [0,2,0,0,0,0|2,0,0]=4 11664 B13R1.28 CCSCCCOc1ccccn1 63370f853bbb0a81f96d60257487f164 [0,2,0,0,0,0|0,0,0]=2 11665 B13R1.28 CCSCCCOc1cccnc1 3b7ecd33728062f9809c3af0648cd57b [0,2,0,0,0,0|2,0,0]=4 11666 B13R1.28 CCSCCCOc1ccncc1 e4bd88431e112269151a023397453a3f [0,2,0,0,0,0|2,0,0]=4 11667 B13R1.28 CCSCCCOc1cnccn1 bd3b985634296b80bcb1efe33d751833 [0,2,0,0,0,0|1,0,0]=3 11668 B13R1.28 CCSCCCOc1cncnn1 8364dab94bdfde084f4ae88e1cc4ef04 [0,2,0,0,0,0|2,0,0]=4 11669 B13R1.28 CCSCCCOc1ncccn1 08c94d255366fc91b9d2b38eec3cad81 [0,2,0,0,0,0|1,0,0]=3 11670 B13R1.28 CCSCCNCc1ccccc1 a1e613372ea8e8dc6aebf316f19b1ac6 [0,2,0,0,0,0|1,0,0]=3 11671 B13R1.28 CCSCCNCc1ccccn1 2776904a9938ca6454e5995d67f9dd1c [0,2,0,0,0,0|0,0,0]=2 11672 B13R1.28 CCSCCNCc1cccnc1 d4beafb5a171447468ec0b41fe2ced5c [0,2,0,0,0,0|2,0,0]=4 11673 B13R1.28 CCSCCNCc1cccnn1 c8454edb45fdccc0c9adc0b51b80bcc7 [0,2,0,0,0,0|1,0,0]=3 11674 B13R1.28 CCSCCNCc1ccncc1 7a4df5c8d6f1057f08e8b1144fe07658 [0,2,0,0,0,0|2,0,0]=4 11675 B13R1.28 CCSCCNCc1ccncn1 91bdf1eee45fd895f38e8fddc63a47f6 [0,2,0,0,0,0|1,0,0]=3 11676 B13R1.28 CCSCCNCc1cnccn1 e1b8bfdf879cffd8dd82c7a871e79564 [0,2,0,0,0,0|1,0,0]=3 11677 B13R1.28 CCSCCNCc1ncccn1 695e97a0d979b2bbe7474eebd3e4bf58 [0,2,0,0,0,0|1,0,0]=3 11678 B13R1.28 CCSCCOCc1ccccc1 892d64f9c9c2211c658e41916d24cd83 [0,2,0,0,0,0|1,0,0]=3 11679 B13R1.28 CCSCCOCc1ccccn1 f60f5598d670187e4d9f5579ffb0f24d [0,2,0,0,0,0|0,0,0]=2 11680 B13R1.28 CCSCCOCc1cccnc1 c025382c9c88c52eeea549af18fe5893 [0,2,0,0,0,0|2,0,0]=4 11681 B13R1.28 CCSCCOCc1cccnn1 d5cd8bde60c89d44fb3c2633142a8e3c [0,2,0,0,0,0|1,0,0]=3 11682 B13R1.28 CCSCCOCc1ccncc1 d5638ed089f9e230661298bf9bc55d95 [0,2,0,0,0,0|2,0,0]=4 11683 B13R1.28 CCSCCOCc1ccncn1 4d20616691117197175fb8b46d160dc5 [0,2,0,0,0,0|1,0,0]=3 11684 B13R1.28 CCSCCOCc1cnccn1 060a8a3ac8b314d5b5b503a364f51806 [0,2,0,0,0,0|1,0,0]=3 11685 B13R1.28 CCSCCOCc1ncccn1 d3dcfd51a08a8cfc2336a000a9681f14 [0,2,0,0,0,0|1,0,0]=3 11686 B13R1.28 COCCCCNc1ccccc1 2f5eb05f588d34eeb3c5f37bd21d4ce0 [0,2,0,0,0,0|1,0,0]=3 11687 B13R1.28 COCCCCNc1ccccn1 f9f7b2b059ced723a4b0cc5ed23b0c59 [0,2,0,0,0,0|0,0,0]=2 11688 B13R1.28 COCCCCNc1cccnc1 c6ebc50bfb6089c063aa4db131d99027 [0,2,0,0,0,0|2,0,0]=4 11689 B13R1.28 COCCCCNc1cccnn1 24f155a6c197f68ee5c9be7a248097da [0,2,0,0,0,0|1,0,0]=3 11690 B13R1.28 COCCCCNc1ccncc1 265b105003484b833649876cea8c7d87 [0,2,0,0,0,0|2,0,0]=4 11691 B13R1.28 COCCCCNc1ccncn1 261addedc433a6e29b687d42b763d2cc [0,2,0,0,0,0|1,0,0]=3 11692 B13R1.28 COCCCCNc1cnccn1 3dca1cc736c6a008a199b00b71bc38fc [0,2,0,0,0,0|1,0,0]=3 11693 B13R1.28 COCCCCNc1cnncn1 a97b06ed5a4d75f495f5344f0852ac8c [0,2,0,0,0,0|2,0,0]=4 11694 B13R1.28 COCCCCNc1ncccn1 cd4ad6222bb1bba8e198e228556a1a7f [0,2,0,0,0,0|1,0,0]=3 11695 B13R1.28 COCCCCNc1nccnn1 37b1d56f316aac76239ef196817fad1f [0,2,0,0,0,0|2,0,0]=4 11696 B13R1.28 COCCCCNc1ncncn1 b4ce56e66c44eab6457580fca026a22b [0,2,0,0,0,0|2,0,0]=4 11697 B13R1.28 COCCCCOc1ccccn1 91b5ce385a16d933bbf8a8d408ded633 [0,2,0,0,0,0|0,0,0]=2 11698 B13R1.28 COCCCCOc1cccnc1 f839815e843b970afb8aaa36c920d1e1 [0,2,0,0,0,0|2,0,0]=4 11699 B13R1.28 COCCCCOc1ccncc1 39dcc8d6fb19dec037581b8f3f000aa3 [0,2,0,0,0,0|2,0,0]=4 11700 B13R1.28 COCCCCOc1cnccn1 86d18e226b7b46722a85ed1c1fe28b34 [0,2,0,0,0,0|1,0,0]=3 11701 B13R1.28 COCCCCOc1cncnn1 c35dc9d17c3106f9749e6ef2b371dbee [0,2,0,0,0,0|2,0,0]=4 11702 B13R1.28 COCCCCOc1ncccn1 5f8ed3c497f1e6213b09dfa46d34a515 [0,2,0,0,0,0|1,0,0]=3 11703 B13R1.28 COCCCNCc1ccccc1 9d34ba6aabe9a19d73aceea3611c03cc [0,2,0,0,0,0|1,0,0]=3 11704 B13R1.28 COCCCNCc1ccccn1 a7adab1c153b0a66bfdba326b7beb6d2 [0,2,0,0,0,0|0,0,0]=2 11705 B13R1.28 COCCCNCc1cccnc1 4d5ae86127e62c7f3973777acb4c82a9 [0,2,0,0,0,0|2,0,0]=4 11706 B13R1.28 COCCCNCc1cccnn1 c4bee3aa75a933f37b38822ca28223ef [0,2,0,0,0,0|1,0,0]=3 11707 B13R1.28 COCCCNCc1ccncc1 1f53246ab30bbb81875da2a6ec8229c3 [0,2,0,0,0,0|2,0,0]=4 11708 B13R1.28 COCCCNCc1ccncn1 24df628807b5d1b3bb29d679689bbda7 [0,2,0,0,0,0|1,0,0]=3 11709 B13R1.28 COCCCNCc1cnccn1 cce694f1016c5faba78c79553dcbfe0c [0,2,0,0,0,0|1,0,0]=3 11710 B13R1.28 COCCCNCc1ncccn1 44815ee5d2483a8c26601861380146ed [0,2,0,0,0,0|1,0,0]=3 11711 B13R1.28 COCCCOCc1ccccc1 b2314cc7e18905a9d78f5fb2c3c5bf45 [0,2,0,0,0,0|1,0,0]=3 11712 B13R1.28 COCCCOCc1ccccn1 7dca33af7e30bea032471dfb3a1d450b [0,2,0,0,0,0|0,0,0]=2 11713 B13R1.28 COCCCOCc1cccnc1 8c738d8cb76c3fb1b380d0c957283dfa [0,2,0,0,0,0|2,0,0]=4 11714 B13R1.28 COCCCOCc1cccnn1 dc2a82d72c6afb80aa3947edeab4bfdd [0,2,0,0,0,0|1,0,0]=3 11715 B13R1.28 COCCCOCc1ccncc1 222bd47b9e17aee1cfb7ef7dd06aa3c7 [0,2,0,0,0,0|2,0,0]=4 11716 B13R1.28 COCCCOCc1ccncn1 ab565aeca97fb5b9a11d535dbf485e49 [0,2,0,0,0,0|1,0,0]=3 11717 B13R1.28 COCCCOCc1cnccn1 0d6256c36018c7f2b5a33921c58fd5bb [0,2,0,0,0,0|1,0,0]=3 11718 B13R1.28 COCCCOCc1ncccn1 e598a4ff779b227b89d2e8ab110dcc30 [0,2,0,0,0,0|1,0,0]=3 11719 B13R1.28 COCCNCCc1ccccc1 61123cdd1ab457a4a47f92c1a737f6db [0,2,0,0,0,0|1,0,0]=3 11720 B13R1.28 COCCNCCc1ccccn1 e471ba0a0ad542968e72d36be76605b8 [0,2,0,0,0,0|0,0,0]=2 11721 B13R1.28 COCCNCCc1cccnc1 b72f4f5b9a0e47b0f79d0057c209e043 [0,2,0,0,0,0|2,0,0]=4 11722 B13R1.28 COCCNCCc1ccncc1 7af66b49ba64920abc41d94715a089ea [0,2,0,0,0,0|2,0,0]=4 11723 B13R1.28 COCCNCCc1ccncn1 3151395b11f1db486a8178cf375170f8 [0,2,0,0,0,0|1,0,0]=3 11724 B13R1.28 COCCNCCc1cnccn1 1cc747e598d4cfa3fbce4613233ed30c [0,2,0,0,0,0|1,0,0]=3 11725 B13R1.28 COCCNCCc1ncccn1 ba2f187ee302d6fb1bbeb81671448c34 [0,2,0,0,0,0|1,0,0]=3 11726 B13R1.28 COCCNCSc1ccccc1 cc582b84bbc458216ef1894e27b28213 [0,2,0,0,0,0|2,0,0]=4 11727 B13R1.28 COCCOCCc1ccccc1 ff280801e717a5a4b5f2fea2891e4059 [0,2,0,0,0,0|1,0,0]=3 11728 B13R1.28 COCCOCCc1ccccn1 a1bfd613a1a5250ef9f05ea3f6721929 [0,2,0,0,0,0|0,0,0]=2 11729 B13R1.28 COCCOCCc1cccnc1 0d447fd80ca04e42c31eae7badf0c56d [0,2,0,0,0,0|2,0,0]=4 11730 B13R1.28 COCCOCCc1ccncc1 f08adba63b63755b7099f30db8fda45d [0,2,0,0,0,0|2,0,0]=4 11731 B13R1.28 COCCOCCc1ccncn1 8043bd35275dc9c393423ab8966c44b8 [0,2,0,0,0,0|1,0,0]=3 11732 B13R1.28 COCCOCCc1cnccn1 3a691c665ca20fd12edad1608256dbbf [0,2,0,0,0,0|1,0,0]=3 11733 B13R1.28 COCCOCCc1ncccn1 614f2600a6a694b8ec1f568532540a7c [0,2,0,0,0,0|1,0,0]=3 11734 B13R1.28 COCCOCNc1ccccc1 606fdc2185087b47674224b6a55ac681 [0,2,0,0,0,0|2,0,0]=4 11735 B13R1.28 COCCOCNc1ccccn1 2a28d3651fbf41c067c9370643983a07 [0,2,0,0,0,0|1,0,0]=3 11736 B13R1.28 COCCOCNc1cccnn1 83f32091c39cb32b3491eeb3cb8a68aa [0,2,0,0,0,0|2,0,0]=4 11737 B13R1.28 COCCOCNc1ccncn1 ac0ca3cc2a5337d1744ef3f0fc71e7fc [0,2,0,0,0,0|2,0,0]=4 11738 B13R1.28 COCCOCNc1cnccn1 922c5a3892635ff7b7bc44f44b2471de [0,2,0,0,0,0|2,0,0]=4 11739 B13R1.28 COCCOCNc1ncccn1 15501ea346aa84309a5f4130d6e84381 [0,2,0,0,0,0|2,0,0]=4 11740 B13R1.28 COCCOCOc1ccccn1 88f5f847a2f01ee9d175c07a91ceaf06 [0,2,0,0,0,0|1,0,0]=3 11741 B13R1.28 COCCOCOc1cnccn1 dd9034d132cd1ef2dc2dfb1e766c7e92 [0,2,0,0,0,0|2,0,0]=4 11742 B13R1.28 COCCOCOc1ncccn1 6fd20096d7e883d76ee8b76218f69308 [0,2,0,0,0,0|2,0,0]=4 11743 B13R1.28 COCCOCSc1ccccc1 02f6e2d349e7181991e3454bb316e523 [0,2,0,0,0,0|2,0,0]=4 11744 B13R1.28 COCNCCCc1ccccc1 ade12b517817d3289e0d4254cb033ebb [0,2,0,0,0,0|1,0,0]=3 11745 B13R1.28 COCNCCCc1ccccn1 20f08a827a27bf30079bd17f9c93164b [0,2,0,0,0,0|0,0,0]=2 11746 B13R1.28 COCNCCCc1cccnc1 051921682925411d720fac2af4a9ba2e [0,2,0,0,0,0|2,0,0]=4 11747 B13R1.28 COCNCCCc1ccncc1 e793a81e81175128e2b7e85d02c7afc4 [0,2,0,0,0,0|2,0,0]=4 11748 B13R1.28 COCNCCOc1ccccc1 5ba1fcd51da08f3878df18623bf9fad3 [0,2,0,0,0,0|2,0,0]=4 11749 B13R1.28 COCNCCOc1ccccn1 0fe3f85abb22d335cf47347dd80d6990 [0,2,0,0,0,0|1,0,0]=3 11750 B13R1.28 COCOC/C=C/c1ccccn1 b22dae3422c634dd6fa416f1bb8756d5 [0,2,0,0,0,0|0,0,2]=4 11751 B13R1.28 COCOCC#Cc1ccccn1 e6b4644466890c0d5f3f972b777cbac3 [0,2,0,0,0,0|0,0,2]=4 11752 B13R1.28 COCOCCCC1=CCC=CC1 2ad6f009adc974038652dcf8c8c9fd45 [0,2,0,0,0,0|1,0,1]=4 11753 B13R1.28 COCOCCCc1ccccc1 a22528d75a60855a8d4db005a26cbe47 [0,2,0,0,0,0|1,0,0]=3 11754 B13R1.28 COCOCCCc1ccccn1 4ac076232a6426ffc8b45e2438fa90a3 [0,2,0,0,0,0|0,0,0]=2 11755 B13R1.28 COCOCCCc1cccnc1 cef01d31fcbbccaf1e98d6e0a939f2eb [0,2,0,0,0,0|2,0,0]=4 11756 B13R1.28 COCOCCCc1ccncc1 9260609f7db0d5605fad37da3dc9fa64 [0,2,0,0,0,0|2,0,0]=4 11757 B13R1.28 COCOCCCc1cnccn1 aed6406a59b6c07d8c85bd07a5de03fa [0,2,0,0,0,0|1,0,0]=3 11758 B13R1.28 COCOCCCc1ncccn1 97ba0b1ce5dc95d718cbdfedd1941d55 [0,2,0,0,0,0|1,0,0]=3 11759 B13R1.28 COCOCCNc1ccccc1 caa9c6b3ac8569e31c4c4c137ec52f5a [0,2,0,0,0,0|2,0,0]=4 11760 B13R1.28 COCOCCNc1ccccn1 e8ab5f0e925b22439cff029f1ef576d2 [0,2,0,0,0,0|1,0,0]=3 11761 B13R1.28 COCOCCNc1cccnn1 a0e15d33f50aef1856baefbfb04757ce [0,2,0,0,0,0|2,0,0]=4 11762 B13R1.28 COCOCCNc1ccncn1 ccf0f9ddecd3244ac2d78c3e8decb547 [0,2,0,0,0,0|2,0,0]=4 11763 B13R1.28 COCOCCNc1cnccn1 cf4dbcf7a97f48ea9e840c38b9d94aad [0,2,0,0,0,0|2,0,0]=4 11764 B13R1.28 COCOCCNc1ncccn1 0ac5f62dc452cb6fb7db4400140cbf42 [0,2,0,0,0,0|2,0,0]=4 11765 B13R1.28 COCOCCOc1ccccc1 bf555a71e4f4c7e4a4a31d791cefe748 [0,2,0,0,0,0|2,0,0]=4 11766 B13R1.28 COCOCCOc1ccccn1 9d5c595454aace138877b6de50effab9 [0,2,0,0,0,0|1,0,0]=3 11767 B13R1.28 COCOCCOc1cnccn1 d318e5d8e4f2da57e74dc9e3ac4d787d [0,2,0,0,0,0|2,0,0]=4 11768 B13R1.28 COCOCCOc1ncccn1 dd3bf68a913f2d72afa7b2b427457989 [0,2,0,0,0,0|2,0,0]=4 11769 B13R1.28 COCOCCSc1ccccc1 58825ed83bb75567ea14ecefca050688 [0,2,0,0,0,0|2,0,0]=4 11770 B13R1.28 COCOCCSc1ccccn1 19fb23e03f92272f7454fa26346d8d02 [0,2,0,0,0,0|1,0,0]=3 11771 B13R1.28 COCOCSCc1ccccc1 7c6d5b323ca67a735b028348fd9a620e [0,2,0,0,0,0|2,0,0]=4 11772 B13R1.28 CSCCCCNc1ccccc1 4bc5adb305c61106204d8292741c71b4 [0,2,0,0,0,0|1,0,0]=3 11773 B13R1.28 CSCCCCNc1cccnc1 d0f0e5ceb32cb21c3c6d7deb4a99caf9 [0,2,0,0,0,0|2,0,0]=4 11774 B13R1.28 CSCCCCNc1cccnn1 121e60e7c5eddf41ebbf0c7bf22dcda0 [0,2,0,0,0,0|1,0,0]=3 11775 B13R1.28 CSCCCCNc1ccncc1 67a1f47d3412f1e3b552710dd407e949 [0,2,0,0,0,0|2,0,0]=4 11776 B13R1.28 CSCCCCNc1ccncn1 7e20fed65e7abeea80e399f374fc9db0 [0,2,0,0,0,0|1,0,0]=3 11777 B13R1.28 CSCCCNCc1ccccc1 42c45603daaf10a256a8dfddb403a13b [0,2,0,0,0,0|1,0,0]=3 11778 B13R1.28 CSCCCNCc1ccccn1 a113f57e7bd92e73d33549501c30d8fc [0,2,0,0,0,0|0,0,0]=2 11779 B13R1.28 CSCCCNCc1cccnc1 bb0ea981d0a9659b0957ad40f0c3977f [0,2,0,0,0,0|2,0,0]=4 11780 B13R1.28 CSCCCNCc1cccnn1 bbaea44b7b1825437e2d00d3f7c370d3 [0,2,0,0,0,0|1,0,0]=3 11781 B13R1.28 CSCCCNCc1ccncc1 9aeff6e685028084d428707c3f26a7de [0,2,0,0,0,0|2,0,0]=4 11782 B13R1.28 CSCCCNCc1ccncn1 806a71cfa1007c9d8a609938f517cd9d [0,2,0,0,0,0|1,0,0]=3 11783 B13R1.28 CSCCCNCc1cnccn1 d8df57ac3ceb40bdd82d28026afaab1f [0,2,0,0,0,0|1,0,0]=3 11784 B13R1.28 CSCCCNCc1ncccn1 9380d576b8f2fc638902de68f271a423 [0,2,0,0,0,0|1,0,0]=3 11785 B13R1.28 CSCCCOCc1ccccc1 141cb52f7ea1e2af27ad5c61b4835846 [0,2,0,0,0,0|1,0,0]=3 11786 B13R1.28 CSCCCOCc1ccccn1 7fce8632450d1d558cef39487394b3d9 [0,2,0,0,0,0|0,0,0]=2 11787 B13R1.28 CSCCCOCc1cccnc1 01bb8e8261f4e045403c1e2c4f738014 [0,2,0,0,0,0|2,0,0]=4 11788 B13R1.28 CSCCCOCc1cccnn1 24dcc44a07e599ffbd9b567b221c0a2c [0,2,0,0,0,0|1,0,0]=3 11789 B13R1.28 CSCCCOCc1ccncc1 51f1f6281599cf00eb021f0f16e2f983 [0,2,0,0,0,0|2,0,0]=4 11790 B13R1.28 CSCCCOCc1ccncn1 dd54763d8a2cc6cf319b70e4cf51b787 [0,2,0,0,0,0|1,0,0]=3 11791 B13R1.28 CSCCCOCc1cnccn1 628e1b83ff2cc77c848793dd30935782 [0,2,0,0,0,0|1,0,0]=3 11792 B13R1.28 CSCCCOCc1ncccn1 d28d8b72493fb2beb6972927ce2bfe4f [0,2,0,0,0,0|1,0,0]=3 11793 B13R1.28 CSCCNCCc1ccccc1 50681d35aa3eb6d4193e75f1dabcea2b [0,2,0,0,0,0|1,0,0]=3 11794 B13R1.28 CSCCNCCc1ccccn1 8ecd32cc6d00ec34f8354a78b2f3c7ab [0,2,0,0,0,0|0,0,0]=2 11795 B13R1.28 CSCCNCCc1cccnc1 9149cbf55fe87277e4d3b746b1d36fb8 [0,2,0,0,0,0|2,0,0]=4 11796 B13R1.28 CSCCNCCc1ccncc1 70b15fd1c559591e72ef3cabb4afe57a [0,2,0,0,0,0|2,0,0]=4 11797 B13R1.28 CSCCNCCc1ccncn1 47c8ffd04b36d8e3b25b31ec4e8d7603 [0,2,0,0,0,0|1,0,0]=3 11798 B13R1.28 CSCCNCCc1cnccn1 ffe19f2d97a3709b5b5f1b7d14fb8ff2 [0,2,0,0,0,0|1,0,0]=3 11799 B13R1.28 CSCCNCCc1ncccn1 ade615d0642f27624e04f574206c539a [0,2,0,0,0,0|1,0,0]=3 11800 B13R1.28 CSCCOCCc1ccccc1 a603d09f08b3e7c6ef1792818cc41cff [0,2,0,0,0,0|1,0,0]=3 11801 B13R1.28 CSCCOCCc1ccccn1 1856fb47a23823a5e409af168293c7a7 [0,2,0,0,0,0|0,0,0]=2 11802 B13R1.28 CSCCOCCc1cccnc1 1b90d2d6f527cea5046d2386ac7c4f8e [0,2,0,0,0,0|2,0,0]=4 11803 B13R1.28 CSCCOCCc1ccncc1 1515950dd87eb1d6e8b829b3487f2f03 [0,2,0,0,0,0|2,0,0]=4 11804 B13R1.28 CSCCOCCc1ccncn1 6d503a90978877f203258289172974ba [0,2,0,0,0,0|1,0,0]=3 11805 B13R1.28 CSCCOCCc1cnccn1 b07ecefd295514c854ab58934d039436 [0,2,0,0,0,0|1,0,0]=3 11806 B13R1.28 CSCCOCCc1ncccn1 5979d85ac87015d2734ab78701315bd6 [0,2,0,0,0,0|1,0,0]=3 11807 B13R1.28 CSCNCCCc1ccccc1 2cff81f377e2a84a76e69ccc0d1723a1 [0,2,0,0,0,0|1,0,0]=3 11808 B13R1.28 CSCNCCCc1ccccn1 5f1d8ce2e890983b9d5825f447b6d31a [0,2,0,0,0,0|0,0,0]=2 11809 B13R1.28 CSCNCCCc1cccnc1 6c0f2256375ff347cbb85db8fe804fdd [0,2,0,0,0,0|2,0,0]=4 11810 B13R1.28 CSCNCCCc1ccncc1 08bff316f491bbefa044b098a126da16 [0,2,0,0,0,0|2,0,0]=4 11811 B13R1.28 CSCNCCOc1ccccc1 85fe539b173efdbe18cce8ea2b18384c [0,2,0,0,0,0|2,0,0]=4 11812 B13R1.28 CSCNCCOc1ccccn1 410dfeb22db84ada89be1785cd53ff0b [0,2,0,0,0,0|1,0,0]=3 11813 B13R1.28 CSCOC/C=C/c1ccccn1 73e48d7b85064cb261b48d411f1bab0f [0,2,0,0,0,0|0,0,2]=4 11814 B13R1.28 CSCOCC#Cc1ccccn1 40e32728ee2b554d7395732089520f22 [0,2,0,0,0,0|0,0,2]=4 11815 B13R1.28 CSCOCCCC1=CCC=CC1 6867de54cb4d6a4a68ce927a11d7cffa [0,2,0,0,0,0|1,0,1]=4 11816 B13R1.28 CSCOCCCc1ccccc1 ba698fac1957235500dbde7fa95ab254 [0,2,0,0,0,0|1,0,0]=3 11817 B13R1.28 CSCOCCCc1ccccn1 0406ca65bcd13f2617aa5954f6a7d717 [0,2,0,0,0,0|0,0,0]=2 11818 B13R1.28 CSCOCCCc1cccnc1 7fa537417acb27ae11cfb6573b9c73dd [0,2,0,0,0,0|2,0,0]=4 11819 B13R1.28 CSCOCCCc1ccncc1 04418e8a083f3553be0b7058f145922e [0,2,0,0,0,0|2,0,0]=4 11820 B13R1.28 CSCOCCCc1cnccn1 d62c1f28edfff9dabdb6f301f9dc6115 [0,2,0,0,0,0|1,0,0]=3 11821 B13R1.28 CSCOCCCc1ncccn1 376ca7690087b82a6e314eaee7ae27ad [0,2,0,0,0,0|1,0,0]=3 11822 B13R1.28 CSCOCCOc1ccccc1 90c1ef192b469e6198695927b2ac9436 [0,2,0,0,0,0|2,0,0]=4 11823 B13R1.28 CSCOCCSc1ccccc1 00d1a35d25e9d8898bbc69bf2eb44662 [0,2,0,0,0,0|2,0,0]=4 11824 B13R1.28 CSCOCCSc1ccccn1 8653c710618cb7b34e3c25f6b15332ad [0,2,0,0,0,0|1,0,0]=3 11825 B13R1.28 Cl/C=C/CNCCc1ccccn1 c8ce00b22d8b73202d143b07d967f3ae [0,2,0,0,0,0|0,0,2]=4 11826 B13R1.28 Cl/C=C/COCCc1ccccn1 eb8b63e389953b609b6294b73631500a [0,2,0,0,0,0|0,0,2]=4 11827 B13R1.28 Cl/C=C\CNCCc1ccccn1 b7e7cf44a868428c5bde81930a128845 [0,2,0,0,0,0|0,0,2]=4 11828 B13R1.28 Cl/C=C\COCCc1ccccn1 12b1ddab1672294a141753701485cd06 [0,2,0,0,0,0|0,0,2]=4 11829 B13R1.28 ClC=CCOCCc1ccccn1 0f5fe56a1e35ce7b648f56ca594c9df4 [0,2,0,0,0,0|0,0,2]=4 11830 B13R1.28 ClCCCCCNc1ccccc1 c6ecde0e555ff6a799ee38d2f2708233 [0,2,0,0,0,0|1,0,0]=3 11831 B13R1.28 ClCCCCCNc1ccccn1 9c0f8116dd49429d3c52c50a5fad3a0b [0,2,0,0,0,0|0,0,0]=2 11832 B13R1.28 ClCCCCCNc1cccnc1 1e21404f17824943cfadec6c70fe71d0 [0,2,0,0,0,0|2,0,0]=4 11833 B13R1.28 ClCCCCCNc1cccnn1 d2483c8a19f83ebe6c81e0c0ed0ccaea [0,2,0,0,0,0|1,0,0]=3 11834 B13R1.28 ClCCCCCNc1ccncc1 11ec9ac265a573f810ec730c77965d3d [0,2,0,0,0,0|2,0,0]=4 11835 B13R1.28 ClCCCCCNc1ccncn1 31fe59b1191289f72a54fb1c71fbd62c [0,2,0,0,0,0|1,0,0]=3 11836 B13R1.28 ClCCCCCNc1cnccn1 4c268867ed1a20c836a5fd40ca1148a0 [0,2,0,0,0,0|1,0,0]=3 11837 B13R1.28 ClCCCCCNc1cncnn1 39ceb7a1525014c13e0c5bfd4e9a5dc2 [0,2,0,0,0,0|2,0,0]=4 11838 B13R1.28 ClCCCCCNc1ncccn1 3a46ff3fac51600064a20ae5a36b749a [0,2,0,0,0,0|1,0,0]=3 11839 B13R1.28 ClCCCCNCc1ccccc1 90736244ca15d92fd3a3077d1e2fc997 [0,2,0,0,0,0|1,0,0]=3 11840 B13R1.28 ClCCCCNCc1ccccn1 dbb7fc83a19e23eee6c5a8ff4ef354fc [0,2,0,0,0,0|0,0,0]=2 11841 B13R1.28 ClCCCCNCc1cccnc1 6822df730815d2e0b47e7e84d134c3f0 [0,2,0,0,0,0|2,0,0]=4 11842 B13R1.28 ClCCCCNCc1cccnn1 d1f8124ac4b00c815b2a1f5b0ebae017 [0,2,0,0,0,0|1,0,0]=3 11843 B13R1.28 ClCCCCNCc1ccncn1 9bef081b142d830e67cf6c1124c30028 [0,2,0,0,0,0|1,0,0]=3 11844 B13R1.28 ClCCCCNCc1ncccn1 66b99deef472c6610d2f4db570002b37 [0,2,0,0,0,0|1,0,0]=3 11845 B13R1.28 ClCCCNCCc1ccccc1 349b7a4cba969454c0cc0360422f4783 [0,2,0,0,0,0|1,0,0]=3 11846 B13R1.28 ClCCCNCCc1ccccn1 992a1675a2be4244f661d85cbb3c8d00 [0,2,0,0,0,0|0,0,0]=2 11847 B13R1.28 ClCCCNCCc1cccnc1 d333ae59124a4950d2c630166ea1255e [0,2,0,0,0,0|2,0,0]=4 11848 B13R1.28 ClCCCNCCc1ccncc1 dd0d05efa70b31f5ab383db4ddde2c73 [0,2,0,0,0,0|2,0,0]=4 11849 B13R1.28 ClCCCNCSc1ccccc1 c4987a1f7d5e366dd70c1195d64438ab [0,2,0,0,0,0|2,0,0]=4 11850 B13R1.28 FCCCCCNc1ccccc1 6979ef07ec2626a2af5f14792eff3d71 [0,2,0,0,0,0|1,0,0]=3 11851 B13R1.28 FCCCCCNc1ccccn1 7eacc34bab7e6fa1dfc3091509a299ff [0,2,0,0,0,0|0,0,0]=2 11852 B13R1.28 FCCCCCNc1cccnc1 efe887cb1412e0702fed36641dd3e436 [0,2,0,0,0,0|2,0,0]=4 11853 B13R1.28 FCCCCCNc1cccnn1 a4ee0ab985deff53f3b8d37309145b4a [0,2,0,0,0,0|1,0,0]=3 11854 B13R1.28 FCCCCCNc1ccncc1 993219913b601f0d844763370571998c [0,2,0,0,0,0|2,0,0]=4 11855 B13R1.28 FCCCCCNc1ccncn1 34cf567106f59d128c2822315b8a57a3 [0,2,0,0,0,0|1,0,0]=3 11856 B13R1.28 FCCCCCNc1cnccn1 5577133bbfeba931027eb9b7e6c4eeda [0,2,0,0,0,0|1,0,0]=3 11857 B13R1.28 FCCCCCNc1cnncn1 1cb1ebf2f82b840ec1dab66bffdc2629 [0,2,0,0,0,0|2,0,0]=4 11858 B13R1.28 FCCCCCNc1ncccn1 1d0b2be82a57f2d6421b95838a7a3c89 [0,2,0,0,0,0|1,0,0]=3 11859 B13R1.28 FCCCCCNc1nccnn1 4312bdf56e8594a74ab6630c826b5cf1 [0,2,0,0,0,0|2,0,0]=4 11860 B13R1.28 FCCCCCNc1ncncn1 95bedb0b2c83de3c7020579e56456b16 [0,2,0,0,0,0|2,0,0]=4 11861 B13R1.28 FCCCCCOc1ccccn1 cdb1caa92cec0e1074012f8dc023f156 [0,2,0,0,0,0|0,0,0]=2 11862 B13R1.28 FCCCCCOc1cccnc1 27050460746ba84083e03b5327164bc4 [0,2,0,0,0,0|2,0,0]=4 11863 B13R1.28 FCCCCCOc1ccncc1 6aa363d461ac6e4325380481294ef12c [0,2,0,0,0,0|2,0,0]=4 11864 B13R1.28 FCCCCCOc1cnccn1 985a6b2d212c2ae7568a7e3d2b9cab21 [0,2,0,0,0,0|1,0,0]=3 11865 B13R1.28 FCCCCCOc1cncnn1 3f04123ed6ea6901c3cd064d1173ba59 [0,2,0,0,0,0|2,0,0]=4 11866 B13R1.28 FCCCCCOc1ncccn1 394a564890f3a4bf80a4e8d0f095c0d4 [0,2,0,0,0,0|1,0,0]=3 11867 B13R1.28 FCCCCNCc1ccccc1 2404d7f858c2dcfc451d2fb270137d5a [0,2,0,0,0,0|1,0,0]=3 11868 B13R1.28 FCCCCNCc1ccccn1 90cee0a65ed5c7e5d9c8baa658c95f27 [0,2,0,0,0,0|0,0,0]=2 11869 B13R1.28 FCCCCNCc1cccnc1 f514f5375c5b10ab43613568d5c6d5dd [0,2,0,0,0,0|2,0,0]=4 11870 B13R1.28 FCCCCNCc1cccnn1 14ee0be4e94902c29be6f3389709d10c [0,2,0,0,0,0|1,0,0]=3 11871 B13R1.28 FCCCCNCc1ccncc1 b6c9d779e1ebe651dac476113fe263a2 [0,2,0,0,0,0|2,0,0]=4 11872 B13R1.28 FCCCCNCc1ccncn1 2bc62081f3756620f1c28085f53161e6 [0,2,0,0,0,0|1,0,0]=3 11873 B13R1.28 FCCCCNCc1cnccn1 1aa8cb0542e84b003145294d4b1644b6 [0,2,0,0,0,0|1,0,0]=3 11874 B13R1.28 FCCCCNCc1ncccn1 2046f2162b2de9c51ccc5f62cd7ef2fb [0,2,0,0,0,0|1,0,0]=3 11875 B13R1.28 FCCCCOCc1ccccc1 d0a25bd9ee98a1642a8c47d86db8d7c1 [0,2,0,0,0,0|1,0,0]=3 11876 B13R1.28 FCCCCOCc1ccccn1 42ef20a328ea5d0bfb79314a87aa5c6a [0,2,0,0,0,0|0,0,0]=2 11877 B13R1.28 FCCCCOCc1cccnc1 4252ece08472f0322618ac1f8988a605 [0,2,0,0,0,0|2,0,0]=4 11878 B13R1.28 FCCCCOCc1cccnn1 7dc682110d052eda77856401ef3f1537 [0,2,0,0,0,0|1,0,0]=3 11879 B13R1.28 FCCCCOCc1ccncc1 74c60ed62c8a40f63277c397bb01bcd1 [0,2,0,0,0,0|2,0,0]=4 11880 B13R1.28 FCCCCOCc1ccncn1 7e623f2ac8f0c2ec8549f4c9e0fb2bab [0,2,0,0,0,0|1,0,0]=3 11881 B13R1.28 FCCCCOCc1cnccn1 58fa5c748acbaed01ee6844cef59bdec [0,2,0,0,0,0|1,0,0]=3 11882 B13R1.28 FCCCCOCc1ncccn1 a0f53504b83c09d3cc6fe43c9c23e10f [0,2,0,0,0,0|1,0,0]=3 11883 B13R1.28 FCCCNCCc1ccccc1 95a7ed67182daebf812f6a52f4983814 [0,2,0,0,0,0|1,0,0]=3 11884 B13R1.28 FCCCNCCc1ccccn1 89a34315068f25b48a9ba4774efcb912 [0,2,0,0,0,0|0,0,0]=2 11885 B13R1.28 FCCCNCCc1cccnc1 9716c16da0fc154a446d44ea6c9cc4aa [0,2,0,0,0,0|2,0,0]=4 11886 B13R1.28 FCCCNCCc1ccncc1 fe9d05fa9f0858fc6a6aef379be6a2a0 [0,2,0,0,0,0|2,0,0]=4 11887 B13R1.28 FCCCNCCc1ccncn1 1c8cccbaeee65b401705160996fd1eea [0,2,0,0,0,0|1,0,0]=3 11888 B13R1.28 FCCCNCCc1cnccn1 125083a2bfaea18366ced10bf4ad2687 [0,2,0,0,0,0|1,0,0]=3 11889 B13R1.28 FCCCNCCc1ncccn1 b4b3974fda8603500a370ba8036c67ba [0,2,0,0,0,0|1,0,0]=3 11890 B13R1.28 FCCCOCCc1ccccc1 310cdeaa04912c9fbd1c7026a24a1ed3 [0,2,0,0,0,0|1,0,0]=3 11891 B13R1.28 FCCCOCCc1ccccn1 63c38b7fa49e0042f290b951ab1150f8 [0,2,0,0,0,0|0,0,0]=2 11892 B13R1.28 FCCCOCCc1cccnc1 e8990575a189f5f4f7b356e396bff1a5 [0,2,0,0,0,0|2,0,0]=4 11893 B13R1.28 FCCCOCCc1ccncc1 779211f1bfff9ef96697b4700e0ff7d2 [0,2,0,0,0,0|2,0,0]=4 11894 B13R1.28 FCCCOCCc1ccncn1 b6733e18e620ccc6b6bb6ab9ae77cf1a [0,2,0,0,0,0|1,0,0]=3 11895 B13R1.28 FCCCOCCc1cnccn1 9474ba7066f51d1ec1fe7a8f97e3519a [0,2,0,0,0,0|1,0,0]=3 11896 B13R1.28 FCCCOCCc1ncccn1 1f7b23a37d8d35d203f09d82f41b2973 [0,2,0,0,0,0|1,0,0]=3 11897 B13R1.28 FCCNCCCc1ccccc1 cff9ec332e4565e00203c9a9218e7809 [0,2,0,0,0,0|1,0,0]=3 11898 B13R1.28 FCCNCCCc1ccccn1 cbb3658da293145ea40608ae59fd5adb [0,2,0,0,0,0|0,0,0]=2 11899 B13R1.28 FCCNCCCc1cccnc1 2ea6d4f79856c022e19e3ff22a869673 [0,2,0,0,0,0|2,0,0]=4 11900 B13R1.28 FCCNCCCc1ccncc1 600a975c870c15662e5ae796e567485d [0,2,0,0,0,0|2,0,0]=4 11901 B13R1.28 FCCNCCOc1ccccc1 a25d58a1095a40517be1120aaa79cbd2 [0,2,0,0,0,0|2,0,0]=4 11902 B13R1.28 FCCNCCOc1ccccn1 d3abd947a05ba73a3d11c383ddcde212 [0,2,0,0,0,0|1,0,0]=3 11903 B13R1.28 FCCNCOCc1ccccc1 c1e967541f295b41defd3084c94c8662 [0,2,0,0,0,0|2,0,0]=4 11904 B13R1.28 FCCNCSCc1ccccc1 fcb193c37d91d035430132838289b079 [0,2,0,0,0,0|2,0,0]=4 11905 B13R1.28 FCCOC/C=C/c1ccccn1 f0f1f4e93ba46aa11ffdcc977ee6cf63 [0,2,0,0,0,0|0,0,2]=4 11906 B13R1.28 FCCOCC#Cc1ccccn1 6ae14b7ecdf65cd8f12739d79440d5a0 [0,2,0,0,0,0|0,0,2]=4 11907 B13R1.28 FCCOCCCC1=CCC=CC1 610f72297a10d31738301f85319ff2ea [0,2,0,0,0,0|1,0,1]=4 11908 B13R1.28 FCCOCCCc1ccccc1 e0925e41f379218fdb14d92265c58675 [0,2,0,0,0,0|1,0,0]=3 11909 B13R1.28 FCCOCCCc1ccccn1 a420db69b7fbacc37fcb39cee3f88152 [0,2,0,0,0,0|0,0,0]=2 11910 B13R1.28 FCCOCCCc1cccnc1 cf7e5085ca98e15da278cb6857353fda [0,2,0,0,0,0|2,0,0]=4 11911 B13R1.28 FCCOCCCc1ccncc1 31a241a94153aa5a30560ad8f987db26 [0,2,0,0,0,0|2,0,0]=4 11912 B13R1.28 FCCOCCCc1cnccn1 2dff4a23d772b05b3c585349ac16bd23 [0,2,0,0,0,0|1,0,0]=3 11913 B13R1.28 FCCOCCCc1ncccn1 fc1f28a8f70bbf955d202ae326a8b9df [0,2,0,0,0,0|1,0,0]=3 11914 B13R1.28 FCCOCCOc1ccccc1 12bf0f6f8d8cc5531af5bbeee76ef129 [0,2,0,0,0,0|2,0,0]=4 11915 B13R1.28 FCCOCCSc1ccccc1 edf104e0bd9709fed5f7029a9a50afb0 [0,2,0,0,0,0|2,0,0]=4 11916 B13R1.28 FCCOCCSc1ccccn1 1eb6170d9f78795f8147d089223a72bd [0,2,0,0,0,0|1,0,0]=3 11917 B13R1.28 FCCOCSCc1ccccc1 1726687a61e70012c2b9da125c001683 [0,2,0,0,0,0|2,0,0]=4 11918 B13R1.28 FCNCCCCc1ccccc1 af3ebd28c32ad52bcc3e60f29b4be4f2 [0,2,0,0,0,0|1,0,0]=3 11919 B13R1.28 FCNCCCCc1ccccn1 698e01ebf4f7a3f933c7d54b821834ea [0,2,0,0,0,0|0,0,0]=2 11920 B13R1.28 FCNCCCOc1ccccc1 3f39c1d248b312630983fb8fa0812f7c [0,2,0,0,0,0|2,0,0]=4 11921 B13R1.28 FCNCCCOc1ccccn1 a1e441beafa5e6edcbc0cf8adfc08ce9 [0,2,0,0,0,0|1,0,0]=3 11922 B13R1.28 FCNCCOCc1ccccc1 9e6fd216ce38b0cdb29a0546051cc9f3 [0,2,0,0,0,0|2,0,0]=4 11923 B13R1.28 FCOCCC#Cc1ccccn1 1b868792da7bb4267484d5af11f11a8e [0,2,0,0,0,0|0,0,2]=4 11924 B13R1.28 FCOCCCCc1ccccc1 df6e675bd5eae946e4592c9bdf607243 [0,2,0,0,0,0|1,0,0]=3 11925 B13R1.28 FCOCCCCc1ccccn1 4244a54439be7c5c276e6ea4891e02fe [0,2,0,0,0,0|0,0,0]=2 11926 B13R1.28 FCOCCCCc1cccnc1 5feda2af88d418b4f4ff3aef72090fa2 [0,2,0,0,0,0|2,0,0]=4 11927 B13R1.28 FCOCCCCc1ccncc1 ca5cf2c47f40179528f448f6bc2f4646 [0,2,0,0,0,0|2,0,0]=4 11928 B13R1.28 FCOCCCCc1cnccn1 9de37d1407ea09970800bd71dc8cd5f7 [0,2,0,0,0,0|1,0,0]=3 11929 B13R1.28 FCOCCCOc1ccccc1 b10b401514a0578346514a6b45eff062 [0,2,0,0,0,0|2,0,0]=4 11930 B13R1.28 FCOCCCOc1ccccn1 cbcd8baa77d77ca578a4d11bff116311 [0,2,0,0,0,0|1,0,0]=3 11931 B13R1.28 FCOCCCSc1ccccc1 c26389f6dc8e5c52f130664b6f24a83a [0,2,0,0,0,0|2,0,0]=4 11932 B13R1.28 FCOCCOCc1ccccc1 3ee67f05d9636d2623d3c26696ca2b2f [0,2,0,0,0,0|2,0,0]=4 11933 B13R1.28 FCOCCSCc1ccccc1 4f3e9920da92f4ef09851233064eb187 [0,2,0,0,0,0|2,0,0]=4 11934 B13R1.28 FCOCCSSc1ccccn1 77988d41563152f4079b435c78618421 [0,2,0,0,0,0|2,0,0]=4 11935 B13R1.28 IC#CCOCCc1ccccn1 7e101f1c91f38f1882ee947911b76dbc [0,2,0,0,0,0|0,0,2]=4 11936 B13R1.28 ICCNCCCc1ccccc1 aafcc01c32a54fc3702818c8c022424b [0,2,0,0,0,0|1,0,0]=3 11937 B13R1.28 ICCNCCCc1ccccn1 b45ad4d7cdf3b8a4740200a9f3aed2b6 [0,2,0,0,0,0|0,0,0]=2 11938 B13R1.28 ICCNCCCc1cccnc1 f6eadb11ff6bbed5412b5db2f8a1f887 [0,2,0,0,0,0|2,0,0]=4 11939 B13R1.28 ICCNCCCc1ccncc1 fb13382adc7e4e788de1a7e830779d38 [0,2,0,0,0,0|2,0,0]=4 11940 B13R1.28 ICCNCCOc1ccccc1 6c63ad6a8ab9e443b5ad1d4b5dbedc5d [0,2,0,0,0,0|2,0,0]=4 11941 B13R1.28 N#CCCCCNc1ccccc1 8593f09a2565182c2d625e83d98380c1 [0,2,0,0,0,0|1,0,1]=4 11942 B13R1.28 N#CCCCCNc1ccccn1 a96c0fcb0437de4a150cd5ebb31150db [0,2,0,0,0,0|0,0,1]=3 11943 B13R1.28 N#CCCCCNc1cccnn1 36a02b614c2dd8b7d22a92099c76e469 [0,2,0,0,0,0|1,0,1]=4 11944 B13R1.28 N#CCCCCNc1ccncn1 980fd37199bddad20ca476c4a775b8f1 [0,2,0,0,0,0|1,0,1]=4 11945 B13R1.28 N#CCCCCNc1cnccn1 745b905b854d437acd0f8a2437f39e15 [0,2,0,0,0,0|1,0,1]=4 11946 B13R1.28 N#CCCCCNc1ncccn1 29f5b7464307ce02d7461e4cce8462d1 [0,2,0,0,0,0|1,0,1]=4 11947 B13R1.28 N#CCCCCOc1ccccn1 2fbf8329b93e2a45d8cafdb42d4bb937 [0,2,0,0,0,0|0,0,1]=3 11948 B13R1.28 N#CCCCCOc1cnccn1 e0e8918f0af7f36197b95cd262e5dfa4 [0,2,0,0,0,0|1,0,1]=4 11949 B13R1.28 N#CCCCCOc1ncccn1 5dc9a8f3e14c69918144b246318bb2d5 [0,2,0,0,0,0|1,0,1]=4 11950 B13R1.28 N#CCCCNCc1ccccc1 77412c7d6d12ca4d1eb7d36fe8cd26e6 [0,2,0,0,0,0|1,0,1]=4 11951 B13R1.28 N#CCCCNCc1ccccn1 2812f7acc19844e3094c7896a09dca1b [0,2,0,0,0,0|0,0,1]=3 11952 B13R1.28 N#CCCCNCc1cccnn1 46788ff83fb0019ef721b83c86fc8142 [0,2,0,0,0,0|1,0,1]=4 11953 B13R1.28 N#CCCCNCc1ccncn1 114e97fba83d8a4a2b6ae5538305136b [0,2,0,0,0,0|1,0,1]=4 11954 B13R1.28 N#CCCCNCc1cnccn1 92cd9a73264b51a2142117db769a96a1 [0,2,0,0,0,0|1,0,1]=4 11955 B13R1.28 N#CCCCNCc1ncccn1 aa187fcb557a533e345d1792ed934fed [0,2,0,0,0,0|1,0,1]=4 11956 B13R1.28 N#CCCCOCc1ccccc1 ea084861e5e382cf83a2456567c11780 [0,2,0,0,0,0|1,0,1]=4 11957 B13R1.28 N#CCCCOCc1ccccn1 60bb3c4fba3e576a2976768ac92ff5af [0,2,0,0,0,0|0,0,1]=3 11958 B13R1.28 N#CCCCOCc1cccnn1 e1d7f5d90754e53a1d5b8f9094e1270c [0,2,0,0,0,0|1,0,1]=4 11959 B13R1.28 N#CCCCOCc1ccncn1 c9f3d546efcde1f4278d55a03a08148e [0,2,0,0,0,0|1,0,1]=4 11960 B13R1.28 N#CCCCOCc1cnccn1 a5ca2cb1a4df34b557ee86457ad33021 [0,2,0,0,0,0|1,0,1]=4 11961 B13R1.28 N#CCCCOCc1ncccn1 dd7970c8dec0fe4887b86d7cba39d3f0 [0,2,0,0,0,0|1,0,1]=4 11962 B13R1.28 N#CCCNCCc1ccccc1 f7daf2393b63a57ad4ad95afe5b1a5f1 [0,2,0,0,0,0|1,0,1]=4 11963 B13R1.28 N#CCCNCCc1ccccn1 d8be686ed80b9b4c7d54323d5b82e822 [0,2,0,0,0,0|0,0,1]=3 11964 B13R1.28 N#CCCNCCc1ccncn1 62743e71dd8d6ff8ce6be9246e938bad [0,2,0,0,0,0|1,0,1]=4 11965 B13R1.28 N#CCCNCCc1cnccn1 414398d662eb0934d6cc89241d3dbf07 [0,2,0,0,0,0|1,0,1]=4 11966 B13R1.28 N#CCCNCCc1ncccn1 ae3eaae4783f20d41a2e0a109bc71f1b [0,2,0,0,0,0|1,0,1]=4 11967 B13R1.28 N#CCCOCCc1ccccc1 b350e48b17731e24ef5c60f8e89fdbff [0,2,0,0,0,0|1,0,1]=4 11968 B13R1.28 N#CCCOCCc1ccccn1 98b447ab70d123ab09679f49f4f99263 [0,2,0,0,0,0|0,0,1]=3 11969 B13R1.28 N#CCCOCCc1ccncn1 18c51926cffaf8173e12793bc93cde24 [0,2,0,0,0,0|1,0,1]=4 11970 B13R1.28 N#CCCOCCc1cnccn1 55c672e9ef9007d0790e5247f138251a [0,2,0,0,0,0|1,0,1]=4 11971 B13R1.28 N#CCCOCCc1ncccn1 a773313a03bed346bcccfa1c37f05681 [0,2,0,0,0,0|1,0,1]=4 11972 B13R1.28 N#CCNCCCc1ccccc1 5d731191cf3d9baf15af1436a889a88f [0,2,0,0,0,0|1,0,1]=4 11973 B13R1.28 N#CCNCCCc1ccccn1 6413eb4231f0d76a5d450ad26066f17d [0,2,0,0,0,0|0,0,1]=3 11974 B13R1.28 N#CCNCCOc1ccccn1 15452a0c7b6f9d183ec43f8b61d97c83 [0,2,0,0,0,0|1,0,1]=4 11975 B13R1.28 N#CCOCCCc1ccccc1 e90a1750a8c4e1a2c43c555ea5f33be7 [0,2,0,0,0,0|1,0,1]=4 11976 B13R1.28 N#CCOCCCc1ccccn1 e18bff69145689bf1c7cd0711acfe64f [0,2,0,0,0,0|0,0,1]=3 11977 B13R1.28 N#CCOCCCc1cnccn1 137f5d3c4f73461e3edaa67d2455e41a [0,2,0,0,0,0|1,0,1]=4 11978 B13R1.28 N#CCOCCCc1ncccn1 31dffd5bdd83cd80e795c1dcb995c1a7 [0,2,0,0,0,0|1,0,1]=4 11979 B13R1.28 N#CCOCCNc1ccccn1 88f68a1d6feb9ce3626dff8a61ec5166 [0,2,0,0,0,0|1,0,1]=4 11980 B13R1.28 N#CCOCCOc1ccccn1 6d73db1d1aec2222cfda9cea0fb7af49 [0,2,0,0,0,0|1,0,1]=4 11981 B13R1.28 N#CCOCCSc1ccccn1 57ed80ecf485228f4fc664c8aee46716 [0,2,0,0,0,0|1,0,1]=4 11982 B13R1.28 N#CNCCCCc1ccccc1 a68d17f854d0e8f8c9cc287339ef2efe [0,2,0,0,0,0|1,0,1]=4 11983 B13R1.28 N#CSCOCCc1ccccn1 5d7c392421d50686e167331e9c809224 [0,2,0,0,0,0|1,0,1]=4 11984 B13R1.28 NOCCCCNc1ccccc1 0f5eb6dad0618ee7ac060dc2379541ef [0,2,0,0,0,0|2,0,0]=4 11985 B13R1.28 NOCCCCNc1ccccn1 5ed99e3c4a9e4ca4349f7fd4cf367b75 [0,2,0,0,0,0|1,0,0]=3 11986 B13R1.28 NOCCCCNc1cccnn1 def5986db5a73daa1398c98fa5f254d2 [0,2,0,0,0,0|2,0,0]=4 11987 B13R1.28 NOCCCCNc1ccncn1 7075fc72f827750245168539add72703 [0,2,0,0,0,0|2,0,0]=4 11988 B13R1.28 NOCCCCNc1cnccn1 725daa6405f98a8aafa6ea32c6539916 [0,2,0,0,0,0|2,0,0]=4 11989 B13R1.28 NOCCCCNc1ncccn1 c3df1a92629f1041cffecd0afae39feb [0,2,0,0,0,0|2,0,0]=4 11990 B13R1.28 NOCCNCCc1ccccc1 1fa151c595d76f621ab442c26b407574 [0,2,0,0,0,0|2,0,0]=4 11991 B13R1.28 NOCCNCCc1ccccn1 01a89099ed5373e5e721267a0a66617c [0,2,0,0,0,0|1,0,0]=3 11992 B13R1.28 O/C=C\CNCCc1ccccn1 0cd3a7f5e127b6e924bf9d13da0708a7 [0,2,0,0,0,0|0,0,2]=4 11993 B13R1.28 O=CCCCCNc1ccccc1 bf8094030d10db1652921c49ecb560ce [0,2,0,0,0,0|1,0,1]=4 11994 B13R1.28 O=CCCCCNc1ccccn1 eda82a030ba67ec55d90e2107f1d07de [0,2,0,0,0,0|0,0,1]=3 11995 B13R1.28 O=CCCCCNc1cccnn1 b14e9559376c5b6ded3f83d2e30c0706 [0,2,0,0,0,0|1,0,1]=4 11996 B13R1.28 O=CCCCCNc1ccncn1 d77a5f8d4412cf59a0173004954defcb [0,2,0,0,0,0|1,0,1]=4 11997 B13R1.28 O=CCCCCNc1cnccn1 930ff5f526cbe18efceff1ede3f6ef4f [0,2,0,0,0,0|1,0,1]=4 11998 B13R1.28 O=CCCCCNc1ncccn1 ded392e70be331f048f207dd70128f68 [0,2,0,0,0,0|1,0,1]=4 11999 B13R1.28 O=CCCCCOc1ccccn1 5a25ce025ec3201d83c23d2238c159fe [0,2,0,0,0,0|0,0,1]=3 12000 B13R1.28 O=CCCCCOc1cnccn1 5acef983ab9d47d5ba163b68cab09097 [0,2,0,0,0,0|1,0,1]=4 12001 B13R1.28 O=CCCCCOc1ncccn1 26b8426959a40323a22ac2c865b15a99 [0,2,0,0,0,0|1,0,1]=4 12002 B13R1.28 O=CCCCNCc1ccccc1 396f21ca73c44baaf22cb3f65b7f6de1 [0,2,0,0,0,0|1,0,1]=4 12003 B13R1.28 O=CCCCNCc1ccccn1 64b500e8d01da58fc3419517aed933ba [0,2,0,0,0,0|0,0,1]=3 12004 B13R1.28 O=CCCCNCc1cccnn1 f5658faa7835a14f63a57808056be16e [0,2,0,0,0,0|1,0,1]=4 12005 B13R1.28 O=CCCCNCc1ccncn1 b3ea9cd260c4cc6bb9adfec7cfd0672c [0,2,0,0,0,0|1,0,1]=4 12006 B13R1.28 O=CCCCNCc1cnccn1 d5c6ff7d42fe3b88a527a7b73f5f9a55 [0,2,0,0,0,0|1,0,1]=4 12007 B13R1.28 O=CCCCNCc1ncccn1 a58d2e16c322754c4a09a5a5200e2864 [0,2,0,0,0,0|1,0,1]=4 12008 B13R1.28 O=CCCCOCc1ccccc1 d2299cde4d970f725a5b88d59a622f9c [0,2,0,0,0,0|1,0,1]=4 12009 B13R1.28 O=CCCCOCc1ccccn1 03c04de6587441fe2105f60a43abc24a [0,2,0,0,0,0|0,0,1]=3 12010 B13R1.28 O=CCCCOCc1cccnn1 8209224f44a8a6b4f59b63dcab2688e4 [0,2,0,0,0,0|1,0,1]=4 12011 B13R1.28 O=CCCCOCc1ccncn1 becd2dc22958e50ad3a1594dcaa520a6 [0,2,0,0,0,0|1,0,1]=4 12012 B13R1.28 O=CCCCOCc1cnccn1 9956529892a54193cc2d101a8137999c [0,2,0,0,0,0|1,0,1]=4 12013 B13R1.28 O=CCCCOCc1ncccn1 0c85047b11b531507a9ccc432fbc294a [0,2,0,0,0,0|1,0,1]=4 12014 B13R1.28 O=CCCNCCc1ccccc1 db436ebf21453a036c7b2655a16faa3b [0,2,0,0,0,0|1,0,1]=4 12015 B13R1.28 O=CCCNCCc1ccccn1 3c93ffaee4845ac46fd724c24ac6159a [0,2,0,0,0,0|0,0,1]=3 12016 B13R1.28 O=CCCNCCc1ccncn1 9e1981dd00909c383cab9b4856776844 [0,2,0,0,0,0|1,0,1]=4 12017 B13R1.28 O=CCCNCCc1cnccn1 80b00312eac76d633f9b2222efef37aa [0,2,0,0,0,0|1,0,1]=4 12018 B13R1.28 O=CCCNCCc1ncccn1 1b3eaf2245f5531d5685ab619168c65a [0,2,0,0,0,0|1,0,1]=4 12019 B13R1.28 O=CCCOCCc1ccccc1 24102b35f760104c7b227800a2958db0 [0,2,0,0,0,0|1,0,1]=4 12020 B13R1.28 O=CCCOCCc1ccccn1 e700af01bb7d51c3ab6b080672ec678c [0,2,0,0,0,0|0,0,1]=3 12021 B13R1.28 O=CCCOCCc1ccncn1 1ad96c502f134b7fd8fb7436b80b3c6b [0,2,0,0,0,0|1,0,1]=4 12022 B13R1.28 O=CCCOCCc1cnccn1 440adf768e37ff2b39113ecc8ed4ada2 [0,2,0,0,0,0|1,0,1]=4 12023 B13R1.28 O=CCCOCCc1ncccn1 1e2a9df4c4fbdb2b80b459cdf82231d8 [0,2,0,0,0,0|1,0,1]=4 12024 B13R1.28 O=CCNCCCc1ccccc1 2fed10c8cf266d7ebf72ee4935306174 [0,2,0,0,0,0|1,0,1]=4 12025 B13R1.28 O=CCNCCCc1ccccn1 d0229dfb1be6f92acb42b3e4fa729611 [0,2,0,0,0,0|0,0,1]=3 12026 B13R1.28 O=CCNCCOc1ccccn1 a66e88761674c940dc291198eecee6dd [0,2,0,0,0,0|1,0,1]=4 12027 B13R1.28 O=CCOCCCc1ccccc1 b0c712950b9c0d6652a2631bb35b24a3 [0,2,0,0,0,0|1,0,1]=4 12028 B13R1.28 O=CCOCCCc1ccccn1 b98e8fc13a229597260514f96cc340fb [0,2,0,0,0,0|0,0,1]=3 12029 B13R1.28 O=CCOCCCc1cnccn1 cd8ef597295150a3829d56ba27f4a73f [0,2,0,0,0,0|1,0,1]=4 12030 B13R1.28 O=CCOCCCc1ncccn1 d480c07e1fdf88d2c03c94b8b4040c2b [0,2,0,0,0,0|1,0,1]=4 12031 B13R1.28 O=CCOCCNc1ccccn1 89f07615b14151ab00ceafe62fd54379 [0,2,0,0,0,0|1,0,1]=4 12032 B13R1.28 O=CCOCCOc1ccccn1 143be6c041f0e7bc80e4917cf114534c [0,2,0,0,0,0|1,0,1]=4 12033 B13R1.28 O=CCOCCSc1ccccn1 0d015b2b936079ea1f61f133a09e627d [0,2,0,0,0,0|1,0,1]=4 12034 B13R1.28 O=CNCCCCc1ccccc1 b2f67c85bbf2e52f6d4c0a02b220c884 [0,2,0,0,0,0|1,0,1]=4 12035 B13R1.28 O=CNCCCCc1ccccn1 21bb0b3457444a07527cf3c23bef1ef2 [0,2,0,0,0,0|0,0,1]=3 12036 B13R1.28 O=CNCCCOc1ccccn1 c7c2624fb0a65be5e6fc49b1fc26f824 [0,2,0,0,0,0|1,0,1]=4 12037 B13R1.28 O=CNCCOCc1ccccn1 a66b4cad242dc9a6a883b3c0fe549f43 [0,2,0,0,0,0|1,0,1]=4 12038 B13R1.28 O=COCCOCc1ccccn1 37052b83f8d1bea6eb8d615871645d0d [0,2,0,0,0,0|1,0,1]=4 12039 B13R1.28 OCC#CCNCc1ccccn1 76632053ec78eb4b26bd9f6672b94d3c [0,2,0,0,0,0|0,0,2]=4 12040 B13R1.28 OCCCCCNc1ccccc1 3703e8864ede01d8d44cbde375640e29 [0,2,0,0,0,0|1,0,0]=3 12041 B13R1.28 OCCCCCNc1ccccn1 7a2be6b5b37665951b2d5bb288e4c41d [0,2,0,0,0,0|0,0,0]=2 12042 B13R1.28 OCCCCCNc1cccnc1 82e36a03b68b7b46a4a40a43557c4fac [0,2,0,0,0,0|2,0,0]=4 12043 B13R1.28 OCCCCCNc1cccnn1 a9f8fcd2a13f41ba3a88d02bf6c5037a [0,2,0,0,0,0|1,0,0]=3 12044 B13R1.28 OCCCCCNc1ccncc1 080d99c88f73b21a41f243addab48950 [0,2,0,0,0,0|2,0,0]=4 12045 B13R1.28 OCCCCCNc1ccncn1 06f9369891a56ae0495ae3e8bd8a556a [0,2,0,0,0,0|1,0,0]=3 12046 B13R1.28 OCCCCCNc1cnccn1 fa6e88398b8b7b84a9767f8aa246a41b [0,2,0,0,0,0|1,0,0]=3 12047 B13R1.28 OCCCCCNc1cnncn1 8972f18258d85a6646fcdac124c7c6ce [0,2,0,0,0,0|2,0,0]=4 12048 B13R1.28 OCCCCCNc1ncccn1 8cc70c268da9d23628226eb305ee9755 [0,2,0,0,0,0|1,0,0]=3 12049 B13R1.28 OCCCCCNc1nccnn1 9d834d99eb59ea3604167647187041d2 [0,2,0,0,0,0|2,0,0]=4 12050 B13R1.28 OCCCCCNc1ncncn1 d3c58d94dad381c6e7b549aedcdea2d6 [0,2,0,0,0,0|2,0,0]=4 12051 B13R1.28 OCCCCNCc1ccccc1 143d3ff2bf83c896b064451a6b089da1 [0,2,0,0,0,0|1,0,0]=3 12052 B13R1.28 OCCCCNCc1ccccn1 030991a2a9710fc4ba8269c52394602f [0,2,0,0,0,0|0,0,0]=2 12053 B13R1.28 OCCCCNCc1cccnc1 d0741d88702d1bf891f8c5040bd23ad5 [0,2,0,0,0,0|2,0,0]=4 12054 B13R1.28 OCCCCNCc1cccnn1 1ee0635fb0b4cb4a4a48b5d8e348717e [0,2,0,0,0,0|1,0,0]=3 12055 B13R1.28 OCCCCNCc1ccncc1 011c3aae2ac2af0744ad57b9259a9523 [0,2,0,0,0,0|2,0,0]=4 12056 B13R1.28 OCCCCNCc1ccncn1 54b2165eda034dcbcb5f18c5b4007aa5 [0,2,0,0,0,0|1,0,0]=3 12057 B13R1.28 OCCCCNCc1cnccn1 17ec5482b9e2d27eb4eefd36d855023b [0,2,0,0,0,0|1,0,0]=3 12058 B13R1.28 OCCCCNCc1ncccn1 4ee86dae46b762a11bb8ec732f58b0bd [0,2,0,0,0,0|1,0,0]=3 12059 B13R1.28 OCCCNCCc1ccccc1 31cc75da7677f29e22dc021b342942ec [0,2,0,0,0,0|1,0,0]=3 12060 B13R1.28 OCCCNCCc1ccccn1 32eb74507c7af0d621f6f4c1963e12c8 [0,2,0,0,0,0|0,0,0]=2 12061 B13R1.28 OCCCNCCc1cccnc1 99d401e61acd15a70b2dd43f063c8225 [0,2,0,0,0,0|2,0,0]=4 12062 B13R1.28 OCCCNCCc1ccncc1 8a316e9f1e4886d755cb853b24d0daab [0,2,0,0,0,0|2,0,0]=4 12063 B13R1.28 OCCCNCCc1ccncn1 dd38314a4aa76fd765ec93ebb72184f6 [0,2,0,0,0,0|1,0,0]=3 12064 B13R1.28 OCCCNCCc1cnccn1 73f4dc3415fcda274fd19a1182e91445 [0,2,0,0,0,0|1,0,0]=3 12065 B13R1.28 OCCCNCCc1ncccn1 1b4e2e5209be6beec5c0e68c90b434ef [0,2,0,0,0,0|1,0,0]=3 12066 B13R1.28 OCCCNCSc1ccccc1 6a3191f18480470adae265289c4e8cfc [0,2,0,0,0,0|2,0,0]=4 12067 B13R1.28 OCCNCCCc1ccccc1 b484b7c2a241b78497c4056d5d03ad31 [0,2,0,0,0,0|1,0,0]=3 12068 B13R1.28 OCCNCCCc1ccccn1 15478510cb8674a6e25b8d3568b55f2f [0,2,0,0,0,0|0,0,0]=2 12069 B13R1.28 OCCNCCCc1cccnc1 14eacee1c2ef286a53dfacc63944e262 [0,2,0,0,0,0|2,0,0]=4 12070 B13R1.28 OCCNCCCc1ccncc1 06b6617969c6025486744f08c4c52b05 [0,2,0,0,0,0|2,0,0]=4 12071 B13R1.28 OCCNCCOc1ccccc1 2c56f221dafab9550d882a95f830bd7f [0,2,0,0,0,0|2,0,0]=4 12072 B13R1.28 OCCNCCOc1ccccn1 58cd4570815126248356c3d520ff5ec2 [0,2,0,0,0,0|1,0,0]=3 12073 B13R1.28 OCCNCSCc1ccccc1 8e0aa47b122c3ea5dd9c59849b2306ab [0,2,0,0,0,0|2,0,0]=4 12074 B13R1.28 OCCOCCNc1ccccc1 f01ba73a904e6cca8d1c122c52659605 [0,2,0,0,0,0|2,0,0]=4 12075 B13R1.28 OCCOCCNc1ccccn1 15c521b6d71965c8111c751ebc0aee5d [0,2,0,0,0,0|1,0,0]=3 12076 B13R1.28 OCCOCCNc1cccnn1 66a272344db813fdb25c0820175a6887 [0,2,0,0,0,0|2,0,0]=4 12077 B13R1.28 OCCOCCNc1ccncn1 4c570227e7b914628f69726cc351fec8 [0,2,0,0,0,0|2,0,0]=4 12078 B13R1.28 OCCOCCNc1cnccn1 d27646b0ce2dd6c0b70a516c89435bd0 [0,2,0,0,0,0|2,0,0]=4 12079 B13R1.28 OCCOCCNc1ncccn1 aa8b5a5ad77062267929b2ca6cd56853 [0,2,0,0,0,0|2,0,0]=4 12080 B13R1.28 OCCSCCNc1ccccc1 883f5ca75497d4cdece6fe58a4f94f9b [0,2,0,0,0,0|2,0,0]=4 12081 B13R1.28 OCCSCCNc1ccccn1 6ef0ebf37b2ff930c387ab3098e77de2 [0,2,0,0,0,0|1,0,0]=3 12082 B13R1.28 OCCSCCNc1cccnn1 078325b9686f0dfc65e51328a4a77a53 [0,2,0,0,0,0|2,0,0]=4 12083 B13R1.28 OCCSCCNc1ccncn1 923983fd301dc602ec252068bd2f34f5 [0,2,0,0,0,0|2,0,0]=4 12084 B13R1.28 OCNCCCCc1ccccc1 0dca3c0bea3432493cecd16e9c5bf401 [0,2,0,0,0,0|1,0,0]=3 12085 B13R1.28 OCNCCCCc1ccccn1 a9131d686e46f52e2529868147a221ef [0,2,0,0,0,0|0,0,0]=2 12086 B13R1.28 OCNCCCOc1ccccc1 ac53e18bca360d0f2178806411bc6ea8 [0,2,0,0,0,0|2,0,0]=4 12087 B13R1.28 OCNCCCOc1ccccn1 c3d2db7a1a9db1d50de3af9feb312128 [0,2,0,0,0,0|1,0,0]=3 12088 B13R1.28 OCNCCOCc1ccccc1 2841a6a140fe4143920215065f5784cd [0,2,0,0,0,0|2,0,0]=4 12089 B13R1.28 OCNCCSCc1ccccc1 deb18bb2c4ad92b6dd6f6f4c2386ade3 [0,2,0,0,0,0|2,0,0]=4 12090 B13R1.28 OCNCCSSc1ccccn1 f13ed39c82d6ba74629b39b50e4ea319 [0,2,0,0,0,0|2,0,0]=4 12091 B13R1.28 SCCCCNCc1ccccc1 3b08a730b1c5c3ee9d4cac0b6dee7102 [0,2,0,0,0,0|1,0,0]=3 12092 B13R1.28 SCCCCNCc1ccccn1 fd031e30071d9be246f5baa91a720ce5 [0,2,0,0,0,0|0,0,0]=2 12093 B13R1.28 SCCCCNCc1cccnc1 71e306c22a57f5a1fa1365588b7a4f8e [0,2,0,0,0,0|2,0,0]=4 12094 B13R1.28 SCCCCNCc1cccnn1 2dabdb0fcd120573c70a64fcf3f7b8ed [0,2,0,0,0,0|1,0,0]=3 12095 B13R1.28 SCCCCNCc1ccncn1 55438b191c4491bb08de6c6b9d49000f [0,2,0,0,0,0|1,0,0]=3 12096 B13R1.28 SCCCCNCc1ncccn1 6de0e52f97f4d2397f03da4ab90661c6 [0,2,0,0,0,0|1,0,0]=3 12097 B13R1.28 SCCCCOCc1ccccc1 c54a16ae6a3454def5d9cd9a56f5dc07 [0,2,0,0,0,0|1,0,0]=3 12098 B13R1.28 SCCCCOCc1ccccn1 d0c1bb820fbe7922bf03ace6a0e96da6 [0,2,0,0,0,0|0,0,0]=2 12099 B13R1.28 SCCCCOCc1cccnc1 d00598b43b152782521fc9d3122f64ed [0,2,0,0,0,0|2,0,0]=4 12100 B13R1.28 SCCCCOCc1cccnn1 829c1560cdc7f588d53e26470fff068b [0,2,0,0,0,0|1,0,0]=3 12101 B13R1.28 SCCCCOCc1ccncn1 e08f14c823ada69c2e7a85f591698b00 [0,2,0,0,0,0|1,0,0]=3 12102 B13R1.28 SCCCCOCc1ncccn1 884d2c7e7abf82e938fa32f6e521c731 [0,2,0,0,0,0|1,0,0]=3 12103 B13R1.28 SCCCNCCc1ccccc1 c7daf13b73faf2c7a326ea218e199d72 [0,2,0,0,0,0|1,0,0]=3 12104 B13R1.28 SCCCNCCc1ccccn1 e3dd9c74cf8c445fa6a7e2994eaecfc4 [0,2,0,0,0,0|0,0,0]=2 12105 B13R1.28 SCCCNCCc1cccnc1 f390d28887680fe0fa9c074dba4be85e [0,2,0,0,0,0|2,0,0]=4 12106 B13R1.28 SCCCNCCc1ccncc1 c1c70dd5e1a573bffe3650bcb49873d9 [0,2,0,0,0,0|2,0,0]=4 12107 B13R1.28 SCCCNCCc1ccncn1 7f7e74d1424e26a032f3cd86ff39a5e8 [0,2,0,0,0,0|1,0,0]=3 12108 B13R1.28 SCCCNCCc1cnccn1 97e7ee9f071198fd733335865622510a [0,2,0,0,0,0|1,0,0]=3 12109 B13R1.28 SCCCNCCc1ncccn1 9b9a63458ec83f3987096d7fa852b986 [0,2,0,0,0,0|1,0,0]=3 12110 B13R1.28 SCCCOCCc1ccccc1 de0b15ea71e4523c7421e65f8c83011e [0,2,0,0,0,0|1,0,0]=3 12111 B13R1.28 SCCCOCCc1ccccn1 8294d44d3ee2bf3ad1261a87165cc40d [0,2,0,0,0,0|0,0,0]=2 12112 B13R1.28 SCCCOCCc1cccnc1 7ecfbbe9b3b14ecb12233ddfe9be3662 [0,2,0,0,0,0|2,0,0]=4 12113 B13R1.28 SCCCOCCc1ccncc1 ed2ec98d8cda9a5f40dffa1d68aaf03d [0,2,0,0,0,0|2,0,0]=4 12114 B13R1.28 SCCCOCCc1ccncn1 5c7b146957ec32db1bd2a637201f8ad7 [0,2,0,0,0,0|1,0,0]=3 12115 B13R1.28 SCCCOCCc1cnccn1 8f5753065704a75ffd3185d937c4b674 [0,2,0,0,0,0|1,0,0]=3 12116 B13R1.28 SCCCOCCc1ncccn1 3405fab9c312aaeb7fd89c840678162b [0,2,0,0,0,0|1,0,0]=3 12117 B13R1.28 SCCNCCCc1ccccc1 40e4bad6b5404abcc1bcb0662613e4ff [0,2,0,0,0,0|1,0,0]=3 12118 B13R1.28 SCCNCCCc1ccccn1 5951e9622784d314b84431bf8dca4b93 [0,2,0,0,0,0|0,0,0]=2 12119 B13R1.28 SCCNCCCc1cccnc1 3dff2ff66108ee95032cd1a337447b38 [0,2,0,0,0,0|2,0,0]=4 12120 B13R1.28 SCCNCCCc1ccncc1 bc6a8f116fbd5e4f0145dd573596091d [0,2,0,0,0,0|2,0,0]=4 12121 B13R1.28 SCCNCCOc1ccccc1 fa3020f64f92bcb26f0b95cf1ad2223d [0,2,0,0,0,0|2,0,0]=4 12122 B13R1.28 SCCNCCOc1ccccn1 4600a877393ab58c4092b2613c14dc20 [0,2,0,0,0,0|1,0,0]=3 12123 B13R1.28 SCCOC/C=C/c1ccccn1 85fab6b5587980b4768f409c0f720239 [0,2,0,0,0,0|0,0,2]=4 12124 B13R1.28 SCCOCC#Cc1ccccn1 e53cae286bb5f1bc8cfddff13374db7d [0,2,0,0,0,0|0,0,2]=4 12125 B13R1.28 SCCOCCCC1=CCC=CC1 f14dea815be4f4f5c67da2e5bba24c53 [0,2,0,0,0,0|1,0,1]=4 12126 B13R1.28 SCCOCCCc1ccccc1 f7d853836bc2b5e33361009dc66072ec [0,2,0,0,0,0|1,0,0]=3 12127 B13R1.28 SCCOCCCc1ccccn1 35e0b89265ee2da2abea732d433d6a44 [0,2,0,0,0,0|0,0,0]=2 12128 B13R1.28 SCCOCCCc1cccnc1 9f367e10a00e29a29263284d87e542bc [0,2,0,0,0,0|2,0,0]=4 12129 B13R1.28 SCCOCCCc1ccncc1 200224575eac9bed10d19880f414fe4b [0,2,0,0,0,0|2,0,0]=4 12130 B13R1.28 SCCOCCCc1cnccn1 7b9015553388c98087e511eaeee6c743 [0,2,0,0,0,0|1,0,0]=3 12131 B13R1.28 SCCOCCCc1ncccn1 c7059b1f15a4c22c60b3ce7771eb5e84 [0,2,0,0,0,0|1,0,0]=3 12132 B13R1.28 SCCOCCNc1ccccc1 4e2e68c1fad3e9baea13b04385befa8f [0,2,0,0,0,0|2,0,0]=4 12133 B13R1.28 SCCOCCNc1ccccn1 9ff18e66288e61023140945bb1715aec [0,2,0,0,0,0|1,0,0]=3 12134 B13R1.28 SCCOCCNc1cccnn1 ffe3613dffe69b81fb9c66263521804d [0,2,0,0,0,0|2,0,0]=4 12135 B13R1.28 SCCOCCNc1ccncn1 b7a837871810552f38de29b952b27857 [0,2,0,0,0,0|2,0,0]=4 12136 B13R1.28 SCCOCCNc1cnccn1 05ea377721726e9582591883f5068deb [0,2,0,0,0,0|2,0,0]=4 12137 B13R1.28 SCCOCCNc1ncccn1 bb3e0d05ce7478eabe27e89c634f094d [0,2,0,0,0,0|2,0,0]=4 12138 B13R1.28 SCCOCCOc1ccccc1 3efd9316c964647f28cf89874689d65f [0,2,0,0,0,0|2,0,0]=4 12139 B13R1.28 SCCOCCSc1ccccc1 9ecc6a78cdb6c48d886b35bc46d71cc2 [0,2,0,0,0,0|2,0,0]=4 12140 B13R1.28 SCCOCCSc1ccccn1 96babba8bf96da76f6f50b8e6b563d94 [0,2,0,0,0,0|1,0,0]=3 12141 B13R1.28 SCCOCSCc1ccccc1 1de540835c718e8c74bec2b47bca2e32 [0,2,0,0,0,0|2,0,0]=4 12142 B13R1.42 C#CCC(C)OCc1ccccn1 a406730106335daff1d0a24c4caa5ebb [0,2,0,0,0,0|0,0,2]=4 12143 B13R1.42 C#CCN(C)CCc1ccccn1 f58d16434669f0725a662f7579200ca4 [0,2,0,0,0,0|0,0,2]=4 12144 B13R1.42 C/C=C/C(C)OCc1ccccn1 434d84f8ff614bcdfa6790207c9c1c2b [0,2,0,0,0,0|0,0,2]=4 12145 B13R1.42 C=CCC(C)CNc1ccccn1 865097c1ac11e8f2ac2810120cfbb14e [0,2,0,0,0,0|0,0,2]=4 12146 B13R1.42 C=CCC(C)COc1ccccn1 c6f1ff60fac56bf721a7e5e806c31762 [0,2,0,0,0,0|0,0,2]=4 12147 B13R1.42 C=CCC(C)OCc1ccccn1 be16601e5cbcb3072b3bda9c5e5564fa [0,2,0,0,0,0|0,0,2]=4 12148 B13R1.42 C=CCC(O)CNc1ccccn1 30e6ff4ff8cedefa69fc3d36967bcf83 [0,2,0,0,0,0|0,0,2]=4 12149 B13R1.42 C=CCN(C)CCc1ccccn1 acac44dfb824206a4fdc6fa5cefc49ef [0,2,0,0,0,0|0,0,2]=4 12150 B13R1.42 C=CC[C@@H](C)OCc1ccccn1 5dfe62c6a7113f8296059c20c63b108a [0,2,0,0,0,0|0,0,2]=4 12151 B13R1.42 C=CC[C@H](C)OCc1ccccn1 38afd8839e7c1c2a7fa1d19d63845d77 [0,2,0,0,0,0|0,0,2]=4 12152 B13R1.42 CC#CC(C)OCc1ccccn1 df357191567d37b74632f2a274be6a57 [0,2,0,0,0,0|0,0,2]=4 12153 B13R1.42 CC(CC#N)NCc1ccccn1 ed7099ef9e23d0dfc3ab1aa3c3f0d408 [0,2,0,0,0,0|1,0,1]=4 12154 B13R1.42 CC(CC#N)OCc1ccccn1 62700b93b1712051ff697402413b7307 [0,2,0,0,0,0|1,0,1]=4 12155 B13R1.42 CC(CCO)CNc1ccccc1 1cbf2b82d6cb29848f970040e61bb301 [0,2,0,0,0,0|2,0,0]=4 12156 B13R1.42 CC(CCO)CNc1cccnn1 56e56e0460ca6596292bdf6e9c95e492 [0,2,0,0,0,0|2,0,0]=4 12157 B13R1.42 CC(CCO)CNc1ccncn1 a219a4d194406e20bcc45694925423c7 [0,2,0,0,0,0|2,0,0]=4 12158 B13R1.42 CC(CCO)CNc1cnccn1 81b1d8ad31443f3d95c07f125942048d [0,2,0,0,0,0|2,0,0]=4 12159 B13R1.42 CC(CCO)NCc1ccccc1 2d704fb14f90482b2a98956731d04e1c [0,2,0,0,0,0|2,0,0]=4 12160 B13R1.42 CC(CCO)NCc1ccccn1 abf48fb665ce2ad89b750447079ee5b5 [0,2,0,0,0,0|1,0,0]=3 12161 B13R1.42 CC(CCO)NCc1cccnn1 b900286215b3db6f364972010c92b959 [0,2,0,0,0,0|2,0,0]=4 12162 B13R1.42 CC(CCO)NCc1ccncn1 39089afe08fbcf1cc062f697132ea403 [0,2,0,0,0,0|2,0,0]=4 12163 B13R1.42 CC(CCO)NCc1cnccn1 d4be5a81699315ed5708932ab1169667 [0,2,0,0,0,0|2,0,0]=4 12164 B13R1.42 CC(CCO)NCc1ncccn1 dd8962dc04ab5ee5d3a1e648cf20d5d1 [0,2,0,0,0,0|2,0,0]=4 12165 B13R1.42 CC(CCc1ccccc1)NCF a42e5b5f91b83e44d4ea6cb075865f9a [0,2,0,0,0,0|2,0,0]=4 12166 B13R1.42 CC(CCc1ccccc1)NCO 573731d8365bcd386dcb0a75723b31f9 [0,2,0,0,0,0|2,0,0]=4 12167 B13R1.42 CC(CCc1ccccc1)OCF b817527da136da6614558b4fdf8a884a [0,2,0,0,0,0|2,0,0]=4 12168 B13R1.42 CC=CC(C)OCc1ccccn1 90a320fb9a3e93a15ba2344ead4c3965 [0,2,0,0,0,0|0,0,2]=4 12169 B13R1.42 CCCC(=O)CNc1ccccc1 14fa6bc2c7e381d92dd1277d63e2ce6c [0,2,0,0,0,0|1,0,1]=4 12170 B13R1.42 CCCC(=O)CNc1ccccn1 6eaafb84ba24f0deec43216fcfd4d52c [0,2,0,0,0,0|0,0,1]=3 12171 B13R1.42 CCCC(=O)CNc1cccnn1 4a89fdf40c0abd24366944fba43c011b [0,2,0,0,0,0|1,0,1]=4 12172 B13R1.42 CCCC(=O)CNc1ccncn1 1d4bd5eb94c5604899c23f647f7d915f [0,2,0,0,0,0|1,0,1]=4 12173 B13R1.42 CCCC(=O)CNc1cnccn1 2e66236e0a3ead872cc933c2d3174272 [0,2,0,0,0,0|1,0,1]=4 12174 B13R1.42 CCCC(=O)CNc1ncccn1 5ae92b36d877933f892511f318e2647d [0,2,0,0,0,0|1,0,1]=4 12175 B13R1.42 CCCC(=O)COc1ccccn1 4a71fe748c5e0b431750c983ef85ebad [0,2,0,0,0,0|0,0,1]=3 12176 B13R1.42 CCCC(=O)COc1cnccn1 43b4e6766b90595ddb8e8dd3df8ea6f8 [0,2,0,0,0,0|1,0,1]=4 12177 B13R1.42 CCCC(=O)COc1ncccn1 399d9f1cf615b9e5e0af0aee5ac3ec72 [0,2,0,0,0,0|1,0,1]=4 12178 B13R1.42 CCCC(=O)NCc1ccccc1 7e7d5868199d05b9cf94b697a0fc3061 [0,2,0,0,0,0|1,0,1]=4 12179 B13R1.42 CCCC(=O)NCc1ccccn1 dce2c70219fa9d32d952f93749656667 [0,2,0,0,0,0|0,0,1]=3 12180 B13R1.42 CCCC(=O)NCc1cccnn1 98da3b09e262eb4d44508479896c5f22 [0,2,0,0,0,0|1,0,1]=4 12181 B13R1.42 CCCC(=O)NCc1ccncn1 3b26865d51b8dbd9d9826546431b4400 [0,2,0,0,0,0|1,0,1]=4 12182 B13R1.42 CCCC(=O)NCc1cnccn1 d1b176ad50b96cc892db7f18adfe09c9 [0,2,0,0,0,0|1,0,1]=4 12183 B13R1.42 CCCC(=O)NCc1ncccn1 7f6e103ccc18b3c0d75b804ef773e586 [0,2,0,0,0,0|1,0,1]=4 12184 B13R1.42 CCCC(=S)OCc1ccccc1 0ccd2c90c5f33303bada68347298f645 [0,2,0,0,0,0|1,0,1]=4 12185 B13R1.42 CCCC(=S)OCc1ccccn1 fff4954a189410c81ff95ab8ecabeceb [0,2,0,0,0,0|0,0,1]=3 12186 B13R1.42 CCCC(=S)OCc1cccnn1 ed18f16154f7d6997d96f7a1c3a16561 [0,2,0,0,0,0|1,0,1]=4 12187 B13R1.42 CCCC(=S)OCc1ccncn1 cd85cd67eebe7f47f663e336a57eb48f [0,2,0,0,0,0|1,0,1]=4 12188 B13R1.42 CCCC(=S)OCc1ncccn1 2e758f5383c099abeeb0ba93fe15eb5b [0,2,0,0,0,0|1,0,1]=4 12189 B13R1.42 CCCC(C)CNc1ccccc1 aceca67b9a8fe005c5366aac5e0a66b6 [0,2,0,0,0,0|1,0,0]=3 12190 B13R1.42 CCCC(C)CNc1ccccn1 0560692e416663f0ac279185bef51664 [0,2,0,0,0,0|0,0,0]=2 12191 B13R1.42 CCCC(C)CNc1cccnc1 837992370dd0d002479863207a876060 [0,2,0,0,0,0|2,0,0]=4 12192 B13R1.42 CCCC(C)CNc1cccnn1 c21c84bb0b5ac668442cd01befe2c59c [0,2,0,0,0,0|1,0,0]=3 12193 B13R1.42 CCCC(C)CNc1ccncc1 5c68330ca7d6554388acaf6d79eef487 [0,2,0,0,0,0|2,0,0]=4 12194 B13R1.42 CCCC(C)CNc1ccncn1 203b4a475a16393231ad4c17df2b30aa [0,2,0,0,0,0|1,0,0]=3 12195 B13R1.42 CCCC(C)CNc1cnccn1 ba0bfb56c648de9233a37c700b6b01ca [0,2,0,0,0,0|1,0,0]=3 12196 B13R1.42 CCCC(C)CNc1cnncn1 060736ad0c82313c298a133fbc311121 [0,2,0,0,0,0|2,0,0]=4 12197 B13R1.42 CCCC(C)CNc1ncccn1 590fd55b88d1aa5ea7ea5e33041760ab [0,2,0,0,0,0|1,0,0]=3 12198 B13R1.42 CCCC(C)CNc1nccnn1 68b554ea41e3ed901a105c640d769684 [0,2,0,0,0,0|2,0,0]=4 12199 B13R1.42 CCCC(C)CNc1ncncn1 2f0f4a364b4e55789dc3d5cf331559b3 [0,2,0,0,0,0|2,0,0]=4 12200 B13R1.42 CCCC(C)COc1ccccn1 12dacfbbf1b488afb20dfda8d54da262 [0,2,0,0,0,0|0,0,0]=2 12201 B13R1.42 CCCC(C)COc1cccnc1 cff1dfbd8ccf9528b38169c55db4083b [0,2,0,0,0,0|2,0,0]=4 12202 B13R1.42 CCCC(C)COc1ccncc1 2748013dffc496cc2a2bc136451a05f3 [0,2,0,0,0,0|2,0,0]=4 12203 B13R1.42 CCCC(C)COc1cnccn1 6df420d54f0b6224359fd0bde210c91f [0,2,0,0,0,0|1,0,0]=3 12204 B13R1.42 CCCC(C)COc1cncnn1 8b914d9618d3d02c6e996a7480ae0f65 [0,2,0,0,0,0|2,0,0]=4 12205 B13R1.42 CCCC(C)COc1ncccn1 d44f060acbde32db879299126691ff77 [0,2,0,0,0,0|1,0,0]=3 12206 B13R1.42 CCCC(C)NCc1ccccc1 53154217c268f5d0598e4e12f7d298bb [0,2,0,0,0,0|1,0,0]=3 12207 B13R1.42 CCCC(C)NCc1ccccn1 8d24e4762bc738925b72abf65fc6cce5 [0,2,0,0,0,0|0,0,0]=2 12208 B13R1.42 CCCC(C)NCc1cccnc1 119fbc39c8ee510532f331d1355a189c [0,2,0,0,0,0|2,0,0]=4 12209 B13R1.42 CCCC(C)NCc1cccnn1 0a83c03b6978b0df49d5dfe17688e3f4 [0,2,0,0,0,0|1,0,0]=3 12210 B13R1.42 CCCC(C)NCc1ccncc1 a4f93fded8b842efab6278a1555846f4 [0,2,0,0,0,0|2,0,0]=4 12211 B13R1.42 CCCC(C)NCc1ccncn1 0989b5ba538814749caf2dfc146fe6a0 [0,2,0,0,0,0|1,0,0]=3 12212 B13R1.42 CCCC(C)NCc1cnccn1 34168f10465571b35601ca9601f1988d [0,2,0,0,0,0|1,0,0]=3 12213 B13R1.42 CCCC(C)NCc1ncccn1 bf9976d85bbc7c1b82e47a4f5f55ca87 [0,2,0,0,0,0|1,0,0]=3 12214 B13R1.42 CCCC(C)OCc1ccccc1 62e10e03a43d42ba7fb192a9435404e6 [0,2,0,0,0,0|1,0,0]=3 12215 B13R1.42 CCCC(C)OCc1ccccn1 40f8e0befb3c172df16b70dd460301bf [0,2,0,0,0,0|0,0,0]=2 12216 B13R1.42 CCCC(C)OCc1cccnc1 765ca82df2a50c714805a125cffa66cc [0,2,0,0,0,0|2,0,0]=4 12217 B13R1.42 CCCC(C)OCc1cccnn1 0501c7e11df4c7729be11bad7550d4da [0,2,0,0,0,0|1,0,0]=3 12218 B13R1.42 CCCC(C)OCc1ccncc1 e5af9595f160bb0f6dbc05eda545a675 [0,2,0,0,0,0|2,0,0]=4 12219 B13R1.42 CCCC(C)OCc1ccncn1 b15fe564ddad5f0ca4588740b78d8083 [0,2,0,0,0,0|1,0,0]=3 12220 B13R1.42 CCCC(C)OCc1cnccn1 05d12ec53755e16f641f9cc61ff86009 [0,2,0,0,0,0|1,0,0]=3 12221 B13R1.42 CCCC(C)OCc1ncccn1 82b12d02b806503971c88f2d166f8a83 [0,2,0,0,0,0|1,0,0]=3 12222 B13R1.42 CCCC(O)CNc1ccccc1 220474775c6cbfc6d80aa13b0113711a [0,2,0,0,0,0|1,0,0]=3 12223 B13R1.42 CCCC(O)CNc1cccnc1 baf3d4e36ec25a42a269af9b16328b4c [0,2,0,0,0,0|2,0,0]=4 12224 B13R1.42 CCCC(O)CNc1ccncc1 897c97268b6b29513597479630ef8bf7 [0,2,0,0,0,0|2,0,0]=4 12225 B13R1.42 CCCC(O)CNc1ccncn1 b490324c70489c0c727fd888fe85330a [0,2,0,0,0,0|1,0,0]=3 12226 B13R1.42 CCCN(C)CCc1ccccc1 a41beb51cc343624f1c890785f4bdd38 [0,2,0,0,0,0|1,0,0]=3 12227 B13R1.42 CCCN(C)CCc1ccccn1 9d41cae91559775116f2c67bba968325 [0,2,0,0,0,0|0,0,0]=2 12228 B13R1.42 CCCN(C)CCc1cccnc1 96a3682f00487bb288ecb76c14cca66f [0,2,0,0,0,0|2,0,0]=4 12229 B13R1.42 CCCN(C)CCc1ccncc1 88ff6e856f3cadb879b79cc36f17ad55 [0,2,0,0,0,0|2,0,0]=4 12230 B13R1.42 CCC[C@@H](C)OCc1ccccc1 db98b5f2c49d1e3ddf209846b4784b59 [0,2,0,0,0,0|1,0,0]=3 12231 B13R1.42 CCC[C@@H](C)OCc1ccccn1 bd41dc578e8d2658484f7b46e8b4f85e [0,2,0,0,0,0|0,0,0]=2 12232 B13R1.42 CCC[C@@H](C)OCc1cccnc1 0944196062ba019cdaf80d334fab1ed2 [0,2,0,0,0,0|2,0,0]=4 12233 B13R1.42 CCC[C@@H](C)OCc1cccnn1 874f36a5129ea9d8f66822f37f2d9d27 [0,2,0,0,0,0|1,0,0]=3 12234 B13R1.42 CCC[C@@H](C)OCc1ccncn1 d621ad2d6bd5586f2be11631c26795ab [0,2,0,0,0,0|1,0,0]=3 12235 B13R1.42 CCC[C@@H](C)OCc1ncccn1 8b1f101c64ac07acbcbeb17f44971a2c [0,2,0,0,0,0|1,0,0]=3 12236 B13R1.42 CCC[C@H](C)NCc1ccccc1 d8804a42c825fa4b5c431612e37bfcee [0,2,0,0,0,0|1,0,0]=3 12237 B13R1.42 CCC[C@H](C)NCc1ccccn1 a8d17443222f253ff8727d9abec4ab0c [0,2,0,0,0,0|0,0,0]=2 12238 B13R1.42 CCC[C@H](C)NCc1cccnc1 76a990dd3013ec74d3737eb136989fe2 [0,2,0,0,0,0|2,0,0]=4 12239 B13R1.42 CCC[C@H](C)NCc1cccnn1 55ed363e25de777e1272c85a319636f1 [0,2,0,0,0,0|1,0,0]=3 12240 B13R1.42 CCC[C@H](C)NCc1ccncn1 27903b8ae949385c83394a88fe65fab2 [0,2,0,0,0,0|1,0,0]=3 12241 B13R1.42 CCC[C@H](C)NCc1ncccn1 ee216787ff6626c01c00a736f9e9fe47 [0,2,0,0,0,0|1,0,0]=3 12242 B13R1.42 CCC[C@H](C)OCc1ccccc1 8c3ca82fcc39937ab59845512a9cd17f [0,2,0,0,0,0|1,0,0]=3 12243 B13R1.42 CCC[C@H](C)OCc1ccccn1 02380f6eb798b82e0d812ea1d39d39b8 [0,2,0,0,0,0|0,0,0]=2 12244 B13R1.42 CCC[C@H](C)OCc1cccnc1 9b528b0f1eae4b8a214ed42e884e5e0e [0,2,0,0,0,0|2,0,0]=4 12245 B13R1.42 CCC[C@H](C)OCc1cccnn1 78bcda486b5fd5e0c030e75c867599bb [0,2,0,0,0,0|1,0,0]=3 12246 B13R1.42 CCC[C@H](C)OCc1ccncn1 284518d9ec8a44e9b456a659bb7c0882 [0,2,0,0,0,0|1,0,0]=3 12247 B13R1.42 CCC[C@H](C)OCc1ncccn1 a79dc9bb2677a3760a791824742ca116 [0,2,0,0,0,0|1,0,0]=3 12248 B13R1.42 CCNC(=O)CNc1ccccn1 92af30baef4429bd73ff2839a4a82c05 [0,2,0,0,0,0|1,0,1]=4 12249 B13R1.42 CCNC(=O)COc1ccccn1 3721a7671c12cb8c2b3a952ff37c46bb [0,2,0,0,0,0|1,0,1]=4 12250 B13R1.42 CCNC(C)CCc1ccccc1 3a85d48c04505575d5467bc0bd9af811 [0,2,0,0,0,0|1,0,0]=3 12251 B13R1.42 CCNC(C)COc1ccccc1 c3f5b985c1454f438bd9b054f4063300 [0,2,0,0,0,0|2,0,0]=4 12252 B13R1.42 CCN[C@@H](C)CCc1ccccc1 25cc2dcf1297b4ba66d4746337c79bd1 [0,2,0,0,0,0|1,0,0]=3 12253 B13R1.42 CCN[C@H](C)CCc1ccccc1 77d995264aa903f3deaa67a682fcce7b [0,2,0,0,0,0|1,0,0]=3 12254 B13R1.42 CCOC(=O)CNc1ccccn1 0dac23f5a6e3cd8859a05c0def4f8380 [0,2,0,0,0,0|1,0,1]=4 12255 B13R1.42 CCOC(=O)COc1ccccn1 3d73e6f9d883d2c4bb5211478057dd50 [0,2,0,0,0,0|1,0,1]=4 12256 B13R1.42 CCOC(C)CCc1ccccc1 23579034bfebccfffc6e55cea5f13e11 [0,2,0,0,0,0|1,0,0]=3 12257 B13R1.42 CCOC(C)CCc1ccncc1 37b6523f4f90b117462d88265ecf78ea [0,2,0,0,0,0|2,0,0]=4 12258 B13R1.42 CCOC(C)CNc1ccccc1 25fb120a0da31a70bf05e55af475fa7e [0,2,0,0,0,0|2,0,0]=4 12259 B13R1.42 CCOC(C)CNc1ccccn1 375c8e5ae5f4da551c655f4a49d77b1e [0,2,0,0,0,0|1,0,0]=3 12260 B13R1.42 CCOC(C)CNc1cccnn1 f16dde9fa1fa6f7752ab19e50daf05e1 [0,2,0,0,0,0|2,0,0]=4 12261 B13R1.42 CCOC(C)CNc1ccncn1 99cf3740b95b24adb1de5a012c34a419 [0,2,0,0,0,0|2,0,0]=4 12262 B13R1.42 CCOC(C)CNc1cnccn1 411148eb714e981f99df8131d8d5eae1 [0,2,0,0,0,0|2,0,0]=4 12263 B13R1.42 CCOC(C)CNc1ncccn1 a0d5827c652f8734c8c4497eca5e6c35 [0,2,0,0,0,0|2,0,0]=4 12264 B13R1.42 CCOC(C)COc1ccccc1 adadaa14ae1f0e2b1b62d0cb1c6d50e0 [0,2,0,0,0,0|2,0,0]=4 12265 B13R1.42 CCO[C@@H](C)CCc1ccccc1 b70a0a77f96b996d192896970f07f491 [0,2,0,0,0,0|1,0,0]=3 12266 B13R1.42 CCO[C@H](C)CCc1ccccc1 825f854f5bf562ec2e457866b3a4856f [0,2,0,0,0,0|1,0,0]=3 12267 B13R1.42 CN(CC#N)CCc1ccccn1 19073cb97aec933df98b4ae7cce792b3 [0,2,0,0,0,0|1,0,1]=4 12268 B13R1.42 CN(CC=O)CCc1ccccn1 b40eb0039034d399f721afb2ead598b2 [0,2,0,0,0,0|1,0,1]=4 12269 B13R1.42 CN(CCF)CCc1ccccc1 1781394fa8b0991b0b61fe822c9dd8d3 [0,2,0,0,0,0|2,0,0]=4 12270 B13R1.42 CN(CCF)CCc1ccccn1 ce0c1551ccb1a752e9301d7dfe2f0eb7 [0,2,0,0,0,0|1,0,0]=3 12271 B13R1.42 CN(CCO)CCc1ccccc1 4c669cc510b57787c8bc9fcbecf75376 [0,2,0,0,0,0|2,0,0]=4 12272 B13R1.42 CN(CCO)CCc1ccccn1 151354c1cac05e71f825dfc42a6dd998 [0,2,0,0,0,0|1,0,0]=3 12273 B13R1.42 CN(CCS)CCc1ccccc1 d45b47e6351da8dae4096dc30623fdf0 [0,2,0,0,0,0|2,0,0]=4 12274 B13R1.42 CN(CCS)CCc1ccccn1 5044cea88d6b8c3a06913f25295d2093 [0,2,0,0,0,0|1,0,0]=3 12275 B13R1.42 COCC(=O)CNc1ccccn1 374aebd16727974aa3e5709fc849a3c6 [0,2,0,0,0,0|1,0,1]=4 12276 B13R1.42 COCC(=O)COc1ccccn1 2bc17692a7fee93064fddb1822b0ef86 [0,2,0,0,0,0|1,0,1]=4 12277 B13R1.42 COCC(=O)NCc1ccccn1 45dd972e5c251449b5e523f93baf11e0 [0,2,0,0,0,0|1,0,1]=4 12278 B13R1.42 COCC(C)NCc1ccccc1 ab1fcc440d4cc521099d3de2f29d455a [0,2,0,0,0,0|2,0,0]=4 12279 B13R1.42 COCC(C)NCc1ccccn1 fbba32a546af650e758347c492f87417 [0,2,0,0,0,0|1,0,0]=3 12280 B13R1.42 COCC(C)NCc1cccnn1 9f8e5985e6dfb5e04434f93948a72116 [0,2,0,0,0,0|2,0,0]=4 12281 B13R1.42 COCC(C)NCc1ccncn1 07257c3f92840932daa5d0e11dfdf11a [0,2,0,0,0,0|2,0,0]=4 12282 B13R1.42 COCC(C)NCc1cnccn1 bbd0a2e8c1ec96950fec7ab3b90470ae [0,2,0,0,0,0|2,0,0]=4 12283 B13R1.42 COCC(C)NCc1ncccn1 38fafdcdfc0e6c61ae0c589c612b7bf7 [0,2,0,0,0,0|2,0,0]=4 12284 B13R1.42 COCC(C)OCc1ccccc1 11e0f0e823324ee028f381824ac985a0 [0,2,0,0,0,0|2,0,0]=4 12285 B13R1.42 COCC(C)OCc1ccccn1 474b94ea61fc08cf4221858761693ac2 [0,2,0,0,0,0|1,0,0]=3 12286 B13R1.42 COCC(C)OCc1cccnn1 68404a12d860dd86cf81a3f520189f8f [0,2,0,0,0,0|2,0,0]=4 12287 B13R1.42 COCC(C)OCc1ccncn1 d82bea67b3914fef36ea1dd42116bcb2 [0,2,0,0,0,0|2,0,0]=4 12288 B13R1.42 COCC(C)OCc1cnccn1 586ad135204bb68c0022f61813967695 [0,2,0,0,0,0|2,0,0]=4 12289 B13R1.42 COCC(C)OCc1ncccn1 669fab2ca72c06196856c1e16992b213 [0,2,0,0,0,0|2,0,0]=4 12290 B13R1.42 COCC(O)CNc1ccccc1 f022b89d713d4034f5740dbcffca3d88 [0,2,0,0,0,0|2,0,0]=4 12291 B13R1.42 COCC(O)CNc1ccccn1 d1e2e48f5e319919afbbe404e8d1bec4 [0,2,0,0,0,0|1,0,0]=3 12292 B13R1.42 COCC(O)CNc1cccnn1 1fea742ac00970dfe7ec4d5b7fb88929 [0,2,0,0,0,0|2,0,0]=4 12293 B13R1.42 COCC(O)CNc1ccncn1 f588ac9714d8c3be8d6c6af985745221 [0,2,0,0,0,0|2,0,0]=4 12294 B13R1.42 COCC(O)CNc1cnccn1 bbec0c17816558df7e3e2c51c9f81d6d [0,2,0,0,0,0|2,0,0]=4 12295 B13R1.42 COCC(O)CNc1ncccn1 fda013552ff4c6a4462d3aea9dfc9740 [0,2,0,0,0,0|2,0,0]=4 12296 B13R1.42 COCN(C)CCc1ccccc1 e7d3165b0b61bc462d79ae1576fa1ba9 [0,2,0,0,0,0|2,0,0]=4 12297 B13R1.42 COCN(C)CCc1ccccn1 33b281c25bc5b136c758322ee97fa4aa [0,2,0,0,0,0|1,0,0]=3 12298 B13R1.42 COC[C@@H](C)NCc1ccccc1 466a3931c5e490fb14677f149f8080c5 [0,2,0,0,0,0|2,0,0]=4 12299 B13R1.42 COC[C@@H](C)NCc1ccccn1 390011a03833c1d95593dffb83a8c05f [0,2,0,0,0,0|1,0,0]=3 12300 B13R1.42 COC[C@@H](C)NCc1cccnn1 79dfeac7f65072b365d611e27afd54ca [0,2,0,0,0,0|2,0,0]=4 12301 B13R1.42 COC[C@@H](C)NCc1ccncn1 4559f5aae98a9b3e1b51484001c9bd2b [0,2,0,0,0,0|2,0,0]=4 12302 B13R1.42 COC[C@@H](C)NCc1ncccn1 183965eda59199afc83d886cb294b427 [0,2,0,0,0,0|2,0,0]=4 12303 B13R1.42 COC[C@@H](C)OCc1ccccc1 51036b1f3c77dbee4e5edd16b8bd6bcb [0,2,0,0,0,0|2,0,0]=4 12304 B13R1.42 COC[C@@H](C)OCc1ccccn1 3734745c1fd39c4070ed933316bf0752 [0,2,0,0,0,0|1,0,0]=3 12305 B13R1.42 COC[C@@H](C)OCc1cccnn1 12d8ed0aa5e2e087695f101255be5f5c [0,2,0,0,0,0|2,0,0]=4 12306 B13R1.42 COC[C@@H](C)OCc1ccncn1 4a4be99b1f6ee5c54409d6182657fd02 [0,2,0,0,0,0|2,0,0]=4 12307 B13R1.42 COC[C@@H](C)OCc1ncccn1 78395d565514ce72a17089744f24202a [0,2,0,0,0,0|2,0,0]=4 12308 B13R1.42 COC[C@@H](O)CNc1ccccc1 f1b8b05560bc328fdc4c555a83140a6f [0,2,0,0,0,0|2,0,0]=4 12309 B13R1.42 COC[C@@H](O)CNc1cccnn1 24c00aed37dd127419361f873c863263 [0,2,0,0,0,0|2,0,0]=4 12310 B13R1.42 COC[C@@H](O)CNc1ccncn1 253afc16a4bd7ab1d05a8ee74c30b308 [0,2,0,0,0,0|2,0,0]=4 12311 B13R1.42 COC[C@@H](O)CNc1cnccn1 163120a0918b957a50c62c7e457d80eb [0,2,0,0,0,0|2,0,0]=4 12312 B13R1.42 COC[C@H](C)NCc1ccccc1 32f825cd017921b7836d59b7e65fd97a [0,2,0,0,0,0|2,0,0]=4 12313 B13R1.42 COC[C@H](C)NCc1ccccn1 fb24f8a64ec9cf1d71f0715db427cbfe [0,2,0,0,0,0|1,0,0]=3 12314 B13R1.42 COC[C@H](C)NCc1cccnn1 012569b11bb2f648c10783aaa8e8faee [0,2,0,0,0,0|2,0,0]=4 12315 B13R1.42 COC[C@H](C)NCc1ccncn1 94ca4fb904eea29cf7a3ae31f534f080 [0,2,0,0,0,0|2,0,0]=4 12316 B13R1.42 COC[C@H](C)NCc1ncccn1 90c8e676a4c3af2d97585625322dc42a [0,2,0,0,0,0|2,0,0]=4 12317 B13R1.42 COC[C@H](C)OCc1ccccc1 0e493f712feabde7b5d70b60c172f1a2 [0,2,0,0,0,0|2,0,0]=4 12318 B13R1.42 COC[C@H](C)OCc1ccccn1 a0c87ae3f9ce2d0266f8cf9bddbad11b [0,2,0,0,0,0|1,0,0]=3 12319 B13R1.42 COC[C@H](C)OCc1cccnn1 924facf8f3a226f659afbd4fe5cfdda2 [0,2,0,0,0,0|2,0,0]=4 12320 B13R1.42 COC[C@H](C)OCc1ccncn1 1d1c6b0b86a044eabccd0c7138505d81 [0,2,0,0,0,0|2,0,0]=4 12321 B13R1.42 COC[C@H](C)OCc1ncccn1 53709b965eff87025eae278333b6c2c6 [0,2,0,0,0,0|2,0,0]=4 12322 B13R1.42 CSCC(=O)NCc1ccccn1 a5226a1c1d201349da278c922b342f39 [0,2,0,0,0,0|1,0,1]=4 12323 B13R1.42 CSCC(C)OCc1ccccc1 c5047fc77e770d5b5eb9f1fcd10f510e [0,2,0,0,0,0|2,0,0]=4 12324 B13R1.42 CSCC(C)OCc1ccccn1 696a35e88b285b9bb56f192116eb1b9e [0,2,0,0,0,0|1,0,0]=3 12325 B13R1.42 CSCC(C)OCc1cccnn1 9db9092d6cba7814907e603b0dbf5069 [0,2,0,0,0,0|2,0,0]=4 12326 B13R1.42 CSCC(C)OCc1ccncn1 d81b1d05f439b47393a2c9d806f4e7fe [0,2,0,0,0,0|2,0,0]=4 12327 B13R1.42 CSCC(C)OCc1ncccn1 2ef9dc37b4808cd7721629278742ccab [0,2,0,0,0,0|2,0,0]=4 12328 B13R1.42 CSCN(C)CCc1ccccc1 9944bfe9badd870ea5b4a03d98255fd2 [0,2,0,0,0,0|2,0,0]=4 12329 B13R1.42 CSCN(C)CCc1ccccn1 8344131679c9e98e493f585533fa826d [0,2,0,0,0,0|1,0,0]=3 12330 B13R1.42 C[C@@H](CC#N)OCc1ccccn1 3f0a23af7b946d83c6966f17dce6caa5 [0,2,0,0,0,0|1,0,1]=4 12331 B13R1.42 C[C@@H](CCO)NCc1ccccc1 bc3866dbf49e39f228cb674cbc1bec8b [0,2,0,0,0,0|2,0,0]=4 12332 B13R1.42 C[C@@H](CCO)NCc1ccccn1 709c790ae075267f9ebb731e9c9319ac [0,2,0,0,0,0|1,0,0]=3 12333 B13R1.42 C[C@@H](CCO)NCc1cccnn1 46ab1b2574f318bbfcd4ca5d3556d25d [0,2,0,0,0,0|2,0,0]=4 12334 B13R1.42 C[C@@H](CCO)NCc1ccncn1 c96d2a2a2b5e007ed7bfad289059c4c1 [0,2,0,0,0,0|2,0,0]=4 12335 B13R1.42 C[C@@H](CCO)NCc1ncccn1 d462faf07737822cfffa944e8a300cc0 [0,2,0,0,0,0|2,0,0]=4 12336 B13R1.42 C[C@@H](CCc1ccccc1)NCF 141464051b59054dc947b79a37fab287 [0,2,0,0,0,0|2,0,0]=4 12337 B13R1.42 C[C@@H](CCc1ccccc1)NCO 3759c1278ce61f38b6db3ceb186b0f09 [0,2,0,0,0,0|2,0,0]=4 12338 B13R1.42 C[C@@H](CCc1ccccc1)OCF 2d7573a53a25a898551f872deb413ea5 [0,2,0,0,0,0|2,0,0]=4 12339 B13R1.42 C[C@H](CC#N)OCc1ccccn1 79aeb0e1e6f833e42c3a8ffaca1d0dca [0,2,0,0,0,0|1,0,1]=4 12340 B13R1.42 C[C@H](CCO)NCc1ccccc1 8b0dda9ac626523e27cea0e3830dbd74 [0,2,0,0,0,0|2,0,0]=4 12341 B13R1.42 C[C@H](CCO)NCc1ccccn1 ab0361bf5768167e6335736fcf2caf20 [0,2,0,0,0,0|1,0,0]=3 12342 B13R1.42 C[C@H](CCO)NCc1cccnn1 3e03f26485eeb2e9291248ef09d92cc0 [0,2,0,0,0,0|2,0,0]=4 12343 B13R1.42 C[C@H](CCO)NCc1ccncn1 5372f0041d22c840ed68c752f6c971b6 [0,2,0,0,0,0|2,0,0]=4 12344 B13R1.42 C[C@H](CCO)NCc1ncccn1 a5418dd0deda41c70c2edd2abc418756 [0,2,0,0,0,0|2,0,0]=4 12345 B13R1.42 C[C@H](CCc1ccccc1)NCF 4e263f3ce53cc0768d172f1bde7fa992 [0,2,0,0,0,0|2,0,0]=4 12346 B13R1.42 C[C@H](CCc1ccccc1)NCO 2e4b0b7de21d868ecf19e6198b53feec [0,2,0,0,0,0|2,0,0]=4 12347 B13R1.42 C[C@H](CCc1ccccc1)OCF e1ee46cdd9db3dc0e9789b0183a6b30c [0,2,0,0,0,0|2,0,0]=4 12348 B13R1.42 N#CCC(O)CNc1ccccn1 5cc9eb3b0a3aeb8e76d00b96afd9e61f [0,2,0,0,0,0|1,0,1]=4 12349 B13R1.42 N#CC[C@@H](O)CNc1ccccn1 b514b230deea1fdce5f17b86f299c871 [0,2,0,0,0,0|1,0,1]=4 12350 B13R1.42 N#CC[C@H](O)CNc1ccccn1 d7a053b63efa998abab06027f1254e87 [0,2,0,0,0,0|1,0,1]=4 12351 B13R1.42 O=C(CCF)NCc1ccccn1 2aff02a03355b1ebc6c8832b40fc05e2 [0,2,0,0,0,0|1,0,1]=4 12352 B13R1.42 O=C(CCO)NCc1ccccn1 9076e7d32eec9d2921fb28fdd708c0c1 [0,2,0,0,0,0|1,0,1]=4 12353 B13R1.42 O=C(CCS)NCc1ccccn1 438a7429fd2b322f3f26c3ad00b61988 [0,2,0,0,0,0|1,0,1]=4 12354 B13R1.42 OCC[C@H](O)COc1ccccn1 74d0d5ffbe4d5e0e6988767159b72fa9 [0,2,0,0,0,0|1,0,0]=3 12355 B13R1.42 OCC[C@H](O)COc1cnccn1 cee0aa582356e262eddabcc79c6c9ece [0,2,0,0,0,0|2,0,0]=4 12356 B13R1.42 OCC[C@H](O)COc1ncccn1 12128230817eff46992da86b59eaa4a8 [0,2,0,0,0,0|2,0,0]=4 12357 B13R1.44 C#CCCN(C)Cc1ccccn1 bb849a8b56eca3f42cb6cfed9c8a4f6e [0,2,0,0,0,0|0,0,2]=4 12358 B13R1.44 C#CCNC(C)Cc1ccccn1 9a3f7b9011e35483503e7398f429c39d [0,2,0,0,0,0|0,0,2]=4 12359 B13R1.44 C#CCOC(C)Cc1ccccn1 6e73427ad7449d1eefda67cb2ae6b079 [0,2,0,0,0,0|0,0,2]=4 12360 B13R1.44 C/C=C/CN(C)Cc1ccccn1 4dabbaeb8ab23d3b94d5102b2c57d6aa [0,2,0,0,0,0|0,0,2]=4 12361 B13R1.44 C/C=C\CN(C)Cc1ccccn1 661fb9b3d7b906d09103a8fab852bc0c [0,2,0,0,0,0|0,0,2]=4 12362 B13R1.44 C=CCCC(C)Nc1ccccn1 84efb9c48f1ddf315941ab6aa7ed871b [0,2,0,0,0,0|0,0,2]=4 12363 B13R1.44 C=CCCC(C)Oc1ccccn1 6dcab05d157231fbd669bf78458dce11 [0,2,0,0,0,0|0,0,2]=4 12364 B13R1.44 C=CCCN(C)Cc1ccccn1 12d3dbf5c92e6853dca1d6471491ef8b [0,2,0,0,0,0|0,0,2]=4 12365 B13R1.44 C=CCNC(C)Cc1ccccn1 29157b676bab3bfbd1de0c67396e0241 [0,2,0,0,0,0|0,0,2]=4 12366 B13R1.44 C=CCOC(C)Cc1ccccn1 71aaf916f6b3b1e16489983dbd6def59 [0,2,0,0,0,0|0,0,2]=4 12367 B13R1.44 CC(CCC#N)Nc1ccccn1 28a31c3e592cab3351977a52c8c85729 [0,2,0,0,0,0|1,0,1]=4 12368 B13R1.44 CC(CCC#N)Oc1ccccn1 8726e039ddfed2b8dcb76d402336b486 [0,2,0,0,0,0|1,0,1]=4 12369 B13R1.44 CC(CCCO)Nc1ccccc1 f20bb93ce6f40cf58cacb8aee4b19b92 [0,2,0,0,0,0|2,0,0]=4 12370 B13R1.44 CC(CCCO)Nc1cccnn1 224d52e3d7903b910dda94211f3fea26 [0,2,0,0,0,0|2,0,0]=4 12371 B13R1.44 CC(CCCO)Nc1ccncn1 3b7a5dc8201f095c721c19e867cf6f52 [0,2,0,0,0,0|2,0,0]=4 12372 B13R1.44 CC(CCCO)Nc1ncccn1 a9ebbc6e796ddac60829a7b8b0b80068 [0,2,0,0,0,0|2,0,0]=4 12373 B13R1.44 CC(COCF)Cc1ccccc1 cf6c20d560e020e5378ba5348dafbbbd [0,2,0,0,0,0|2,0,0]=4 12374 B13R1.44 CC(Cc1ccccc1)OCCF 40c0d1fb211b589ef3fa26aebde3a13f [0,2,0,0,0,0|2,0,0]=4 12375 B13R1.44 CC(Cc1ccccc1)OCCS eee651bccc078c60c2c124960fd1edd5 [0,2,0,0,0,0|2,0,0]=4 12376 B13R1.44 CC(Cc1ccccn1)NCC#N df3ffb58f9433ab0efcaebfb8cf1ba2d [0,2,0,0,0,0|1,0,1]=4 12377 B13R1.44 CC(Cc1ccccn1)NCC=O c2daeb5d3ac0d2bc58fd015b06f23477 [0,2,0,0,0,0|1,0,1]=4 12378 B13R1.44 CC(Cc1ccccn1)NCCF 527ade0f5304db944420a1847e79e654 [0,2,0,0,0,0|1,0,0]=3 12379 B13R1.44 CC(Cc1ccccn1)NCCO ba264b17215bdb75982180f401b19fbd [0,2,0,0,0,0|1,0,0]=3 12380 B13R1.44 CC(Cc1ccccn1)NCCS 5c574e494cfea2c911455fefb02e7cc9 [0,2,0,0,0,0|1,0,0]=3 12381 B13R1.44 CC(Cc1ccccn1)OCC#N 0463b9a60d718234986f6b6be5b66915 [0,2,0,0,0,0|1,0,1]=4 12382 B13R1.44 CC(Cc1ccccn1)OCC=O f9e7786d4661a92ae98cf43942d72f84 [0,2,0,0,0,0|1,0,1]=4 12383 B13R1.44 CC(Cc1ccccn1)OCCF 59c812cc83e70813130ec6cd56855e67 [0,2,0,0,0,0|1,0,0]=3 12384 B13R1.44 CC(Cc1ccccn1)OCCS c9ec8be1639bfd794d9c884ce7a6e415 [0,2,0,0,0,0|1,0,0]=3 12385 B13R1.44 CC(Cc1cnccn1)NCCF 21c4819f7ad0114589fa2762e1722400 [0,2,0,0,0,0|2,0,0]=4 12386 B13R1.44 CC(Cc1cnccn1)NCCO 3cdfa5d87d99d6912ce2b0be2b045f86 [0,2,0,0,0,0|2,0,0]=4 12387 B13R1.44 CC(Cc1cnccn1)NCCS 5f20a4f6ac00aa5adc595e2d324c24ad [0,2,0,0,0,0|2,0,0]=4 12388 B13R1.44 CC(Cc1cnccn1)OCCF a3a64557d3eeb20f42479c611b2fd6c7 [0,2,0,0,0,0|2,0,0]=4 12389 B13R1.44 CC(Cc1cnccn1)OCCS 21ed940d8cdd7fe60b75da4b24e8aea4 [0,2,0,0,0,0|2,0,0]=4 12390 B13R1.44 CCCCC(=O)Nc1ccccc1 23ed3b5fa4d849246c442d63dab5c35b [0,2,0,0,0,0|1,0,1]=4 12391 B13R1.44 CCCCC(=O)Nc1ccccn1 ea029227fbf3ccd53e108bc1e3c1d3f3 [0,2,0,0,0,0|0,0,1]=3 12392 B13R1.44 CCCCC(=O)Nc1cccnn1 e8ec91a2273e212d613ec1f80820e525 [0,2,0,0,0,0|1,0,1]=4 12393 B13R1.44 CCCCC(=O)Nc1ccncn1 8d431c9e06505a585c7965c08aa505a9 [0,2,0,0,0,0|1,0,1]=4 12394 B13R1.44 CCCCC(=O)Nc1cnccn1 ea0c62ebbedc36e6a9a73806f7a05d12 [0,2,0,0,0,0|1,0,1]=4 12395 B13R1.44 CCCCC(C)Nc1ccccc1 33a32ffda6f8f10c0a3dafe37790b50b [0,2,0,0,0,0|1,0,0]=3 12396 B13R1.44 CCCCC(C)Nc1ccccn1 345312f082073ed93cb341d625433baf [0,2,0,0,0,0|0,0,0]=2 12397 B13R1.44 CCCCC(C)Nc1cccnc1 8e1988f8bb95672b36368d0afe64cf45 [0,2,0,0,0,0|2,0,0]=4 12398 B13R1.44 CCCCC(C)Nc1cccnn1 014a37dab5538d475feae42ce7e29189 [0,2,0,0,0,0|1,0,0]=3 12399 B13R1.44 CCCCC(C)Nc1ccncc1 6985a5f710b1379ef3ba8836738bc137 [0,2,0,0,0,0|2,0,0]=4 12400 B13R1.44 CCCCC(C)Nc1ccncn1 0bb60cb7b445901e1237ab3a07d05862 [0,2,0,0,0,0|1,0,0]=3 12401 B13R1.44 CCCCC(C)Nc1cnccn1 67dcce8486c444cb2c6b1b00bdaa901c [0,2,0,0,0,0|1,0,0]=3 12402 B13R1.44 CCCCC(C)Nc1cnncn1 e6dc9a2f06ad5773b33d8125e879ac42 [0,2,0,0,0,0|2,0,0]=4 12403 B13R1.44 CCCCC(C)Nc1ncccn1 cf2e8a6c6843019221f3f6052ff27a6b [0,2,0,0,0,0|1,0,0]=3 12404 B13R1.44 CCCCC(C)Nc1nccnn1 3fab0c2f42672202b025bab3ace0b1af [0,2,0,0,0,0|2,0,0]=4 12405 B13R1.44 CCCCC(C)Nc1ncncn1 c0fd88accbffa807f37d6fe13564046b [0,2,0,0,0,0|2,0,0]=4 12406 B13R1.44 CCCCC(C)Oc1ccccn1 1bf9282f665e11b81a4b8addaa5af343 [0,2,0,0,0,0|0,0,0]=2 12407 B13R1.44 CCCCC(C)Oc1cccnc1 eca77caf0aa2a1ade3a535e6eb649c11 [0,2,0,0,0,0|2,0,0]=4 12408 B13R1.44 CCCCC(C)Oc1ccncc1 5e864fbc699053ee4eba2c5d86f005f5 [0,2,0,0,0,0|2,0,0]=4 12409 B13R1.44 CCCCC(C)Oc1cnccn1 0aeb6255e3d43cbdbfbaf86ce80b86e0 [0,2,0,0,0,0|1,0,0]=3 12410 B13R1.44 CCCCC(C)Oc1ncccn1 2f811bb5159010573e48544908d172c1 [0,2,0,0,0,0|1,0,0]=3 12411 B13R1.44 CCCCN(C)Cc1ccccc1 a14836a42f96f1b5adf55efbbee812c9 [0,2,0,0,0,0|1,0,0]=3 12412 B13R1.44 CCCCN(C)Cc1ccccn1 e82a135797ef97dfbc5dc4a7bdfdd4a9 [0,2,0,0,0,0|0,0,0]=2 12413 B13R1.44 CCCCN(C)Cc1cccnc1 61867893599d95943a29f7de84ac1e10 [0,2,0,0,0,0|2,0,0]=4 12414 B13R1.44 CCCCN(C)Cc1cccnn1 cfe17613df144b3ab8aa12b49f9512e5 [0,2,0,0,0,0|1,0,0]=3 12415 B13R1.44 CCCCN(C)Cc1ccncc1 1aeab6820cc8c82302c6870fb596754b [0,2,0,0,0,0|2,0,0]=4 12416 B13R1.44 CCCCN(C)Cc1ccncn1 077018d7b76de83035f766c4494d7e90 [0,2,0,0,0,0|1,0,0]=3 12417 B13R1.44 CCCCN(C)Cc1cnccn1 d52b75829832fecfaa5485dc992a6a3c [0,2,0,0,0,0|1,0,0]=3 12418 B13R1.44 CCCCN(C)Cc1ncccn1 b81ff8b4fb567e3abd27e5acfbdc50cc [0,2,0,0,0,0|1,0,0]=3 12419 B13R1.44 CCCC[C@@H](C)Nc1ccccc1 a81b81af0c0ad2ccc8b90d851da74931 [0,2,0,0,0,0|1,0,0]=3 12420 B13R1.44 CCCC[C@@H](C)Nc1cccnc1 c8db3a02b687884ddaf74c90615e08ca [0,2,0,0,0,0|2,0,0]=4 12421 B13R1.44 CCCNC(=O)Cc1ccccn1 636356973687d8cc469c4e38671fa2db [0,2,0,0,0,0|0,0,1]=3 12422 B13R1.44 CCCNC(=O)Cc1ccncn1 d22237869f456c1c2dd2ab5779308391 [0,2,0,0,0,0|1,0,1]=4 12423 B13R1.44 CCCNC(=O)Cc1cnccn1 2f35857f2c14594d80eb6dfb548f7423 [0,2,0,0,0,0|1,0,1]=4 12424 B13R1.44 CCCNC(=O)Cc1ncccn1 ab2f8b4e4bd9d63374f5c4bb059d8a4a [0,2,0,0,0,0|1,0,1]=4 12425 B13R1.44 CCCNC(=O)Nc1ccccn1 7a343167602c35a8edaca663620bc188 [0,2,0,0,0,0|1,0,1]=4 12426 B13R1.44 CCCNC(=S)Nc1ccccn1 2bc64c0d8d96643d522d131a4064ec0f [0,2,0,0,0,0|1,0,1]=4 12427 B13R1.44 CCCNC(C)Cc1ccccn1 08a9ae499a0ab2b3686ed9f796aeb713 [0,2,0,0,0,0|0,0,0]=2 12428 B13R1.44 CCCNC(C)Cc1cccnc1 d3783f138eefc7174b8325666f11aae7 [0,2,0,0,0,0|2,0,0]=4 12429 B13R1.44 CCCNC(C)Cc1ccncc1 ed6140f88e422fed342ce366cb4c481d [0,2,0,0,0,0|2,0,0]=4 12430 B13R1.44 CCCNC(C)Cc1cnccn1 1a31115b29d15c97038b96ed7563ced4 [0,2,0,0,0,0|1,0,0]=3 12431 B13R1.44 CCCOC(C)Cc1ccccc1 0d6e3fc488ed6570a7168edeaecd186c [0,2,0,0,0,0|1,0,0]=3 12432 B13R1.44 CCCOC(C)Cc1ccccn1 94f180fb14efb678ae5b94b8a114d053 [0,2,0,0,0,0|0,0,0]=2 12433 B13R1.44 CCCOC(C)Cc1cnccn1 c01ceafeef7a46d2e9fb62341685b71b [0,2,0,0,0,0|1,0,0]=3 12434 B13R1.44 CCCO[C@@H](C)Cc1ccccc1 3b4dd1b88c8a6095ff95285b4bf0c213 [0,2,0,0,0,0|1,0,0]=3 12435 B13R1.44 CCCO[C@H](C)Cc1ccccc1 86496af3292741ec4d8a65d7a8599233 [0,2,0,0,0,0|1,0,0]=3 12436 B13R1.44 CCNCC(C)Oc1ccccc1 d65e0b2231c2e63dc9ef564896eaaf21 [0,2,0,0,0,0|2,0,0]=4 12437 B13R1.44 CCNCC(O)Cc1ccccc1 113d746b76c120a3b54e335fef68cfe0 [0,2,0,0,0,0|1,0,0]=3 12438 B13R1.44 CCOCC(=O)Nc1ccccn1 772eb1c9a2a9e8c708f0a85dd0264a7e [0,2,0,0,0,0|1,0,1]=4 12439 B13R1.44 CCOCC(C)Oc1ccccc1 878c0c56f770ef7f9d0b7f8f18b9e6dd [0,2,0,0,0,0|2,0,0]=4 12440 B13R1.44 CCOCN(C)Cc1ccccc1 d2328c731f3f740d0265f8b075a2a451 [0,2,0,0,0,0|2,0,0]=4 12441 B13R1.44 CCOCN(C)Cc1ccccn1 c9904975eb5c117110e42622b605fa2e [0,2,0,0,0,0|1,0,0]=3 12442 B13R1.44 CCOCN(C)Cc1cnccn1 eefb9545a5baed93bc873483bff75619 [0,2,0,0,0,0|2,0,0]=4 12443 B13R1.44 CCOCN(C)Cc1ncccn1 12e43abcc3702b3882a25eff9fabfc01 [0,2,0,0,0,0|2,0,0]=4 12444 B13R1.44 CCOC[C@H](C)Oc1ccccc1 4178584fcff4a6adb50db68f032785ff [0,2,0,0,0,0|2,0,0]=4 12445 B13R1.44 CCSCC(=O)Nc1ccccn1 7aef7f6cae8f6912bdf4e4eb165f0835 [0,2,0,0,0,0|1,0,1]=4 12446 B13R1.44 CN(CCC#N)Cc1ccccn1 7f363fdb72179e0cb096416c8b1da5a1 [0,2,0,0,0,0|1,0,1]=4 12447 B13R1.44 CN(CCC=O)Cc1ccccn1 fd0e53db5370b36243e95be5762af387 [0,2,0,0,0,0|1,0,1]=4 12448 B13R1.44 CN(CCCF)Cc1ccccc1 d05cd88293c0a4b065f332f45d754721 [0,2,0,0,0,0|2,0,0]=4 12449 B13R1.44 CN(CCCF)Cc1ccccn1 f4a3ad3472ec8993d823e2dc561cb08e [0,2,0,0,0,0|1,0,0]=3 12450 B13R1.44 CN(CCCF)Cc1cnccn1 65ccfb5c3e7eb169a2bf2fe03014da07 [0,2,0,0,0,0|2,0,0]=4 12451 B13R1.44 CN(CCCF)Cc1ncccn1 a2df03f8d819854620455333504609df [0,2,0,0,0,0|2,0,0]=4 12452 B13R1.44 CN(CCCO)Cc1ccccc1 ced68969ac84c8705d8561470de9f4ab [0,2,0,0,0,0|2,0,0]=4 12453 B13R1.44 CN(CCCO)Cc1ccccn1 4eee4094f112299fb0de700021e42744 [0,2,0,0,0,0|1,0,0]=3 12454 B13R1.44 CN(CCCO)Cc1cccnn1 d0c41cb9b3d31f893bb0ca5335556d14 [0,2,0,0,0,0|2,0,0]=4 12455 B13R1.44 CN(CCCO)Cc1ccncn1 3a503d68752120250954dbb6f2442b37 [0,2,0,0,0,0|2,0,0]=4 12456 B13R1.44 CN(CCCO)Cc1cnccn1 90c96f9d884cfe2fc00400a6031bc667 [0,2,0,0,0,0|2,0,0]=4 12457 B13R1.44 CN(CCCO)Cc1ncccn1 1cbfb46f75a20e75e12ac6c29ce08c1a [0,2,0,0,0,0|2,0,0]=4 12458 B13R1.44 CN(CCCS)Cc1ccccc1 9ddeb471ca8af960e092d05ca9915ce8 [0,2,0,0,0,0|2,0,0]=4 12459 B13R1.44 CN(CCCS)Cc1ccccn1 4e7f051c4feab68556a18dc1ae339495 [0,2,0,0,0,0|1,0,0]=3 12460 B13R1.44 CN(CCCS)Cc1cnccn1 62d014b1b6bf502541e57cb69205445c [0,2,0,0,0,0|2,0,0]=4 12461 B13R1.44 CN(CCCS)Cc1ncccn1 0696e4c3bd9f035d5c151318ead6478c [0,2,0,0,0,0|2,0,0]=4 12462 B13R1.44 CN(CCON)Cc1ccccn1 b68b6621d0349193bf06444901fd0246 [0,2,0,0,0,0|2,0,0]=4 12463 B13R1.44 COCCC(=O)Nc1ccccn1 54cb6e078964efb01053f49353e285d9 [0,2,0,0,0,0|1,0,1]=4 12464 B13R1.44 COCCN(C)Cc1ccccc1 cdf88891dc4254cba5eaf45424898af9 [0,2,0,0,0,0|2,0,0]=4 12465 B13R1.44 COCCN(C)Cc1ccccn1 936e49970a3f8717b59fd825f6f677ac [0,2,0,0,0,0|1,0,0]=3 12466 B13R1.44 COCCN(C)Cc1cccnn1 46f637bc763b8af41c2682b2ff282459 [0,2,0,0,0,0|2,0,0]=4 12467 B13R1.44 COCCN(C)Cc1ccncn1 117451ce954930f96a93df3f8de93b7c [0,2,0,0,0,0|2,0,0]=4 12468 B13R1.44 COCCN(C)Cc1cnccn1 c6caa0f3923cc5fc6de9ab21211224a5 [0,2,0,0,0,0|2,0,0]=4 12469 B13R1.44 COCCN(C)Cc1ncccn1 c2793caa5873c8e0f67031b02a1034bd [0,2,0,0,0,0|2,0,0]=4 12470 B13R1.44 COCNC(C)Cc1ccccn1 bdef7d44fcae90d367ec08c1653624aa [0,2,0,0,0,0|1,0,0]=3 12471 B13R1.44 COCNC(C)Cc1cnccn1 4665416cd2432d69274e1c872f057208 [0,2,0,0,0,0|2,0,0]=4 12472 B13R1.44 COCOC(C)Cc1ccccn1 01ea1adc66714845ba178045670c465f [0,2,0,0,0,0|1,0,0]=3 12473 B13R1.44 COCOC(C)Cc1cnccn1 5c7cb4d6ce882c5af9b29527f835243b [0,2,0,0,0,0|2,0,0]=4 12474 B13R1.44 CSCCC(=O)Nc1ccccn1 ea18ba1a3b11eb3deed195b8390f7cca [0,2,0,0,0,0|1,0,1]=4 12475 B13R1.44 CSCCN(C)Cc1ccccc1 e5eca7443db58613b4252a52eb1be0ef [0,2,0,0,0,0|2,0,0]=4 12476 B13R1.44 CSCCN(C)Cc1ccccn1 7708d4516e0522a76cb2d3ed0593ce24 [0,2,0,0,0,0|1,0,0]=3 12477 B13R1.44 CSCCN(C)Cc1cccnn1 8ff5170ea3e4a49a7dccf405932014b9 [0,2,0,0,0,0|2,0,0]=4 12478 B13R1.44 CSCCN(C)Cc1ccncn1 5563f13039814e19c7b7f341dea933c0 [0,2,0,0,0,0|2,0,0]=4 12479 B13R1.44 CSCCN(C)Cc1cnccn1 4c1ce8d5790fd59e68a2954f880dd110 [0,2,0,0,0,0|2,0,0]=4 12480 B13R1.44 CSCCN(C)Cc1ncccn1 03c98678916e10d2e8b5e3af41f2d31c [0,2,0,0,0,0|2,0,0]=4 12481 B13R1.44 CSCNC(C)Cc1ccccn1 0163679dcc20e6ad194d00c367953e93 [0,2,0,0,0,0|1,0,0]=3 12482 B13R1.44 CSCNC(C)Cc1cnccn1 9daa1337baecf10df9f53870fc93124e [0,2,0,0,0,0|2,0,0]=4 12483 B13R1.44 CSCOC(C)Cc1ccccc1 d47eb7c2add4cd77a238aaa487c41e75 [0,2,0,0,0,0|2,0,0]=4 12484 B13R1.44 CSCOC(C)Cc1ccccn1 b9c97ccdb56b41bc2150cccd1cd17b28 [0,2,0,0,0,0|1,0,0]=3 12485 B13R1.44 CSCOC(C)Cc1cnccn1 22bd5a3ae9a6294b85b5f506dcaa3e6c [0,2,0,0,0,0|2,0,0]=4 12486 B13R1.44 CSCO[C@@H](C)Cc1ccccc1 a4c62954b462c72460667b177c2c1967 [0,2,0,0,0,0|2,0,0]=4 12487 B13R1.44 CSCO[C@H](C)Cc1ccccc1 7a09f89b34308b5d0baa28a6445feb4b [0,2,0,0,0,0|2,0,0]=4 12488 B13R1.44 C[C@@H](Cc1ccccc1)OCCF adba34a14ed1f92e1af6eb0b6e97a5ec [0,2,0,0,0,0|2,0,0]=4 12489 B13R1.44 C[C@@H](Cc1ccccc1)OCCS 5758e84ff221c2386d02535eac8a32e6 [0,2,0,0,0,0|2,0,0]=4 12490 B13R1.44 C[C@H](CCCO)Nc1ccccc1 2014e04255bf7ecdb216e4a4e9110808 [0,2,0,0,0,0|2,0,0]=4 12491 B13R1.44 C[C@H](Cc1ccccc1)OCCF 18fbc53f40b2dd24993aec64b50307bf [0,2,0,0,0,0|2,0,0]=4 12492 B13R1.44 C[C@H](Cc1ccccc1)OCCS 1c77b2735448efeb08b15e0d9fc3458a [0,2,0,0,0,0|2,0,0]=4 12493 B13R1.44 O=C(CCCF)Nc1ccccn1 f0e164293a4eae9d84ff4e48cbe2da1e [0,2,0,0,0,0|1,0,1]=4 12494 B13R1.44 O=C(CCCS)Nc1ccccn1 65a1cf8776056b4fe63c8370ae29e3e5 [0,2,0,0,0,0|1,0,1]=4 12495 B13R1.44 O=C(Cc1ccccn1)NCCBr 8a271642e375961a84035aeec8c95edd [0,2,0,0,0,0|1,0,1]=4 12496 B13R1.44 O=C(Cc1ccccn1)NCCF 646e0110aaf90ca1b7080004d655cf69 [0,2,0,0,0,0|1,0,1]=4 12497 B13R1.44 O=C(Cc1ccccn1)NCCI a4c8090c90149852f9c77a7f8dbf4d22 [0,2,0,0,0,0|1,0,1]=4 12498 B13R1.44 O=C(Cc1ccccn1)NCCO 549418b45be1ad773acf09fbef792184 [0,2,0,0,0,0|1,0,1]=4 12499 B13R1.44 O=C(Cc1ccccn1)NCCS 18fc700eeeddacbb79869323e7982492 [0,2,0,0,0,0|1,0,1]=4 12500 B13R1.44 OC(CNCF)Cc1ccccc1 c840e624cc42b87df6f7ffdc7fb420aa [0,2,0,0,0,0|2,0,0]=4 12501 B13R1.44 OCNCC(O)Cc1ccccc1 62523061256d425de1023beccf57e668 [0,2,0,0,0,0|2,0,0]=4 12502 B13R1.337 C/C(=C/CNCc1ccccn1)/I f1d1c5f391454702bc301120abcbf8a7 [0,2,0,0,0,0|0,0,2]=4 12503 B13R1.337 C/C(=C/COCc1ccccn1)/Cl 818e22cc829e67f4ba6289355b524c25 [0,2,0,0,0,0|0,0,2]=4 12504 B13R1.337 C/C(=C/COCc1ccccn1)/I ecadc50b04ebefffb30c2c32fcc881e2 [0,2,0,0,0,0|0,0,2]=4 12505 B13R1.337 C/C(=C\CNCc1ccccn1)/Cl d1af7aded0192998fcf89598920d2ab3 [0,2,0,0,0,0|0,0,2]=4 12506 B13R1.337 C/C(=C\COCc1ccccn1)/Cl 42e500802b01dc29a7f6f2927789aad1 [0,2,0,0,0,0|0,0,2]=4 12507 B13R1.337 C=C(Br)CCOCc1ccccn1 193bb7ea6fedc90c44b0806b09502a8e [0,2,0,0,0,0|0,0,2]=4 12508 B13R1.337 C=C(Br)CNCCc1ccccn1 578adb9a8723b36b8402b895e658270d [0,2,0,0,0,0|0,0,2]=4 12509 B13R1.337 C=C(Br)COCCc1ccccn1 765b9c0d5ed77617d5007150d4f2e6cc [0,2,0,0,0,0|0,0,2]=4 12510 B13R1.337 C=C(C)CCCNc1ccccc1 f728f8a1b605411bc015a737be6f7656 [0,2,0,0,0,0|1,0,1]=4 12511 B13R1.337 C=C(C)CCCNc1ccccn1 c26d62aec00ea2d669ff5180aefe95d2 [0,2,0,0,0,0|0,0,1]=3 12512 B13R1.337 C=C(C)CCCNc1cccnn1 d4ad393b7131cade59e3ecb641379af4 [0,2,0,0,0,0|1,0,1]=4 12513 B13R1.337 C=C(C)CCCNc1ccncn1 fa6489dbaeaff55b7f4fa58486599b55 [0,2,0,0,0,0|1,0,1]=4 12514 B13R1.337 C=C(C)CCCNc1cnccn1 0834ec4e97db44d2c749c2b52e954fe1 [0,2,0,0,0,0|1,0,1]=4 12515 B13R1.337 C=C(C)CCCNc1ncccn1 8f69f88361c5ced582f19e289bcaa9ca [0,2,0,0,0,0|1,0,1]=4 12516 B13R1.337 C=C(C)CCCOc1ccccn1 3565532fc19a08de872b9bbb8a2e10d0 [0,2,0,0,0,0|0,0,1]=3 12517 B13R1.337 C=C(C)CCCOc1cnccn1 32c8642901ece56b475517646dc4465f [0,2,0,0,0,0|1,0,1]=4 12518 B13R1.337 C=C(C)CCCOc1ncccn1 f94ea328604faaacd30909782344169b [0,2,0,0,0,0|1,0,1]=4 12519 B13R1.337 C=C(C)CCNCc1ccccc1 245d7e932f268ca289e225d2bf588b51 [0,2,0,0,0,0|1,0,1]=4 12520 B13R1.337 C=C(C)CCNCc1ccccn1 aa5e353503b5885d372f1619d3c13ad1 [0,2,0,0,0,0|0,0,1]=3 12521 B13R1.337 C=C(C)CCNCc1cccnn1 fa879f5aeaf6aed7b516319709c33bee [0,2,0,0,0,0|1,0,1]=4 12522 B13R1.337 C=C(C)CCNCc1ccncn1 0b540fe3d4b99af19431cb694505d834 [0,2,0,0,0,0|1,0,1]=4 12523 B13R1.337 C=C(C)CCNCc1cnccn1 8626bb0dbfe61fdb781d7a04b046a4d1 [0,2,0,0,0,0|1,0,1]=4 12524 B13R1.337 C=C(C)CCNCc1ncccn1 ad3a54edefeadf720300ae0550c53548 [0,2,0,0,0,0|1,0,1]=4 12525 B13R1.337 C=C(C)CCOCc1ccccc1 f1f833f7ffe7ac0efc7e8e372d42a942 [0,2,0,0,0,0|1,0,1]=4 12526 B13R1.337 C=C(C)CCOCc1ccccn1 199d8e635fa75b95a4651da0bbcc52d4 [0,2,0,0,0,0|0,0,1]=3 12527 B13R1.337 C=C(C)CCOCc1cccnn1 b9868bb417551107e22264fb40d58c1f [0,2,0,0,0,0|1,0,1]=4 12528 B13R1.337 C=C(C)CCOCc1ccncn1 7dbb96f9ae634dd0d8bbb1e6d676af13 [0,2,0,0,0,0|1,0,1]=4 12529 B13R1.337 C=C(C)CCOCc1cnccn1 63e5d478c1f799028ad9970be4a1b4e8 [0,2,0,0,0,0|1,0,1]=4 12530 B13R1.337 C=C(C)CCOCc1ncccn1 c8bd388484f9783b67072b6c25b1b575 [0,2,0,0,0,0|1,0,1]=4 12531 B13R1.337 C=C(C)CNCCc1ccccc1 ad4abafd80b4630bfb329df93c6ebf89 [0,2,0,0,0,0|1,0,1]=4 12532 B13R1.337 C=C(C)CNCCc1ccccn1 8c13fe86cc5bf325d72a3e3f5212f6c3 [0,2,0,0,0,0|0,0,1]=3 12533 B13R1.337 C=C(C)CNCCc1ccncn1 e89318b95490e6de04616f788334ea6c [0,2,0,0,0,0|1,0,1]=4 12534 B13R1.337 C=C(C)CNCCc1cnccn1 b2a08840667cd4745e2d612a9ddea005 [0,2,0,0,0,0|1,0,1]=4 12535 B13R1.337 C=C(C)CNCCc1ncccn1 e70aa06ef6970c9f524c410cbaa33bc1 [0,2,0,0,0,0|1,0,1]=4 12536 B13R1.337 C=C(C)COCCc1ccccc1 bb47dba412913fd69c05f208256c3165 [0,2,0,0,0,0|1,0,1]=4 12537 B13R1.337 C=C(C)COCCc1ccccn1 5dd7bb72395ce29ff55f7db29b74d0f1 [0,2,0,0,0,0|0,0,1]=3 12538 B13R1.337 C=C(C)COCCc1ccncn1 0cfbb4bdaf1211eddee61bb84edf02bf [0,2,0,0,0,0|1,0,1]=4 12539 B13R1.337 C=C(C)COCCc1cnccn1 f960a64caf6a49a025110e1500a63c3a [0,2,0,0,0,0|1,0,1]=4 12540 B13R1.337 C=C(C)COCCc1ncccn1 aa18d5bf7b57ca6107f9826ebb4d21e5 [0,2,0,0,0,0|1,0,1]=4 12541 B13R1.337 C=C(Cl)CNCCc1ccccn1 ae8a93152dfba20ce1d90a92b819fa43 [0,2,0,0,0,0|0,0,2]=4 12542 B13R1.337 C=C(Cl)COCCc1ccccn1 003573bd97b57c7eb188167a0445fa57 [0,2,0,0,0,0|0,0,2]=4 12543 B13R1.337 C=C(F)CNCCc1ccccn1 0849dadfff3e60217d1c34b9dfcb6481 [0,2,0,0,0,0|0,0,2]=4 12544 B13R1.337 C=C(F)COCCc1ccccn1 8234555e1b89503e03df696ed2d6d1b3 [0,2,0,0,0,0|0,0,2]=4 12545 B13R1.337 C=C(I)COCCc1ccccn1 57a2d87164adec397e83a6fb202cbc52 [0,2,0,0,0,0|0,0,2]=4 12546 B13R1.337 CC(=CCCNc1ccccn1)C ca9742b4479d6ee5966d87d4096da3d7 [0,2,0,0,0,0|0,0,2]=4 12547 B13R1.337 CC(=CCCOc1ccccn1)C 7ae77830735424f3c8f24e8f869a17d5 [0,2,0,0,0,0|0,0,2]=4 12548 B13R1.337 CC(=CCNCc1ccccn1)C a6c425c4b7745b83cbcc7e5b1748fb04 [0,2,0,0,0,0|0,0,2]=4 12549 B13R1.337 CC(=CCNCc1ccccn1)Cl 83bffc81e98040ca4a69f9cfaf42e58e [0,2,0,0,0,0|0,0,2]=4 12550 B13R1.337 CC(=CCNCc1ccccn1)I b9b835517aa0baa981d7dc4ac4409118 [0,2,0,0,0,0|0,0,2]=4 12551 B13R1.337 CC(=CCOCc1ccccn1)C d4f8c86eae4bd3bafe62911ffc6b03b2 [0,2,0,0,0,0|0,0,2]=4 12552 B13R1.337 CC(=CCOCc1ccccn1)Cl 439d91618aa98c167511a0abc430e3d5 [0,2,0,0,0,0|0,0,2]=4 12553 B13R1.337 CC(=CCOCc1ccccn1)I 66a5a6d1725a5f9b3ca3432a799ac1e0 [0,2,0,0,0,0|0,0,2]=4 12554 B13R1.337 CC(=O)CCCNc1ccccc1 4ae31353e66fee474138ce1ee3f6c9df [0,2,0,0,0,0|1,0,1]=4 12555 B13R1.337 CC(=O)CCCNc1ccccn1 ecf3c5b1c504f1704f05ce63ebe264d7 [0,2,0,0,0,0|0,0,1]=3 12556 B13R1.337 CC(=O)CCCNc1cccnn1 9ad0b942c8dbbd18ce8711b0a9a02637 [0,2,0,0,0,0|1,0,1]=4 12557 B13R1.337 CC(=O)CCCNc1ccncn1 467ebb8f46097a9a2ddfc0b5f582069a [0,2,0,0,0,0|1,0,1]=4 12558 B13R1.337 CC(=O)CCCNc1cnccn1 cc4c5d5148d148ab7a0a14838948c100 [0,2,0,0,0,0|1,0,1]=4 12559 B13R1.337 CC(=O)CCCNc1ncccn1 d0c73229e3092c99c57e8cc22f340d30 [0,2,0,0,0,0|1,0,1]=4 12560 B13R1.337 CC(=O)CCCOc1ccccn1 eabb395048f3ce092959f8c8a00ccc13 [0,2,0,0,0,0|0,0,1]=3 12561 B13R1.337 CC(=O)CCCOc1cnccn1 693d4e43b728989b30abf92af984baa4 [0,2,0,0,0,0|1,0,1]=4 12562 B13R1.337 CC(=O)CCCOc1ncccn1 0d7c050c7c524eb5ea33721fce7fce9c [0,2,0,0,0,0|1,0,1]=4 12563 B13R1.337 CC(=O)CCNCc1ccccc1 545f125e7fb7bd7de6143e9ac44bc8db [0,2,0,0,0,0|1,0,1]=4 12564 B13R1.337 CC(=O)CCNCc1ccccn1 23774b7b8b1ff0aeefd338f8d559d542 [0,2,0,0,0,0|0,0,1]=3 12565 B13R1.337 CC(=O)CCNCc1cccnn1 61e6e75f2f0004e230ef76a3d8caeb89 [0,2,0,0,0,0|1,0,1]=4 12566 B13R1.337 CC(=O)CCNCc1ccncn1 3ce84ceaea4c51c032eda2596eab9b2a [0,2,0,0,0,0|1,0,1]=4 12567 B13R1.337 CC(=O)CCNCc1cnccn1 45f9f3ab4a61b6672dd65e22cc5514ec [0,2,0,0,0,0|1,0,1]=4 12568 B13R1.337 CC(=O)CCNCc1ncccn1 23168e27eecba2f88a5dcadfbde8f2ee [0,2,0,0,0,0|1,0,1]=4 12569 B13R1.337 CC(=O)CCOCc1ccccc1 cd809ee0733413cdafcbf7a64d37b288 [0,2,0,0,0,0|1,0,1]=4 12570 B13R1.337 CC(=O)CCOCc1ccccn1 195cdad993f8bee565ad3b388160ec64 [0,2,0,0,0,0|0,0,1]=3 12571 B13R1.337 CC(=O)CCOCc1cccnn1 0c8b385ec7ed5c17dad246e55727569e [0,2,0,0,0,0|1,0,1]=4 12572 B13R1.337 CC(=O)CCOCc1ccncn1 cfc9f25faa06311d677297aa729e837b [0,2,0,0,0,0|1,0,1]=4 12573 B13R1.337 CC(=O)CCOCc1cnccn1 3320241e698646ad11a82ab2a10139f3 [0,2,0,0,0,0|1,0,1]=4 12574 B13R1.337 CC(=O)CCOCc1ncccn1 a99b8c39da4d07dcb4fc3ef0d1db1259 [0,2,0,0,0,0|1,0,1]=4 12575 B13R1.337 CC(=O)CNCCc1ccccc1 a0e5ecc2a075f9e99967492b413c2b22 [0,2,0,0,0,0|1,0,1]=4 12576 B13R1.337 CC(=O)CNCCc1ccccn1 a441a020b240663c7bada837cc739b6a [0,2,0,0,0,0|0,0,1]=3 12577 B13R1.337 CC(=O)COCCc1ccccc1 b21215f0294db45e86870204260f53f2 [0,2,0,0,0,0|1,0,1]=4 12578 B13R1.337 CC(=O)COCCc1ccccn1 41b627783cd849a02e5a5467d6e48c12 [0,2,0,0,0,0|0,0,1]=3 12579 B13R1.337 CC(=O)NCCCc1ccccc1 4cae49b29a0d5e4aca63abcd8931e637 [0,2,0,0,0,0|1,0,1]=4 12580 B13R1.337 CC(=O)NCCCc1ccccn1 8030cfa265aedf8993932b4e2416dfc8 [0,2,0,0,0,0|0,0,1]=3 12581 B13R1.337 CC(=O)NCCNc1ccccn1 3c7a6e625442c26642f9b476adfb1495 [0,2,0,0,0,0|1,0,1]=4 12582 B13R1.337 CC(=O)NCCOc1ccccn1 12308e44d5c01510963b41941e29af8a [0,2,0,0,0,0|1,0,1]=4 12583 B13R1.337 CC(=O)NCOCc1ccccn1 3eb6c8ef72b2de5db8d159544375d7fa [0,2,0,0,0,0|1,0,1]=4 12584 B13R1.337 CC(=O)OCCNc1ccccn1 36f9aaa066cbdc63edf5f85707ea3e7e [0,2,0,0,0,0|1,0,1]=4 12585 B13R1.337 CC(=O)OCCOc1ccccn1 27e7e62882cf9061dddd2eb5fd7ce7e4 [0,2,0,0,0,0|1,0,1]=4 12586 B13R1.337 CC(=O)OCNCc1ccccn1 dabb5163d1bee795543dd5fed2ec6d0a [0,2,0,0,0,0|1,0,1]=4 12587 B13R1.337 CC(=O)OCOCc1ccccn1 f888943600b8a8b01e54a130579921cd [0,2,0,0,0,0|1,0,1]=4 12588 B13R1.337 CC(=O)SCCNc1ccccn1 ca81179c54819f28ac0c77959a0f256b [0,2,0,0,0,0|1,0,1]=4 12589 B13R1.337 CC(=O)SCCOc1ccccn1 00d0d41886e10476d9d344abd1e39b43 [0,2,0,0,0,0|1,0,1]=4 12590 B13R1.337 CC(C)/C=C/CNc1ccccn1 5608a484054a09e91704cc498e2a6a7b [0,2,0,0,0,0|0,0,2]=4 12591 B13R1.337 CC(C)/C=C/COc1ccccn1 b01bb1517dbc00741c9ea5c24804faff [0,2,0,0,0,0|0,0,2]=4 12592 B13R1.337 CC(C)CCCNc1ccccc1 c82a8703c7f6bacdc28ba024d517baa2 [0,2,0,0,0,0|1,0,0]=3 12593 B13R1.337 CC(C)CCCNc1ccccn1 51be2530c79b637398d9a91ae21bb834 [0,2,0,0,0,0|0,0,0]=2 12594 B13R1.337 CC(C)CCCNc1cccnc1 9beb5791787630d5f828c17422f51de5 [0,2,0,0,0,0|2,0,0]=4 12595 B13R1.337 CC(C)CCCNc1cccnn1 164714cea89e29efa02ef48909b97589 [0,2,0,0,0,0|1,0,0]=3 12596 B13R1.337 CC(C)CCCNc1ccncc1 efbcf79d50e46c69ae6342f34e663e3f [0,2,0,0,0,0|2,0,0]=4 12597 B13R1.337 CC(C)CCCNc1ccncn1 ba3204a7dbabd393c9e8c3138e8b904a [0,2,0,0,0,0|1,0,0]=3 12598 B13R1.337 CC(C)CCCNc1cnccn1 f8a8846240a59d8f28f9330a307493a1 [0,2,0,0,0,0|1,0,0]=3 12599 B13R1.337 CC(C)CCCNc1cnncn1 299984d586ae3d681f07a0294b9646fd [0,2,0,0,0,0|2,0,0]=4 12600 B13R1.337 CC(C)CCCNc1ncccn1 05a1f8fa7e4d119684e785ce3e4b0e4b [0,2,0,0,0,0|1,0,0]=3 12601 B13R1.337 CC(C)CCCNc1nccnn1 47f05cb199f476230b04be520f5425e8 [0,2,0,0,0,0|2,0,0]=4 12602 B13R1.337 CC(C)CCCNc1ncncn1 fa9c97cf40c526bdb72c87ddf29cb4bd [0,2,0,0,0,0|2,0,0]=4 12603 B13R1.337 CC(C)CCCOc1ccccn1 e6375a1c81cd42ff6185fcba1c54b2ce [0,2,0,0,0,0|0,0,0]=2 12604 B13R1.337 CC(C)CCCOc1cccnc1 b3cdd758bbf1b7b529bc9dc2c26ef73c [0,2,0,0,0,0|2,0,0]=4 12605 B13R1.337 CC(C)CCCOc1ccncc1 9d4a6b44dd113b85f64db07d599d8996 [0,2,0,0,0,0|2,0,0]=4 12606 B13R1.337 CC(C)CCCOc1cnccn1 4429a5f869af87a41ee842e0ed570029 [0,2,0,0,0,0|1,0,0]=3 12607 B13R1.337 CC(C)CCCOc1cncnn1 35903289acc47301baa75baae57b5fa6 [0,2,0,0,0,0|2,0,0]=4 12608 B13R1.337 CC(C)CCCOc1ncccn1 eba5ce8fb1bbbd5cd065ef17f2664c8c [0,2,0,0,0,0|1,0,0]=3 12609 B13R1.337 CC(C)CCNCc1ccccc1 1e688087bf103ef5abb70549de5710ec [0,2,0,0,0,0|1,0,0]=3 12610 B13R1.337 CC(C)CCNCc1ccccn1 9942edf39eabe74b173023ccd1d8f680 [0,2,0,0,0,0|0,0,0]=2 12611 B13R1.337 CC(C)CCNCc1cccnc1 efe87d76a5cef2c9c040362dd810c863 [0,2,0,0,0,0|2,0,0]=4 12612 B13R1.337 CC(C)CCNCc1cccnn1 15a6449fefe8e621f12f84b018f04879 [0,2,0,0,0,0|1,0,0]=3 12613 B13R1.337 CC(C)CCNCc1ccncc1 5db284470637968f1e608b9a64808708 [0,2,0,0,0,0|2,0,0]=4 12614 B13R1.337 CC(C)CCNCc1ccncn1 cc209857e981f8b73b71bba4d82ed8c7 [0,2,0,0,0,0|1,0,0]=3 12615 B13R1.337 CC(C)CCNCc1cnccn1 0b7fb59a3ff3c331914dbd52178ad424 [0,2,0,0,0,0|1,0,0]=3 12616 B13R1.337 CC(C)CCNCc1ncccn1 79641020f0438ff172bfa722afdf2715 [0,2,0,0,0,0|1,0,0]=3 12617 B13R1.337 CC(C)CCOCc1ccccc1 b9a2e4d50d414109e50fcb33258261ee [0,2,0,0,0,0|1,0,0]=3 12618 B13R1.337 CC(C)CCOCc1ccccn1 02c5facde60119427fc0e1bd134b071a [0,2,0,0,0,0|0,0,0]=2 12619 B13R1.337 CC(C)CCOCc1cccnc1 16559d4279cb702f2adce6f17203371a [0,2,0,0,0,0|2,0,0]=4 12620 B13R1.337 CC(C)CCOCc1cccnn1 af9fe959e46f68980ee641b45fa18d21 [0,2,0,0,0,0|1,0,0]=3 12621 B13R1.337 CC(C)CCOCc1ccncc1 518cab7758e231497cea7b026594978a [0,2,0,0,0,0|2,0,0]=4 12622 B13R1.337 CC(C)CCOCc1ccncn1 b33d99ed3413203aff24d34577076024 [0,2,0,0,0,0|1,0,0]=3 12623 B13R1.337 CC(C)CCOCc1cnccn1 52cc2f1129beead45456286145a0f947 [0,2,0,0,0,0|1,0,0]=3 12624 B13R1.337 CC(C)CCOCc1ncccn1 506946cf35cee5ecb3c27fb89e5bc90e [0,2,0,0,0,0|1,0,0]=3 12625 B13R1.337 CC(C)CNCCc1ccccc1 f16bae1bab4fffecad912c27055afc90 [0,2,0,0,0,0|1,0,0]=3 12626 B13R1.337 CC(C)CNCCc1ccccn1 17637b2f9e470becdabf7d0ea22c2cf0 [0,2,0,0,0,0|0,0,0]=2 12627 B13R1.337 CC(C)CNCCc1cccnc1 22f87dd52166184eb0378453aefb4118 [0,2,0,0,0,0|2,0,0]=4 12628 B13R1.337 CC(C)CNCCc1ccncc1 2269dbc99675a360552f4f58db1d1235 [0,2,0,0,0,0|2,0,0]=4 12629 B13R1.337 CC(C)CNCCc1ccncn1 1159bc1dbe41e2a616a41010d9fd9bf5 [0,2,0,0,0,0|1,0,0]=3 12630 B13R1.337 CC(C)CNCCc1cnccn1 6f9233ef91733e4c0fa7d3fa53caeb9a [0,2,0,0,0,0|1,0,0]=3 12631 B13R1.337 CC(C)CNCCc1ncccn1 0486514db8a735422bf7dc8ddf59750f [0,2,0,0,0,0|1,0,0]=3 12632 B13R1.337 CC(C)CNCSc1ccccc1 3bc8641eae9466bc9857e5eda44bb5a4 [0,2,0,0,0,0|2,0,0]=4 12633 B13R1.337 CC(C)COCCc1ccccc1 9d79219b725a9770020e16740c174e35 [0,2,0,0,0,0|1,0,0]=3 12634 B13R1.337 CC(C)COCCc1ccccn1 9d35d874685cdfba0dfc7eb62abfa758 [0,2,0,0,0,0|0,0,0]=2 12635 B13R1.337 CC(C)COCCc1cccnc1 11c129e0cd29e06939cfb59230be4c91 [0,2,0,0,0,0|2,0,0]=4 12636 B13R1.337 CC(C)COCCc1ccncc1 a9a6e0c94b48739f9c88c187b5c30a97 [0,2,0,0,0,0|2,0,0]=4 12637 B13R1.337 CC(C)COCCc1ccncn1 eac826a5416b8c62e02db79fdf46229a [0,2,0,0,0,0|1,0,0]=3 12638 B13R1.337 CC(C)COCCc1cnccn1 9874ab97c9716c45e84966248af0eb83 [0,2,0,0,0,0|1,0,0]=3 12639 B13R1.337 CC(C)COCCc1ncccn1 a9976658525d1629e3e8eb0195f38632 [0,2,0,0,0,0|1,0,0]=3 12640 B13R1.337 CC(C)NCCCc1ccccc1 552e4f45cfe8a6dda608f5fb032f73f5 [0,2,0,0,0,0|1,0,0]=3 12641 B13R1.337 CC(C)NCCCc1ccccn1 a8386b45f11ad90cbb757483cb418377 [0,2,0,0,0,0|0,0,0]=2 12642 B13R1.337 CC(C)NCCCc1cccnc1 2684fde524abf85db53dd47d9a680d69 [0,2,0,0,0,0|2,0,0]=4 12643 B13R1.337 CC(C)NCCCc1ccncc1 5420d04b42736bb78b0a40b031f462cb [0,2,0,0,0,0|2,0,0]=4 12644 B13R1.337 CC(C)NCCOc1ccccc1 10d8ac155aa864d48319886f0fea4451 [0,2,0,0,0,0|2,0,0]=4 12645 B13R1.337 CC(C)NCCOc1ccccn1 a25543bbbe2bc7a2e4754fa8488035ef [0,2,0,0,0,0|1,0,0]=3 12646 B13R1.337 CC(C)OC/C=C/c1ccccn1 96de3b9e634782a2ffec827e38dccb59 [0,2,0,0,0,0|0,0,2]=4 12647 B13R1.337 CC(C)OCC#Cc1ccccn1 a2c65b7d8e89aaceddc62f91b6078a6b [0,2,0,0,0,0|0,0,2]=4 12648 B13R1.337 CC(C)OCCCC1=CCC=CC1 0771b8a6b35631c3c8d9cfabc13b9230 [0,2,0,0,0,0|1,0,1]=4 12649 B13R1.337 CC(C)OCCCc1ccccc1 742e1fa75290dae4f0a256e8c200b37d [0,2,0,0,0,0|1,0,0]=3 12650 B13R1.337 CC(C)OCCCc1ccccn1 6eeb08edbb5f5925e676c222bd387982 [0,2,0,0,0,0|0,0,0]=2 12651 B13R1.337 CC(C)OCCCc1cccnc1 20e92cdf46c9d84448abe9ffff585999 [0,2,0,0,0,0|2,0,0]=4 12652 B13R1.337 CC(C)OCCCc1ccncc1 051d6e76b19db36a23d6e3c4faaba141 [0,2,0,0,0,0|2,0,0]=4 12653 B13R1.337 CC(C)OCCCc1cnccn1 a0306991f0e611dcea52786af5346e59 [0,2,0,0,0,0|1,0,0]=3 12654 B13R1.337 CC(C)OCCCc1ncccn1 867c7ec7a53c4cdecee621f1c13ba30f [0,2,0,0,0,0|1,0,0]=3 12655 B13R1.337 CC(C)OCCNc1ccccc1 483fd2d96e61553e8b02b8934f11250e [0,2,0,0,0,0|2,0,0]=4 12656 B13R1.337 CC(C)OCCNc1ccccn1 05ccd8f0e80fb60acb36ef09daa50e4c [0,2,0,0,0,0|1,0,0]=3 12657 B13R1.337 CC(C)OCCNc1cccnn1 d5c0abc83f1f6e3b74bf584fad3d4c90 [0,2,0,0,0,0|2,0,0]=4 12658 B13R1.337 CC(C)OCCNc1ccncn1 9d79277d18be7e3242b4e7c0cfac64db [0,2,0,0,0,0|2,0,0]=4 12659 B13R1.337 CC(C)OCCNc1cnccn1 38e02b2841015d06e50b56df87fd985a [0,2,0,0,0,0|2,0,0]=4 12660 B13R1.337 CC(C)OCCNc1ncccn1 6b1892fa0bc3af489fee29452f7a1e47 [0,2,0,0,0,0|2,0,0]=4 12661 B13R1.337 CC(C)OCCOc1ccccc1 3ab0ec4af6feae154b17be9e6b5c16cd [0,2,0,0,0,0|2,0,0]=4 12662 B13R1.337 CC(C)OCCOc1ccccn1 15a043a8564039dcea38d63f39ca7fd3 [0,2,0,0,0,0|1,0,0]=3 12663 B13R1.337 CC(C)OCCOc1cnccn1 075d6b5bde4cbd2e5073273a08c73c73 [0,2,0,0,0,0|2,0,0]=4 12664 B13R1.337 CC(C)OCCOc1ncccn1 b062a647575cb197cc3b13c676050e22 [0,2,0,0,0,0|2,0,0]=4 12665 B13R1.337 CC(C)OCCSc1ccccc1 722f04b041065aeddd094dbf7e69a654 [0,2,0,0,0,0|2,0,0]=4 12666 B13R1.337 CC(C)OCCSc1ccccn1 07f22cebab9dbc11acd202f64078829c [0,2,0,0,0,0|1,0,0]=3 12667 B13R1.337 CC(C)OCNCc1ccccc1 f4f4760fb0314459d5763a2b5fdca637 [0,2,0,0,0,0|2,0,0]=4 12668 B13R1.337 CC(C)OCNCc1ccccn1 908285ef105057afe587f0e67538473c [0,2,0,0,0,0|1,0,0]=3 12669 B13R1.337 CC(C)OCNCc1cccnn1 4436382a2ef693cde7952c7634c3b425 [0,2,0,0,0,0|2,0,0]=4 12670 B13R1.337 CC(C)OCNCc1ccncn1 5b849e79b66527f71bc1eda642db241d [0,2,0,0,0,0|2,0,0]=4 12671 B13R1.337 CC(C)OCNCc1cnccn1 f364d844885420e250dcb7eb8f5d8ef8 [0,2,0,0,0,0|2,0,0]=4 12672 B13R1.337 CC(C)OCNCc1ncccn1 7069383c9fe80e7e76e22342f23d0115 [0,2,0,0,0,0|2,0,0]=4 12673 B13R1.337 CC(C)OCOCc1ccccn1 38b356543f964c28272545fcd9a7fef2 [0,2,0,0,0,0|1,0,0]=3 12674 B13R1.337 CC(C)OCOCc1cccnn1 e3c352466c34673087ee83845d6a27ca [0,2,0,0,0,0|2,0,0]=4 12675 B13R1.337 CC(C)OCOCc1ccncn1 4de01ac092e72fcbf99707b0f1dc70d0 [0,2,0,0,0,0|2,0,0]=4 12676 B13R1.337 CC(C)OCOCc1cnccn1 b3dc442db0c5090fed1f804529aad4e6 [0,2,0,0,0,0|2,0,0]=4 12677 B13R1.337 CC(C)OCOCc1ncccn1 6a516485bd3091f8f1bd771e7d1a34f9 [0,2,0,0,0,0|2,0,0]=4 12678 B13R1.337 CC(C)OCSCc1ccccc1 4dec8c95093f89c50131d4e494f4bdf2 [0,2,0,0,0,0|2,0,0]=4 12679 B13R1.337 CC(C)SCCNc1ccccc1 1320f99840214bec06e020d16be0842d [0,2,0,0,0,0|2,0,0]=4 12680 B13R1.337 CC(C)SCCNc1ccccn1 2cbd9d542df55dfcad82936006bcfe74 [0,2,0,0,0,0|1,0,0]=3 12681 B13R1.337 CC(C)SCCNc1cccnn1 2dfdb63668e8370fc4f2d0dbd4e3944b [0,2,0,0,0,0|2,0,0]=4 12682 B13R1.337 CC(C)SCCNc1ccncn1 6733e656a576caf4014571bcab6ab2aa [0,2,0,0,0,0|2,0,0]=4 12683 B13R1.337 CC(C)SCCNc1cnccn1 9a507dc46f7e56e75a9b38a46a70d46a [0,2,0,0,0,0|2,0,0]=4 12684 B13R1.337 CC(C)SCCNc1ncccn1 e209f4d911524d5b60a2e50c86a8fa30 [0,2,0,0,0,0|2,0,0]=4 12685 B13R1.337 CC(C)SCCOc1ccccn1 44bf8e93af6f7957a676af90cc056d74 [0,2,0,0,0,0|1,0,0]=3 12686 B13R1.337 CC(C)SCCOc1cnccn1 6fa23832fc7768a365c42cfa58e8582c [0,2,0,0,0,0|2,0,0]=4 12687 B13R1.337 CC(C)SCCOc1ncccn1 261fee340906dcbd496e2fe2dc9cefdc [0,2,0,0,0,0|2,0,0]=4 12688 B13R1.337 CC(F)COCCc1ccccc1 b88b84139ff28c4dba49e80922dfc527 [0,2,0,0,0,0|1,0,0]=3 12689 B13R1.337 CC(F)COCCc1ccccn1 cd3269008528377c2532be03a6c22b7a [0,2,0,0,0,0|0,0,0]=2 12690 B13R1.337 CC(F)COCCc1cccnc1 a755aebc088fdff610f1783889cf27e7 [0,2,0,0,0,0|2,0,0]=4 12691 B13R1.337 CC(F)COCCc1ccncc1 cd4acabb96c814c8dc3b9633b607d5b6 [0,2,0,0,0,0|2,0,0]=4 12692 B13R1.337 CC(O)CCCNc1ccccc1 e1481daff7134e6c32163687714ef7b4 [0,2,0,0,0,0|1,0,0]=3 12693 B13R1.337 CC(O)CCCNc1ccccn1 c41566a209329c15500b283f331d8db0 [0,2,0,0,0,0|0,0,0]=2 12694 B13R1.337 CC(O)CCCNc1cccnc1 b3f77fcb0af3672be4c1835eee34c474 [0,2,0,0,0,0|2,0,0]=4 12695 B13R1.337 CC(O)CCCNc1cccnn1 d8da3ccc95849701178c988a9f3d160b [0,2,0,0,0,0|1,0,0]=3 12696 B13R1.337 CC(O)CCCNc1ccncc1 cf7e61fbe26384720758599e8ec390f8 [0,2,0,0,0,0|2,0,0]=4 12697 B13R1.337 CC(O)CCCNc1ccncn1 a252883a2329c3162c2c7d191baa2957 [0,2,0,0,0,0|1,0,0]=3 12698 B13R1.337 CC(O)CCCNc1cnccn1 9ae2ae5c2da50c7a26c76ce4db864734 [0,2,0,0,0,0|1,0,0]=3 12699 B13R1.337 CC(O)CCCNc1cnncn1 a5abbc5b115e422bf3cd2b649664df36 [0,2,0,0,0,0|2,0,0]=4 12700 B13R1.337 CC(O)CCCNc1ncccn1 dc1fa47d554b9fdc2545e72f2e644cf5 [0,2,0,0,0,0|1,0,0]=3 12701 B13R1.337 CC(O)CCCNc1nccnn1 104c97ec133a4d94b158201a5849b7a8 [0,2,0,0,0,0|2,0,0]=4 12702 B13R1.337 CC(O)CCCNc1ncncn1 1f0063b67d582ef0eae5e8c2bb781a85 [0,2,0,0,0,0|2,0,0]=4 12703 B13R1.337 CC(O)CCNCc1ccccc1 cfa220d842ce3cae8909bfde7ef82284 [0,2,0,0,0,0|1,0,0]=3 12704 B13R1.337 CC(O)CCNCc1ccccn1 4dce02551de73786b0164f0a70a73f58 [0,2,0,0,0,0|0,0,0]=2 12705 B13R1.337 CC(O)CCNCc1cccnc1 b67c6453b0bd7c3134aa8790d323a7c0 [0,2,0,0,0,0|2,0,0]=4 12706 B13R1.337 CC(O)CCNCc1cccnn1 872e8755ec8aec46cc830f0665c2e3e4 [0,2,0,0,0,0|1,0,0]=3 12707 B13R1.337 CC(O)CCNCc1ccncc1 54be9c9c1b32120dceed8636a5c31518 [0,2,0,0,0,0|2,0,0]=4 12708 B13R1.337 CC(O)CCNCc1ccncn1 3a9d440402dca51e2eaab080523db965 [0,2,0,0,0,0|1,0,0]=3 12709 B13R1.337 CC(O)CCNCc1cnccn1 8e14bd477ef82ebecb66bb93e437140a [0,2,0,0,0,0|1,0,0]=3 12710 B13R1.337 CC(O)CCNCc1ncccn1 b46072601f00c239b3d1454b0ddfea03 [0,2,0,0,0,0|1,0,0]=3 12711 B13R1.337 CC(O)CNCCc1ccccc1 a17feeb1b67999943657abdea68adf32 [0,2,0,0,0,0|1,0,0]=3 12712 B13R1.337 CC(O)CNCCc1ccccn1 268379154892fe1c09468e2e1eb13e7d [0,2,0,0,0,0|0,0,0]=2 12713 B13R1.337 CC(O)CNCCc1cccnc1 af7cb075f6747b955e6b90bdab6d87e1 [0,2,0,0,0,0|2,0,0]=4 12714 B13R1.337 CC(O)CNCCc1ccncc1 160e3ad61e755edd52a9c93cf0d47bd8 [0,2,0,0,0,0|2,0,0]=4 12715 B13R1.337 CC(O)CNCCc1ccncn1 636d8c7331d1903b896a4690e240bb03 [0,2,0,0,0,0|1,0,0]=3 12716 B13R1.337 CC(O)CNCCc1cnccn1 64f3ee1722d99542cbf5153094d93b92 [0,2,0,0,0,0|1,0,0]=3 12717 B13R1.337 CC(O)CNCCc1ncccn1 465a59b48716cba53879f5b1916c0b82 [0,2,0,0,0,0|1,0,0]=3 12718 B13R1.337 CC(S)COCCc1ccccc1 1401e2c2628cc7296975b60d2c489fa0 [0,2,0,0,0,0|1,0,0]=3 12719 B13R1.337 CC(S)COCCc1ccccn1 664565a46f29b2f4ac51dffb1ebf890b [0,2,0,0,0,0|0,0,0]=2 12720 B13R1.337 CC(S)COCCc1cccnc1 dff381eb74c162404a00ef74a13d93e8 [0,2,0,0,0,0|2,0,0]=4 12721 B13R1.337 CC(S)COCCc1ccncc1 88b324a0d11297a1d788a4e0d9113a20 [0,2,0,0,0,0|2,0,0]=4 12722 B13R1.337 CN(C)CCCNc1ccccc1 64b213a8b2410fa9ad1808ec1488194d [0,2,0,0,0,0|2,0,0]=4 12723 B13R1.337 CN(C)CCCNc1ccccn1 1af57dd28d6e1c55fd8762022f5d8a34 [0,2,0,0,0,0|1,0,0]=3 12724 B13R1.337 CN(C)CCCNc1cccnn1 1c7aa4ef669f27dad2839ca31d005a2d [0,2,0,0,0,0|2,0,0]=4 12725 B13R1.337 CN(C)CCCNc1ccncn1 72f892884e996e2a82c4c8a4d774bc97 [0,2,0,0,0,0|2,0,0]=4 12726 B13R1.337 CN(C)CCCNc1cnccn1 e47f208cccbf13fbd62f5458efd48217 [0,2,0,0,0,0|2,0,0]=4 12727 B13R1.337 CN(C)CCCNc1ncccn1 836fc2808b9093f05df23ce9eb0f613a [0,2,0,0,0,0|2,0,0]=4 12728 B13R1.337 CN(C)CCCOc1ccccn1 f92a79e1476c168f59f0e8afb9025212 [0,2,0,0,0,0|1,0,0]=3 12729 B13R1.337 CN(C)CCCOc1cnccn1 45ae6f9ed974027c7cf0f59ea0ff459b [0,2,0,0,0,0|2,0,0]=4 12730 B13R1.337 CN(C)CCCOc1ncccn1 fd7bb97b000c34844f8444337e6542d6 [0,2,0,0,0,0|2,0,0]=4 12731 B13R1.337 CN(C)CCNCc1ccccc1 5d59de0a5362f9dd0332c7bbac95b919 [0,2,0,0,0,0|2,0,0]=4 12732 B13R1.337 CN(C)CCNCc1ccccn1 a27bf624973551c30b097b214a2f119d [0,2,0,0,0,0|1,0,0]=3 12733 B13R1.337 CN(C)CCNCc1cccnn1 98a03960f6998892cdba709018a09d21 [0,2,0,0,0,0|2,0,0]=4 12734 B13R1.337 CN(C)CCNCc1ccncn1 fac95f1afa386ef9a5fb06fccd409492 [0,2,0,0,0,0|2,0,0]=4 12735 B13R1.337 CN(C)CCNCc1cnccn1 6623c43fd46c0d72987f3bc699ca7cca [0,2,0,0,0,0|2,0,0]=4 12736 B13R1.337 CN(C)CCNCc1ncccn1 949495865c9d0ccc02bdb1e6f365a5ef [0,2,0,0,0,0|2,0,0]=4 12737 B13R1.337 CN(C)CCOCc1ccccc1 a35121ed4de0a81e5c46c843404814ef [0,2,0,0,0,0|2,0,0]=4 12738 B13R1.337 CN(C)CCOCc1ccccn1 2ee170f4af154dd1efd2d0c55c350e6d [0,2,0,0,0,0|1,0,0]=3 12739 B13R1.337 CN(C)CCOCc1cccnn1 fa80430878f390503370f28d28436885 [0,2,0,0,0,0|2,0,0]=4 12740 B13R1.337 CN(C)CCOCc1ccncn1 282c6f9533398b25b715ad49c7f5de1b [0,2,0,0,0,0|2,0,0]=4 12741 B13R1.337 CN(C)CCOCc1cnccn1 6621ecbae876a6b88bd41fa3cc083789 [0,2,0,0,0,0|2,0,0]=4 12742 B13R1.337 CN(C)CCOCc1ncccn1 32f8eb5ad1d93aaf78321e126ce447bc [0,2,0,0,0,0|2,0,0]=4 12743 B13R1.337 CN(C)CNCCc1ccccc1 477e27f88e5b75781486036a407834e3 [0,2,0,0,0,0|2,0,0]=4 12744 B13R1.337 CN(C)CNCCc1ccccn1 738e20a4657add028d69428d15b5fb3d [0,2,0,0,0,0|1,0,0]=3 12745 B13R1.337 CN(C)CNCCc1ccncn1 12e31588ece595799ef46184904080ed [0,2,0,0,0,0|2,0,0]=4 12746 B13R1.337 CN(C)CNCCc1cnccn1 4a542754da5311a0c16baac784517561 [0,2,0,0,0,0|2,0,0]=4 12747 B13R1.337 CN(C)CNCCc1ncccn1 2444b689ac58110bb3140d44373af9a7 [0,2,0,0,0,0|2,0,0]=4 12748 B13R1.337 CN(C)COCCc1ccccc1 388ebe28b60edfd4e1da7289ebe68ac0 [0,2,0,0,0,0|2,0,0]=4 12749 B13R1.337 CN(C)COCCc1ccccn1 eccfe5ad53c8b6814653b675e5ce812a [0,2,0,0,0,0|1,0,0]=3 12750 B13R1.337 CN(C)COCCc1ccncn1 cb87a3e71cca29862a1aa5f7e69bbe61 [0,2,0,0,0,0|2,0,0]=4 12751 B13R1.337 CN(C)COCCc1cnccn1 7b41b7db9f6bc798239dc671ee9f30ca [0,2,0,0,0,0|2,0,0]=4 12752 B13R1.337 CN(C)COCCc1ncccn1 1104dd9c1cc2a639070fcc8f46c9a445 [0,2,0,0,0,0|2,0,0]=4 12753 B13R1.337 CS(=O)CCCNc1ccccc1 5bd148ec84ef6a74c697b085445b3e7b [0,2,0,0,0,0|2,0,0]=4 12754 B13R1.337 CS(=O)CCCNc1ccccn1 3b55fab69e1dd3117e0f23dadc831a92 [0,2,0,0,0,0|1,0,0]=3 12755 B13R1.337 CS(=O)CCCNc1cccnn1 069e23852e9e9b95ab1510bec97f8c49 [0,2,0,0,0,0|2,0,0]=4 12756 B13R1.337 CS(=O)CCCNc1ccncn1 fb54bf8ac2978f5678eb15baaaa47722 [0,2,0,0,0,0|2,0,0]=4 12757 B13R1.337 CS(=O)CCCNc1cnccn1 e8f3e532420a9979303af79e3d5751e3 [0,2,0,0,0,0|2,0,0]=4 12758 B13R1.337 CS(=O)CCNCc1ccccc1 a1f5c0843bfd86fcf8a010417b2f4251 [0,2,0,0,0,0|2,0,0]=4 12759 B13R1.337 CS(=O)CCNCc1ccccn1 d734b6e27fd5f78d36615ec705fe626f [0,2,0,0,0,0|1,0,0]=3 12760 B13R1.337 CS(=O)CCNCc1cccnn1 0f8d7bfe2241f36114a3f30737286b4a [0,2,0,0,0,0|2,0,0]=4 12761 B13R1.337 CS(=O)CCNCc1ccncn1 c67cae5aef3370a75ae72d4fe836508b [0,2,0,0,0,0|2,0,0]=4 12762 B13R1.337 CS(=O)CCNCc1cnccn1 ce3f13d1b3eb9b27c238dde404f9f356 [0,2,0,0,0,0|2,0,0]=4 12763 B13R1.337 CS(=O)CCNCc1ncccn1 31e1bc1748488bc1663180537004ac6a [0,2,0,0,0,0|2,0,0]=4 12764 B13R1.337 CS(=O)CCOCc1ccccc1 1ecc10915ad29850bfa7b422fb3bb544 [0,2,0,0,0,0|2,0,0]=4 12765 B13R1.337 CS(=O)CCOCc1ccccn1 bf1341926c71cc43ab3b8da0a8f41941 [0,2,0,0,0,0|1,0,0]=3 12766 B13R1.337 CS(=O)CCOCc1cccnn1 dc16f6d2e26d8116634c5ae2bbead036 [0,2,0,0,0,0|2,0,0]=4 12767 B13R1.337 CS(=O)CCOCc1ccncn1 652148826e08e0e069728ed58df2d01e [0,2,0,0,0,0|2,0,0]=4 12768 B13R1.337 CS(=O)CCOCc1cnccn1 5c7858be025855f9a297791a6c713330 [0,2,0,0,0,0|2,0,0]=4 12769 B13R1.337 CS(=O)CCOCc1ncccn1 1a5d3714d2679486ea021c15a4cf4cfc [0,2,0,0,0,0|2,0,0]=4 12770 B13R1.337 C[C@@H](F)COCCc1ccccc1 324a42257d14510e2a4b2220aecdbdf4 [0,2,0,0,0,0|1,0,0]=3 12771 B13R1.337 C[C@@H](F)COCCc1ccccn1 7453a04e7a585ea113c0565c71541bf4 [0,2,0,0,0,0|0,0,0]=2 12772 B13R1.337 C[C@@H](F)COCCc1cccnc1 07a8e36e0b8179cbb4b33dfa1d419a7c [0,2,0,0,0,0|2,0,0]=4 12773 B13R1.337 C[C@@H](F)COCCc1ccncc1 ecf42f71bbb702e1f109917230b13e4f [0,2,0,0,0,0|2,0,0]=4 12774 B13R1.337 C[C@@H](O)CCNCc1ccccc1 9f24edf605181e24106c0c6050c94c8d [0,2,0,0,0,0|1,0,0]=3 12775 B13R1.337 C[C@@H](O)CCNCc1ccccn1 5d455c49f6b415415e0d28e092776cb7 [0,2,0,0,0,0|0,0,0]=2 12776 B13R1.337 C[C@@H](O)CCNCc1cccnc1 c159199acccb7a1c441cf22ff19a36b0 [0,2,0,0,0,0|2,0,0]=4 12777 B13R1.337 C[C@@H](O)CCNCc1cccnn1 bc757afd36a36166733d0ca76e1de3b4 [0,2,0,0,0,0|1,0,0]=3 12778 B13R1.337 C[C@@H](O)CCNCc1ccncn1 c4501d3ff0e652bbf4935a19f7baf378 [0,2,0,0,0,0|1,0,0]=3 12779 B13R1.337 C[C@@H](O)CCNCc1ncccn1 974d574121f79928cc4f9a22008493ee [0,2,0,0,0,0|1,0,0]=3 12780 B13R1.337 C[C@@H](O)CNCCc1ccccc1 35b5f13fb946c3a825fbd6735657a24e [0,2,0,0,0,0|1,0,0]=3 12781 B13R1.337 C[C@@H](O)CNCCc1ccccn1 c43c4f83289564e6983603813bd4d4e1 [0,2,0,0,0,0|0,0,0]=2 12782 B13R1.337 C[C@@H](O)CNCCc1cccnc1 a0ff3134a7a37d756db8079baf9632e2 [0,2,0,0,0,0|2,0,0]=4 12783 B13R1.337 C[C@@H](O)CNCCc1ccncc1 adeffa3c3ce831339aa9ef3c7b63077a [0,2,0,0,0,0|2,0,0]=4 12784 B13R1.337 C[C@@H](O)CNCCc1ccncn1 4aa048efb581cd38391af2edc6774c30 [0,2,0,0,0,0|1,0,0]=3 12785 B13R1.337 C[C@@H](O)CNCCc1cnccn1 8d8b96a2d833909f5f17d7f7c0eba13c [0,2,0,0,0,0|1,0,0]=3 12786 B13R1.337 C[C@@H](O)CNCCc1ncccn1 ace14c999cb66483264788dbc9feba8a [0,2,0,0,0,0|1,0,0]=3 12787 B13R1.337 C[C@H](F)COCCc1ccccc1 479d61bd28093766e98c2d08317df7a7 [0,2,0,0,0,0|1,0,0]=3 12788 B13R1.337 C[C@H](F)COCCc1ccccn1 b9e4cc640150acb06e931d7d17239af3 [0,2,0,0,0,0|0,0,0]=2 12789 B13R1.337 C[C@H](F)COCCc1cccnc1 fe3d6b5f6977d4a4409a5164ab864fb0 [0,2,0,0,0,0|2,0,0]=4 12790 B13R1.337 C[C@H](F)COCCc1ccncc1 04620e32be78ac17aee61b4397f76dfd [0,2,0,0,0,0|2,0,0]=4 12791 B13R1.337 C[C@H](O)CCNCc1ccccc1 01aee1d49778ff0afdde520c75c72c5a [0,2,0,0,0,0|1,0,0]=3 12792 B13R1.337 C[C@H](O)CCNCc1ccccn1 60298be12bf14aca760f8f9698717ae5 [0,2,0,0,0,0|0,0,0]=2 12793 B13R1.337 C[C@H](O)CCNCc1cccnc1 dae5c606c3c2e43d7ac0fe2eded2d19a [0,2,0,0,0,0|2,0,0]=4 12794 B13R1.337 C[C@H](O)CCNCc1cccnn1 fb90a4b3e920f4b404984b3948f0f14b [0,2,0,0,0,0|1,0,0]=3 12795 B13R1.337 C[C@H](O)CCNCc1ccncn1 ac470d26b7dfe670b1358587edad7c04 [0,2,0,0,0,0|1,0,0]=3 12796 B13R1.337 C[C@H](O)CCNCc1ncccn1 a1473982a5ff5fa3a685bab22129127f [0,2,0,0,0,0|1,0,0]=3 12797 B13R1.337 C[C@H](O)CNCCc1ccccc1 92faadc7c13ae1e992b2047adf854f5f [0,2,0,0,0,0|1,0,0]=3 12798 B13R1.337 C[C@H](O)CNCCc1ccccn1 9c39f185c01f63da527f0b24dc64f54d [0,2,0,0,0,0|0,0,0]=2 12799 B13R1.337 C[C@H](O)CNCCc1cccnc1 7d3a8b9b49e9cc647d2aac8305771e67 [0,2,0,0,0,0|2,0,0]=4 12800 B13R1.337 C[C@H](O)CNCCc1ccncc1 8c91587a15c177eeb482086722d3f61d [0,2,0,0,0,0|2,0,0]=4 12801 B13R1.337 C[C@H](O)CNCCc1ccncn1 c3b3ab063265bbcbd886595b8f12ef8e [0,2,0,0,0,0|1,0,0]=3 12802 B13R1.337 C[C@H](O)CNCCc1cnccn1 9afaae6e02c417f60391f337027c0117 [0,2,0,0,0,0|1,0,0]=3 12803 B13R1.337 C[C@H](O)CNCCc1ncccn1 9faf7e3aa8e56fb54831024650ced5ba [0,2,0,0,0,0|1,0,0]=3 12804 B13R1.337 FC(F)CCNCc1ccccc1 8a60d07046cd8a4e396f8a0931200c41 [0,2,0,0,0,0|2,0,0]=4 12805 B13R1.337 FC(F)CCNCc1ccccn1 7f64037da3d1b966f26e5ad7852930bf [0,2,0,0,0,0|1,0,0]=3 12806 B13R1.337 FC(F)CCNCc1cccnn1 461d33887ae6597b72fd5334a8194da7 [0,2,0,0,0,0|2,0,0]=4 12807 B13R1.337 FC(F)CCNCc1ccncn1 392397a37dc59bf24035f292494a5830 [0,2,0,0,0,0|2,0,0]=4 12808 B13R1.337 FC(F)CCNCc1ncccn1 6ced2f5f55d89f09dad0dda9ef5eb38e [0,2,0,0,0,0|2,0,0]=4 12809 B13R1.337 FC(F)CCOCc1ccccc1 94aece52affa4e34c61374b813f119d3 [0,2,0,0,0,0|2,0,0]=4 12810 B13R1.337 FC(F)CCOCc1ccccn1 d9b0c002c1e39d777662a4e97773387f [0,2,0,0,0,0|1,0,0]=3 12811 B13R1.337 FC(F)CCOCc1cccnn1 e89183495ce2edfc9451fa3baec37009 [0,2,0,0,0,0|2,0,0]=4 12812 B13R1.337 FC(F)CCOCc1ccncn1 04ac62913c55754957befb4aa3fb6284 [0,2,0,0,0,0|2,0,0]=4 12813 B13R1.337 FC(F)CCOCc1ncccn1 a6c8331a030af01eaafde28f02909116 [0,2,0,0,0,0|2,0,0]=4 12814 B13R1.337 FC(F)CNCCc1ccccc1 7c4c7aadfd7d14ebc7d8f343f8ddb805 [0,2,0,0,0,0|2,0,0]=4 12815 B13R1.337 FC(F)CNCCc1ccccn1 31919c0ce0bb7d2be366d56933f25fd7 [0,2,0,0,0,0|1,0,0]=3 12816 B13R1.337 FC(F)CNCCc1ccncn1 cc9529b3e65d75e9410c788265c37326 [0,2,0,0,0,0|2,0,0]=4 12817 B13R1.337 FC(F)CNCCc1cnccn1 d3fddc6c085a8a4b9032ac1241b204e6 [0,2,0,0,0,0|2,0,0]=4 12818 B13R1.337 FC(F)CNCCc1ncccn1 a147858a1f4d4efb7bca4cc26e1578de [0,2,0,0,0,0|2,0,0]=4 12819 B13R1.337 FC(F)COCCc1ccccc1 eb2ce10dcef858e0bcb39c29d76e88e5 [0,2,0,0,0,0|2,0,0]=4 12820 B13R1.337 FC(F)COCCc1ccccn1 24303420fcecdb1f4b6d3f5f88e7f925 [0,2,0,0,0,0|1,0,0]=3 12821 B13R1.337 FC(F)COCCc1ccncn1 0fcb71f047787f9e7c156940e8467428 [0,2,0,0,0,0|2,0,0]=4 12822 B13R1.337 FC(F)COCCc1cnccn1 ca4d3bf26b70cd093b84720394fc8c9a [0,2,0,0,0,0|2,0,0]=4 12823 B13R1.337 FC(F)COCCc1ncccn1 b3344ecb5a495b9aa4eb858aab6234da [0,2,0,0,0,0|2,0,0]=4 12824 B13R1.337 FC(F)OCCNc1ccccn1 7fdca97277decc74e93ec575c5c44132 [0,2,0,0,0,0|2,0,0]=4 12825 B13R1.337 FC(F)OCCOc1ccccn1 471b42a445e4318eaf755a9ee0a7e4ab [0,2,0,0,0,0|2,0,0]=4 12826 B13R1.337 NC(=O)CCCNc1ccccn1 5c861f17e06898f74b2a5d7dc7761e01 [0,2,0,0,0,0|1,0,1]=4 12827 B13R1.337 NC(=O)CCNCc1ccccn1 aa21e90ed2a9c775b2c0d36c513a04d9 [0,2,0,0,0,0|1,0,1]=4 12828 B13R1.337 NC(=O)CCOCc1ccccn1 d8a6cf3b569885550c04b6dae6167d91 [0,2,0,0,0,0|1,0,1]=4 12829 B13R1.337 NC(=O)CNCCc1ccccn1 4af4b4271ac4cfbbf6df67583c5e09c3 [0,2,0,0,0,0|1,0,1]=4 12830 B13R1.337 NC(=O)COCCc1ccccn1 b525b138f85081a5f0fc040617847b26 [0,2,0,0,0,0|1,0,1]=4 12831 B13R1.337 NC(=S)CCNCc1ccccn1 2d381a388b293304ec1e7d13e7605897 [0,2,0,0,0,0|1,0,1]=4 12832 B13R1.337 NC(=S)COCCc1ccccn1 6685df8e752a50dbefe40cd1cefc7cee [0,2,0,0,0,0|1,0,1]=4 12833 B13R1.337 O=C(O)CCCNc1ccccn1 fcf0f7bd4589757e85dcd6142b0f0d59 [0,2,0,0,0,0|1,0,1]=4 12834 B13R1.337 O=C(O)CCNCc1ccccn1 cb314c3527495a496af06ac4137661a9 [0,2,0,0,0,0|1,0,1]=4 12835 B13R1.337 O=C(O)CCOCc1ccccn1 f01c40fab5d86c0f7c7a54cb01680799 [0,2,0,0,0,0|1,0,1]=4 12836 B13R1.337 O=C(O)CNCCc1ccccn1 4888ff39cfb844c6fdaaa9b184121fa3 [0,2,0,0,0,0|1,0,1]=4 12837 B13R1.337 O=C(O)COCCc1ccccn1 7a91e61b132e3253da1feee9fedd6a57 [0,2,0,0,0,0|1,0,1]=4 12838 B13R1.337 O=S(O)CCNCc1ccccn1 767bb06f3934d0734748246389e378a7 [0,2,0,0,0,0|2,0,0]=4 12839 B13R1.337 O=S(O)COCCc1ccccn1 f190288d377b7cb56fa085963551b676 [0,2,0,0,0,0|2,0,0]=4 12840 B13R1.337 O=[N+]([O-])CCCNc1ccccn1 7aae733b7c637c67918e133df60ff7c8 [0,2,0,0,0,0|2,0,0]=4 12841 B13R1.337 O=[N+]([O-])CCCOc1ccccn1 4b502596c41bb9f96e3720fe394ce5ef [0,2,0,0,0,0|2,0,0]=4 12842 B13R1.337 O=[N+]([O-])CCOCc1ccccn1 046ff8ed2075f99c201559f6d1925750 [0,2,0,0,0,0|2,0,0]=4 12843 B13R1.337 O=[N+]([O-])CNCCc1ccccn1 06b776f90fb6e7231bcfda0bbe3203a4 [0,2,0,0,0,0|2,0,0]=4 12844 B13R1.337 O=[N+]([O-])COCCc1ccccn1 aa4033a60d5355c86c315465e75bdd97 [0,2,0,0,0,0|2,0,0]=4 12845 B13R1.555 BrCCNCCc1ccccc1I 0f0bbf24190cfb6d9cfb1618ee84d511 [0,2,0,0,0,0|2,0,0]=4 12846 B13R1.555 C#CCCCNc1ncccc1Br 7710fe229c65d1fe30a59f89102a164b [0,2,0,0,0,0|0,0,2]=4 12847 B13R1.555 C#CCCCNc1ncccc1C d1763b769d767e5d94d931ca05261550 [0,2,0,0,0,0|0,0,2]=4 12848 B13R1.555 C#CCCCNc1ncccc1Cl 524a32e28128ec360bb746dac7249e04 [0,2,0,0,0,0|0,0,2]=4 12849 B13R1.555 C#CCCCNc1ncccc1F db8a7464792677131b19337c249095b6 [0,2,0,0,0,0|0,0,2]=4 12850 B13R1.555 C#CCCCNc1ncccc1I d546f04dad842023f3ef412f3b20e88b [0,2,0,0,0,0|0,0,2]=4 12851 B13R1.555 C#CCCCOc1ncccc1Br af310d75c3cdd94b028175357ee3eb0a [0,2,0,0,0,0|0,0,2]=4 12852 B13R1.555 C#CCCCOc1ncccc1C fb1ece56dc8298f061a6ebaff1bb8190 [0,2,0,0,0,0|0,0,2]=4 12853 B13R1.555 C#CCCCOc1ncccc1Cl 48d82bb57f33e6c6bc30cc6e0531609c [0,2,0,0,0,0|0,0,2]=4 12854 B13R1.555 C#CCCCOc1ncccc1F ca9c28a4cfa2560fc9a1aa400b7c84f0 [0,2,0,0,0,0|0,0,2]=4 12855 B13R1.555 C#CCCNCc1ncccc1Br cb45475da5bb3d054da70c8cc080192f [0,2,0,0,0,0|0,0,2]=4 12856 B13R1.555 C#CCCNCc1ncccc1C abe858e6d5a12ba5a85aee2006575106 [0,2,0,0,0,0|0,0,2]=4 12857 B13R1.555 C#CCCNCc1ncccc1Cl 155a6651fff339b3d4f64c1dd2583217 [0,2,0,0,0,0|0,0,2]=4 12858 B13R1.555 C#CCCNCc1ncccc1F 277be546a478c7c015384a6af3349872 [0,2,0,0,0,0|0,0,2]=4 12859 B13R1.555 C#CCCOCc1ncccc1Br 624537bc375682aeea9d1ce6008c7182 [0,2,0,0,0,0|0,0,2]=4 12860 B13R1.555 C#CCCOCc1ncccc1C 90452538366c83ce66ddea130d0c15f0 [0,2,0,0,0,0|0,0,2]=4 12861 B13R1.555 C#CCCOCc1ncccc1Cl f46568340018b014de2f3bbdb29fcd3e [0,2,0,0,0,0|0,0,2]=4 12862 B13R1.555 C#CCCOCc1ncccc1F 3f4c8acd7eec10e2c6a15da8379aa790 [0,2,0,0,0,0|0,0,2]=4 12863 B13R1.555 C#CCNCCc1ncccc1Br c54adcdf7f67b8093e53f4a4089d76c8 [0,2,0,0,0,0|0,0,2]=4 12864 B13R1.555 C#CCNCCc1ncccc1C afe1bb8704eeb634ab46568035be88c7 [0,2,0,0,0,0|0,0,2]=4 12865 B13R1.555 C#CCOCCc1ncccc1C a6089d10f52aaadf787e20b4f601da8c [0,2,0,0,0,0|0,0,2]=4 12866 B13R1.555 C#CCOCCc1ncccc1F 74bfcfb64a7cd416baceb2734e5ffe23 [0,2,0,0,0,0|0,0,2]=4 12867 B13R1.555 C/C=C/CNCc1ncccc1Br a8407b1e7b21993b14b3d6240b967d9e [0,2,0,0,0,0|0,0,2]=4 12868 B13R1.555 C/C=C/CNCc1ncccc1C 77abfb6afe0aa7d623778a1dc347388e [0,2,0,0,0,0|0,0,2]=4 12869 B13R1.555 C/C=C/CNCc1ncccc1Cl e2859d90cf7b10e1949fc3704e3d5374 [0,2,0,0,0,0|0,0,2]=4 12870 B13R1.555 C/C=C/CNCc1ncccc1F a8bba89d5243f37a20d5b9a360a2e1cb [0,2,0,0,0,0|0,0,2]=4 12871 B13R1.555 C/C=C/COCc1ncccc1Br e54d1f4c367516ce210a69cab3743dec [0,2,0,0,0,0|0,0,2]=4 12872 B13R1.555 C/C=C/COCc1ncccc1C 99e92991b5404f9259e7a415611e6669 [0,2,0,0,0,0|0,0,2]=4 12873 B13R1.555 C/C=C/COCc1ncccc1Cl be2eacdb15bcc5b03aa616d240832f4f [0,2,0,0,0,0|0,0,2]=4 12874 B13R1.555 C/C=C/COCc1ncccc1F e7fe75280e1576be4718ff9e9c631b6d [0,2,0,0,0,0|0,0,2]=4 12875 B13R1.555 C/C=C\CNCc1ncccc1Br d5a5be5ec66e1c34c80e81245820ddb6 [0,2,0,0,0,0|0,0,2]=4 12876 B13R1.555 C/C=C\CNCc1ncccc1C f9c9ac71462a9af8d2cfd7edaa7d3e77 [0,2,0,0,0,0|0,0,2]=4 12877 B13R1.555 C/C=C\CNCc1ncccc1Cl 341583dc0e9bd06631b6c39f2fcc5cb9 [0,2,0,0,0,0|0,0,2]=4 12878 B13R1.555 C/C=C\CNCc1ncccc1F 4ec264f17bbdfaf600018b0c72daa167 [0,2,0,0,0,0|0,0,2]=4 12879 B13R1.555 C/C=C\COCc1ncccc1Br f7e6a575e907de47a11eed42b32a05ed [0,2,0,0,0,0|0,0,2]=4 12880 B13R1.555 C/C=C\COCc1ncccc1C 5872ad181abe21bec20366bddf9989ce [0,2,0,0,0,0|0,0,2]=4 12881 B13R1.555 C/C=C\COCc1ncccc1Cl 8254a88ecc6213c4772e24091224eadc [0,2,0,0,0,0|0,0,2]=4 12882 B13R1.555 C/C=C\COCc1ncccc1F a1bd7e58591b3b6c20890f363ed579eb [0,2,0,0,0,0|0,0,2]=4 12883 B13R1.555 C=CCCCNc1ncccc1Br ab398ab94577402162566c8ea2931c21 [0,2,0,0,0,0|0,0,2]=4 12884 B13R1.555 C=CCCCNc1ncccc1C e241720c5f782b082522014e6b329c60 [0,2,0,0,0,0|0,0,2]=4 12885 B13R1.555 C=CCCCNc1ncccc1Cl 9f6a57fa864b20da0b17b686f5dad9f5 [0,2,0,0,0,0|0,0,2]=4 12886 B13R1.555 C=CCCCNc1ncccc1F a8bd1482cbb89f76f59bc8fdd604528b [0,2,0,0,0,0|0,0,2]=4 12887 B13R1.555 C=CCCCNc1ncccc1I bf182e790cf77dbadb882457988ff23d [0,2,0,0,0,0|0,0,2]=4 12888 B13R1.555 C=CCCCNc1ncccc1O c9a582d349f6de5a31fdfafe3668b1a7 [0,2,0,0,0,0|0,0,2]=4 12889 B13R1.555 C=CCCCOc1ncccc1Br 36a72f10b7e6bef352f8375556001079 [0,2,0,0,0,0|0,0,2]=4 12890 B13R1.555 C=CCCCOc1ncccc1C bae1d4233dfc52e830b2f12612d580c1 [0,2,0,0,0,0|0,0,2]=4 12891 B13R1.555 C=CCCCOc1ncccc1Cl 3b791f64d32f2ac9e7df3979d4a77846 [0,2,0,0,0,0|0,0,2]=4 12892 B13R1.555 C=CCCCOc1ncccc1F 877b25d4696386675e37ae37f59bb364 [0,2,0,0,0,0|0,0,2]=4 12893 B13R1.555 C=CCCNCc1ncccc1Br 1c9f55481c0142a167a2fc8334b3e715 [0,2,0,0,0,0|0,0,2]=4 12894 B13R1.555 C=CCCNCc1ncccc1C 1dd7f64dabd2defaf386f1ea760e5af6 [0,2,0,0,0,0|0,0,2]=4 12895 B13R1.555 C=CCCNCc1ncccc1Cl 4eebe90e3522de644eb32f34d1815c58 [0,2,0,0,0,0|0,0,2]=4 12896 B13R1.555 C=CCCNCc1ncccc1F 86e24f0aa582610b6658fac34c519cf9 [0,2,0,0,0,0|0,0,2]=4 12897 B13R1.555 C=CCCOCc1ncccc1Br d08496e87879eadb8e3cbe42c291e646 [0,2,0,0,0,0|0,0,2]=4 12898 B13R1.555 C=CCCOCc1ncccc1C a1b616fc5eaef10f00e84ac5800d6394 [0,2,0,0,0,0|0,0,2]=4 12899 B13R1.555 C=CCCOCc1ncccc1Cl 6af22a7f44cb0f8302331550731e8bb0 [0,2,0,0,0,0|0,0,2]=4 12900 B13R1.555 C=CCCOCc1ncccc1F e54fef5249a1435bd78d9f2bc118e8fd [0,2,0,0,0,0|0,0,2]=4 12901 B13R1.555 C=CCNCCc1ncccc1Br e9e4ff13fb8f159b8d834d06fe590f3b [0,2,0,0,0,0|0,0,2]=4 12902 B13R1.555 C=CCNCCc1ncccc1C 9f4d82e206362c1da44d5333a5ec44f3 [0,2,0,0,0,0|0,0,2]=4 12903 B13R1.555 C=CCOCCc1ncccc1C 85b2f92c3dad7d494e9c48b58750e4a2 [0,2,0,0,0,0|0,0,2]=4 12904 B13R1.555 C=CCOCCc1ncccc1F b3f551e4848598561dcddea6eb124432 [0,2,0,0,0,0|0,0,2]=4 12905 B13R1.555 CC#CCNCc1ncccc1C 18d64540d1ef02b9e263c51214541825 [0,2,0,0,0,0|0,0,2]=4 12906 B13R1.555 CC#CCNCc1ncccc1Cl e4e3e903d1f7944893699f403da9d041 [0,2,0,0,0,0|0,0,2]=4 12907 B13R1.555 CC#CCNCc1ncccc1F 34b547fd9d22b0e1014daaa26abb702b [0,2,0,0,0,0|0,0,2]=4 12908 B13R1.555 CC#CCOCc1ncccc1C 5dd6e462d4849a35fce3358d4da9aa3c [0,2,0,0,0,0|0,0,2]=4 12909 B13R1.555 CC#CCOCc1ncccc1Cl 4a10aa9de9cbb7f40be34e324c43e4eb [0,2,0,0,0,0|0,0,2]=4 12910 B13R1.555 CC#CCOCc1ncccc1F aa4d4cd0048ecfb328cf80fd626f67ec [0,2,0,0,0,0|0,0,2]=4 12911 B13R1.555 CC/C=C/CNc1ncccc1Br 290914ddd6d053db0a8671d80a81b514 [0,2,0,0,0,0|0,0,2]=4 12912 B13R1.555 CC/C=C/CNc1ncccc1C 6a654ec03696457cb756b86277e1d00e [0,2,0,0,0,0|0,0,2]=4 12913 B13R1.555 CC/C=C/CNc1ncccc1Cl a3c4be82bf68367621cab1655e6c3306 [0,2,0,0,0,0|0,0,2]=4 12914 B13R1.555 CC/C=C/CNc1ncccc1F c39b801ea62e3680039085185826976e [0,2,0,0,0,0|0,0,2]=4 12915 B13R1.555 CC/C=C/CNc1ncccc1I 849acbfe2f8455001d48c29a0ebc0f5b [0,2,0,0,0,0|0,0,2]=4 12916 B13R1.555 CC/C=C/COc1ncccc1Br 2f010baeae4e4fdb4f890ff1db8215c4 [0,2,0,0,0,0|0,0,2]=4 12917 B13R1.555 CC/C=C/COc1ncccc1C 61c5fb7c10a229fee781fbd23b76ba46 [0,2,0,0,0,0|0,0,2]=4 12918 B13R1.555 CC/C=C/COc1ncccc1Cl 0e7ffe30d0b341860d6b69e755e06d3a [0,2,0,0,0,0|0,0,2]=4 12919 B13R1.555 CC/C=C/COc1ncccc1F cb81540b6279bed4b2fdd8d911719c38 [0,2,0,0,0,0|0,0,2]=4 12920 B13R1.555 CC=CCNCc1ncccc1Br 107b706f876c63831b8c2760cdd7c397 [0,2,0,0,0,0|0,0,2]=4 12921 B13R1.555 CC=CCNCc1ncccc1C 65fa4111c21a0e19072a5020876d928d [0,2,0,0,0,0|0,0,2]=4 12922 B13R1.555 CC=CCNCc1ncccc1Cl 4254545a5fc94436f7fcca4e1cb88bda [0,2,0,0,0,0|0,0,2]=4 12923 B13R1.555 CC=CCNCc1ncccc1F 1d4c2965c12f316fa7f48f236711fb4f [0,2,0,0,0,0|0,0,2]=4 12924 B13R1.555 CC=CCOCc1ncccc1Br 6f68e6578d2958f42cacad1d3fb51430 [0,2,0,0,0,0|0,0,2]=4 12925 B13R1.555 CC=CCOCc1ncccc1C c07167adc2c5cd958cd5465937a6995f [0,2,0,0,0,0|0,0,2]=4 12926 B13R1.555 CC=CCOCc1ncccc1Cl 1982da2bf1f28672e2267ca4237788ab [0,2,0,0,0,0|0,0,2]=4 12927 B13R1.555 CC=CCOCc1ncccc1F 4e9c55b95c349210012fb82699d50ae9 [0,2,0,0,0,0|0,0,2]=4 12928 B13R1.555 CCC#CCNc1ncccc1C 0c6716845d897390dc16929bf739a8d7 [0,2,0,0,0,0|0,0,2]=4 12929 B13R1.555 CCC#CCNc1ncccc1I 297d6cc41d43a60705e5f4d61a3ae45b [0,2,0,0,0,0|0,0,2]=4 12930 B13R1.555 CCC#CCOc1ncccc1Br b07d29537ac886a25e2af46b6dd8015b [0,2,0,0,0,0|0,0,2]=4 12931 B13R1.555 CCC#CCOc1ncccc1Cl ed89dcf879c6ad6e2057ba3a2181de87 [0,2,0,0,0,0|0,0,2]=4 12932 B13R1.555 CCC#CCOc1ncccc1F 49ac435bc4e23a50582d044fa78ae139 [0,2,0,0,0,0|0,0,2]=4 12933 B13R1.555 CCCCCNc1c[nH]ccc1=O 1c4c4c61483308ca26f2cc17b5c71a4b [0,2,0,0,0,0|2,0,0]=4 12934 B13R1.555 CCCCCNc1c[nH]ccc1=S 3ee19d13c91922023efd017a0114a63f [0,2,0,0,0,0|2,0,0]=4 12935 B13R1.555 CCCCCNc1ccc[nH]c1=O 465530c09c8cbd1b2cda1bb180dc7ba4 [0,2,0,0,0,0|2,0,0]=4 12936 B13R1.555 CCCCCNc1ccc[nH]c1=S 406dced48f142ebd3592279b36049e27 [0,2,0,0,0,0|2,0,0]=4 12937 B13R1.555 CCCCCNc1cccc[n+]1[O-] 1b93a060f4c96a0cd52039efa6c49cc1 [0,2,0,0,0,0|0,0,1]=3 12938 B13R1.555 CCCCCNc1ccccc1C ab4835f51f692b3730bc2c003aee2153 [0,2,0,0,0,0|1,0,0]=3 12939 B13R1.555 CCCCCNc1ccccc1Cl d23708f1a191f2441a32e38251f23567 [0,2,0,0,0,0|1,0,0]=3 12940 B13R1.555 CCCCCNc1ccccc1F ed949f1b872336a9d69d256808e24638 [0,2,0,0,0,0|1,0,0]=3 12941 B13R1.555 CCCCCNc1ccccc1I 0676661191108ae04708395171cff709 [0,2,0,0,0,0|1,0,0]=3 12942 B13R1.555 CCCCCNc1ccccc1S 1d469c01892a6b422b73f1375c3e54c0 [0,2,0,0,0,0|1,0,0]=3 12943 B13R1.555 CCCCCNc1cccnc1Br 509df81ac44d5fbc2c5e8541be9d2c5a [0,2,0,0,0,0|2,0,0]=4 12944 B13R1.555 CCCCCNc1cccnc1C 7e9714561ecbb4cc98f06b9a50023df6 [0,2,0,0,0,0|2,0,0]=4 12945 B13R1.555 CCCCCNc1cccnc1Cl 5f18472a7e013acc2668de2be5181844 [0,2,0,0,0,0|2,0,0]=4 12946 B13R1.555 CCCCCNc1cccnc1F 93b7b408823a7543e90fa89b266419d6 [0,2,0,0,0,0|2,0,0]=4 12947 B13R1.555 CCCCCNc1cccnc1I 5a3ee5469e7168978cf8df99033aae44 [0,2,0,0,0,0|2,0,0]=4 12948 B13R1.555 CCCCCNc1cccoc1=O 09f3035f32d809ef15e4beb27f4eb0cf [0,2,0,0,0,0|2,0,0]=4 12949 B13R1.555 CCCCCNc1ccncc1Br 61e4a601f8c146c6f85e654ebcebaef2 [0,2,0,0,0,0|2,0,0]=4 12950 B13R1.555 CCCCCNc1ccncc1C d2aeed68fad90692376005de31b30dd7 [0,2,0,0,0,0|2,0,0]=4 12951 B13R1.555 CCCCCNc1ccncc1Cl 9169bde8faac9c86118e3aa39b2545aa [0,2,0,0,0,0|2,0,0]=4 12952 B13R1.555 CCCCCNc1ccncc1F 34756a106cb9b661f73df72992a184fa [0,2,0,0,0,0|2,0,0]=4 12953 B13R1.555 CCCCCNc1ccncc1I 22ceca66cf549792135535ee40f057df [0,2,0,0,0,0|2,0,0]=4 12954 B13R1.555 CCCCCNc1cnccc1C 0b229142626ba418145d0614441956a0 [0,2,0,0,0,0|2,0,0]=4 12955 B13R1.555 CCCCCNc1cnccc1Cl 5e4bc8c720c94f8865e9f6ba55ab507e [0,2,0,0,0,0|2,0,0]=4 12956 B13R1.555 CCCCCNc1cnccc1F 19588401039401e9c475d219105a2a63 [0,2,0,0,0,0|2,0,0]=4 12957 B13R1.555 CCCCCNc1cnccc1I 6f0bd5df2e4b884a988fc58733483446 [0,2,0,0,0,0|2,0,0]=4 12958 B13R1.555 CCCCCNc1ncc[nH]c1=O 6b08974e72502fc4e35c0c3ce1a325bc [0,2,0,0,0,0|1,0,0]=3 12959 B13R1.555 CCCCCNc1ncccc1Br 2195bd131e9e37602b4651044de21cc5 [0,2,0,0,0,0|0,0,0]=2 12960 B13R1.555 CCCCCNc1ncccc1C 7be82a6b1733855d779fb449c5479318 [0,2,0,0,0,0|0,0,0]=2 12961 B13R1.555 CCCCCNc1ncccc1Cl c914ccbb5f0a4e54a66adf9ee5b69c59 [0,2,0,0,0,0|0,0,0]=2 12962 B13R1.555 CCCCCNc1ncccc1F 371319aa64e0aa9d11aee91513ad948a [0,2,0,0,0,0|0,0,0]=2 12963 B13R1.555 CCCCCNc1ncccc1I 50aef067bd2fd597fc84de4d1bdfd7d6 [0,2,0,0,0,0|0,0,0]=2 12964 B13R1.555 CCCCCNc1nccnc1Br a2fc57d33c02b55bc9abb482d576f569 [0,2,0,0,0,0|1,0,0]=3 12965 B13R1.555 CCCCCNc1nccnc1C 12cd1faf3845b239947f72aee134f457 [0,2,0,0,0,0|1,0,0]=3 12966 B13R1.555 CCCCCNc1nccnc1Cl deeb17aad2310424e57421ea6d4db43f [0,2,0,0,0,0|1,0,0]=3 12967 B13R1.555 CCCCCNc1nccnc1F f759bf05df64f109b9b140b185d399bb [0,2,0,0,0,0|1,0,0]=3 12968 B13R1.555 CCCCCNc1nccnc1I a4929332a45fec24444fb157ea9fe114 [0,2,0,0,0,0|1,0,0]=3 12969 B13R1.555 CCCCCNc1ncncc1Br e85664fe299458a54f0f7d09d1e94cc0 [0,2,0,0,0,0|1,0,0]=3 12970 B13R1.555 CCCCCNc1ncncc1Cl 47d94d978cfdfda8a6d7c49eeacbc364 [0,2,0,0,0,0|1,0,0]=3 12971 B13R1.555 CCCCCNc1ncncc1F 1589e5b7ba55691f5e9b874c66cf91b3 [0,2,0,0,0,0|1,0,0]=3 12972 B13R1.555 CCCCCNc1ncncc1I ff5285135cbc1fd3aac412ac24335f8e [0,2,0,0,0,0|1,0,0]=3 12973 B13R1.555 CCCCCNc1nnccc1C 1a93112f8077ed08d771a8a3026a634b [0,2,0,0,0,0|1,0,0]=3 12974 B13R1.555 CCCCCOc1ccc[nH]c1=S 22e4201c47469e79668edcc72e2f9c99 [0,2,0,0,0,0|2,0,0]=4 12975 B13R1.555 CCCCCOc1cccc[n+]1[O-] ea0ecb054163ace37802954bd7e4894f [0,2,0,0,0,0|0,0,1]=3 12976 B13R1.555 CCCCCOc1ccccc1C d10e9bf4d6a05afdf74ab561ace7b267 [0,2,0,0,0,0|1,0,0]=3 12977 B13R1.555 CCCCCOc1ccccc1Cl 6b8f308ceb3c6a85d034fc02b9385b40 [0,2,0,0,0,0|1,0,0]=3 12978 B13R1.555 CCCCCOc1ccccc1F 430a0356e2c7bd2638575aee03b58ed0 [0,2,0,0,0,0|1,0,0]=3 12979 B13R1.555 CCCCCOc1ccccc1I 2811b2011d4939101b1d3f090fdd35b3 [0,2,0,0,0,0|1,0,0]=3 12980 B13R1.555 CCCCCOc1cccnc1Br 0c5eb819bf3d48d0374520acd42aa6f5 [0,2,0,0,0,0|2,0,0]=4 12981 B13R1.555 CCCCCOc1cccnc1C 74711cdc14c779a983bc9292c6df9649 [0,2,0,0,0,0|2,0,0]=4 12982 B13R1.555 CCCCCOc1cccnc1Cl 4625652376fc093a999a07d283063e39 [0,2,0,0,0,0|2,0,0]=4 12983 B13R1.555 CCCCCOc1cccnc1F 07b99b9476f26ab9210e537fd8395665 [0,2,0,0,0,0|2,0,0]=4 12984 B13R1.555 CCCCCOc1cccnc1I a1951524f31ef00c32bd1286561b944a [0,2,0,0,0,0|2,0,0]=4 12985 B13R1.555 CCCCCOc1cccoc1=O 70f43d4045e70f103dda7abc557a610d [0,2,0,0,0,0|2,0,0]=4 12986 B13R1.555 CCCCCOc1ccncc1Br 156760739cf442d156134afea9ecb7ff [0,2,0,0,0,0|2,0,0]=4 12987 B13R1.555 CCCCCOc1ccncc1C c722b6491efb129d4981130186093856 [0,2,0,0,0,0|2,0,0]=4 12988 B13R1.555 CCCCCOc1ccncc1Cl d3246ce7c7073b44ae389afe7044258d [0,2,0,0,0,0|2,0,0]=4 12989 B13R1.555 CCCCCOc1ccncc1F 0c894b3f50fb8d5333ddda57b171aa57 [0,2,0,0,0,0|2,0,0]=4 12990 B13R1.555 CCCCCOc1cnccc1Br 87001e0621ea68df2c0bec8f6e9ae20a [0,2,0,0,0,0|2,0,0]=4 12991 B13R1.555 CCCCCOc1cnccc1C 95edd438a0752e1cad9ed57a57b315ac [0,2,0,0,0,0|2,0,0]=4 12992 B13R1.555 CCCCCOc1cnccc1Cl ac25429c99af375aa703ee44f275bb98 [0,2,0,0,0,0|2,0,0]=4 12993 B13R1.555 CCCCCOc1cnccc1F 1ca3c80c3b96b0eab98fa034aef45795 [0,2,0,0,0,0|2,0,0]=4 12994 B13R1.555 CCCCCOc1cnccc1I 327908fb05bf8a2ae75dcfddc8778c92 [0,2,0,0,0,0|2,0,0]=4 12995 B13R1.555 CCCCCOc1coccc1=O 71fb65b91e5361532db665511af29ea3 [0,2,0,0,0,0|2,0,0]=4 12996 B13R1.555 CCCCCOc1ncccc1Br ef0008f9cea32d2bd298347c701da7d3 [0,2,0,0,0,0|0,0,0]=2 12997 B13R1.555 CCCCCOc1ncccc1C c475e817f5cd90362dbfbaf862a59273 [0,2,0,0,0,0|0,0,0]=2 12998 B13R1.555 CCCCCOc1ncccc1Cl 0ea934b86ce7023c7d5f78fea4f58f18 [0,2,0,0,0,0|0,0,0]=2 12999 B13R1.555 CCCCCOc1ncccc1F cc1437c237f7881ea29492c0d0aefabd [0,2,0,0,0,0|0,0,0]=2 13000 B13R1.555 CCCCCOc1nccnc1Br 381474b148bff86664e91c54b6412048 [0,2,0,0,0,0|1,0,0]=3 13001 B13R1.555 CCCCCOc1nccnc1C d9b279d0eb985c224022309404ad2c40 [0,2,0,0,0,0|1,0,0]=3 13002 B13R1.555 CCCCCOc1ncncc1C 3631ffd4f95e310980141f0835456105 [0,2,0,0,0,0|1,0,0]=3 13003 B13R1.555 CCCCCOc1ncncc1Cl c1849f26e30b08a0b51b11eb78718425 [0,2,0,0,0,0|1,0,0]=3 13004 B13R1.555 CCCCCOc1ncncc1F 5d761b9c9ee32215a240d2a92ea73a34 [0,2,0,0,0,0|1,0,0]=3 13005 B13R1.555 CCCCCOc1ncncc1I 7ac89bc8a58a24effe6bc0d9a36d3e04 [0,2,0,0,0,0|1,0,0]=3 13006 B13R1.555 CCCCCOc1nnccc1C 9eba89978ffa2bc9397969b8731158d2 [0,2,0,0,0,0|1,0,0]=3 13007 B13R1.555 CCCCCOc1nnccc1Cl 05a437668063bdeea0810074ea9091ed [0,2,0,0,0,0|1,0,0]=3 13008 B13R1.555 CCCCCOc1nnccc1I 2895ae71f37addf8225726988c2a726c [0,2,0,0,0,0|1,0,0]=3 13009 B13R1.555 CCCCCOn1ccccc1=N 33735ac5c89f153fa59b47e483636311 [0,2,0,0,0,0|2,0,0]=4 13010 B13R1.555 CCCCCOn1ccccc1=O 4158b3ae2d301f5e36936e3333a47641 [0,2,0,0,0,0|2,0,0]=4 13011 B13R1.555 CCCCCOn1ccccc1=S 61393bdc699ddb116c12fded36d4e2bb [0,2,0,0,0,0|2,0,0]=4 13012 B13R1.555 CCCCNCc1cccc[n+]1[O-] d078c073bfa542fc8e6b53cb49e7e74a [0,2,0,0,0,0|0,0,1]=3 13013 B13R1.555 CCCCNCc1ccccc1Br 7cfb7544ec34a6c1dd18094b044273c8 [0,2,0,0,0,0|1,0,0]=3 13014 B13R1.555 CCCCNCc1ccccc1C ab29fbe7c58a67b5ca8373e373d5a8c0 [0,2,0,0,0,0|1,0,0]=3 13015 B13R1.555 CCCCNCc1ccccc1Cl 8adbed7a6527e2a81d1fc8833042b51d [0,2,0,0,0,0|1,0,0]=3 13016 B13R1.555 CCCCNCc1ccccc1F 4d3358a1d1188411dd3cd474125ed73a [0,2,0,0,0,0|1,0,0]=3 13017 B13R1.555 CCCCNCc1ccccc1I 78ddcc259f86c6ba0bf4036e82f5cf35 [0,2,0,0,0,0|1,0,0]=3 13018 B13R1.555 CCCCNCc1cccnc1Br 3ba782acd22e7c0892f1b2352ea8ff61 [0,2,0,0,0,0|2,0,0]=4 13019 B13R1.555 CCCCNCc1cccnc1C 631b6864bf6c05e5c6f2faf30ccc06cf [0,2,0,0,0,0|2,0,0]=4 13020 B13R1.555 CCCCNCc1cccnc1Cl 2967769c4770ac8dea993d81b4ad2b56 [0,2,0,0,0,0|2,0,0]=4 13021 B13R1.555 CCCCNCc1cccnc1F 74ad2280e7f3f497ff7ecff8b795bdb0 [0,2,0,0,0,0|2,0,0]=4 13022 B13R1.555 CCCCNCc1ccncc1Br 587e70f85e78692c610dee8513df917d [0,2,0,0,0,0|2,0,0]=4 13023 B13R1.555 CCCCNCc1ccncc1C 3e575a51b40160b35882c764c92d53d0 [0,2,0,0,0,0|2,0,0]=4 13024 B13R1.555 CCCCNCc1ccncc1Cl 112a5f2bbaed4151c753f89acd13ad86 [0,2,0,0,0,0|2,0,0]=4 13025 B13R1.555 CCCCNCc1ccncc1F 3d93ea820c0104e128311a0bd4a92433 [0,2,0,0,0,0|2,0,0]=4 13026 B13R1.555 CCCCNCc1cnccc1C 9d187c23b78b2fc39e81689a5d30fc28 [0,2,0,0,0,0|2,0,0]=4 13027 B13R1.555 CCCCNCc1ncccc1Br 6aa787303b404f2a253645dc50730f43 [0,2,0,0,0,0|0,0,0]=2 13028 B13R1.555 CCCCNCc1ncccc1C 7e34a56f85472df45b2722e501296a9f [0,2,0,0,0,0|0,0,0]=2 13029 B13R1.555 CCCCNCc1ncccc1Cl f5e4e31e65dd41817b26b9c739eb8df3 [0,2,0,0,0,0|0,0,0]=2 13030 B13R1.555 CCCCNCc1ncccc1F a6dd15e5368b7b154a1ac621f62562c0 [0,2,0,0,0,0|0,0,0]=2 13031 B13R1.555 CCCCNCc1nccnc1C 904e083dcb690c329b2319b828b9e788 [0,2,0,0,0,0|1,0,0]=3 13032 B13R1.555 CCCCNCc1nccnc1Cl 45c585762cbad847f8fac092575b7997 [0,2,0,0,0,0|1,0,0]=3 13033 B13R1.555 CCCCNCc1nnc[nH]c1=O 1f1b1ece045e1dcc1a2636d0d7b9b2bb [0,2,0,0,0,0|2,0,0]=4 13034 B13R1.555 CCCCNCc1nnccc1C c51c8e6da6616edb2979e1528d250eb1 [0,2,0,0,0,0|1,0,0]=3 13035 B13R1.555 CCCCOCc1ccc[nH]c1=O 9ba7ed04793e9783dc3e6ae00519126f [0,2,0,0,0,0|2,0,0]=4 13036 B13R1.555 CCCCOCc1ccccc1C 285e0d46f86c6405583b339b33a45748 [0,2,0,0,0,0|1,0,0]=3 13037 B13R1.555 CCCCOCc1ccccc1Cl 7e7ba135ee001955f5ddd8fc421f119d [0,2,0,0,0,0|1,0,0]=3 13038 B13R1.555 CCCCOCc1ccccc1F c860f48c6402dda7b64d980ab3448319 [0,2,0,0,0,0|1,0,0]=3 13039 B13R1.555 CCCCOCc1ccccc1I bb18ef6b0ca42d98ffdeec2537498cfd [0,2,0,0,0,0|1,0,0]=3 13040 B13R1.555 CCCCOCc1ccccc1S 64f0c6380a76dec8f594ad59644fa8e4 [0,2,0,0,0,0|1,0,0]=3 13041 B13R1.555 CCCCOCc1cccnc1Br bc68f7466bc11171f0a284ec813f7110 [0,2,0,0,0,0|2,0,0]=4 13042 B13R1.555 CCCCOCc1cccnc1C bfcd5c413956b365f9f402e473090128 [0,2,0,0,0,0|2,0,0]=4 13043 B13R1.555 CCCCOCc1cccnc1Cl d23c6a563085c8f739431056e0a39ac0 [0,2,0,0,0,0|2,0,0]=4 13044 B13R1.555 CCCCOCc1cccnc1F c0192266ca575bc0a14f2ea327f3b6b4 [0,2,0,0,0,0|2,0,0]=4 13045 B13R1.555 CCCCOCc1ccncc1Br cc90946f9bff45c892ba15869012dd90 [0,2,0,0,0,0|2,0,0]=4 13046 B13R1.555 CCCCOCc1ccncc1C c25fecec6b0a3da572e3367b3631a627 [0,2,0,0,0,0|2,0,0]=4 13047 B13R1.555 CCCCOCc1ccncc1Cl 3d175c7e9d1cfb0be4e9b06eceddc893 [0,2,0,0,0,0|2,0,0]=4 13048 B13R1.555 CCCCOCc1ccncc1F 00f7cd7f0be7e13dd02dbc73151903e0 [0,2,0,0,0,0|2,0,0]=4 13049 B13R1.555 CCCCOCc1ccncc1I 77495222c9e2dc9edf74da4f26ce9ccd [0,2,0,0,0,0|2,0,0]=4 13050 B13R1.555 CCCCOCc1cnccc1Br 0236e3131c08a1f4dbba09092c4873ad [0,2,0,0,0,0|2,0,0]=4 13051 B13R1.555 CCCCOCc1cnccc1C bfa7e590ec8f144785fb4d49f6e2f5c0 [0,2,0,0,0,0|2,0,0]=4 13052 B13R1.555 CCCCOCc1cnccc1Cl 9f0a961b4fc30b1dd5c9ba48348c779d [0,2,0,0,0,0|2,0,0]=4 13053 B13R1.555 CCCCOCc1cnccc1F 357319498944a27ac04890b0c42b8049 [0,2,0,0,0,0|2,0,0]=4 13054 B13R1.555 CCCCOCc1ncccc1Br fee1514f9bac54274fdecd08fb60192a [0,2,0,0,0,0|0,0,0]=2 13055 B13R1.555 CCCCOCc1ncccc1C c5fc49fc498bd4acdaa23bf0510530ea [0,2,0,0,0,0|0,0,0]=2 13056 B13R1.555 CCCCOCc1ncccc1Cl f9db8a93b14bf75104a5682dfe005de3 [0,2,0,0,0,0|0,0,0]=2 13057 B13R1.555 CCCCOCc1ncccc1F a0aa47bc852d4068f54c87f3b428358c [0,2,0,0,0,0|0,0,0]=2 13058 B13R1.555 CCCCOCc1nccnc1C f872819090ba02ac0e535d28a1fd6967 [0,2,0,0,0,0|1,0,0]=3 13059 B13R1.555 CCCCOCc1nccnc1Cl 42be2528b0ea7259c11664d7e5a891e9 [0,2,0,0,0,0|1,0,0]=3 13060 B13R1.555 CCCCOCc1ncncc1Br 8317a0bd6e557e08d0ea174a09b33412 [0,2,0,0,0,0|1,0,0]=3 13061 B13R1.555 CCCCOCc1nnccc1C 8fa179a64d0e7c35dec7ad5f373e0452 [0,2,0,0,0,0|1,0,0]=3 13062 B13R1.555 CCCNCCc1ccccc1Cl 1e6a4ce6c800b4816f29e5dcbc7b0a3a [0,2,0,0,0,0|1,0,0]=3 13063 B13R1.555 CCCNCCc1ccccc1F 2daeb8b961812440f186bae0215efef3 [0,2,0,0,0,0|1,0,0]=3 13064 B13R1.555 CCCNCCc1ccccc1I d75d64220e9d388209a631867c18167f [0,2,0,0,0,0|1,0,0]=3 13065 B13R1.555 CCCNCCc1ncccc1Br 70721a9e09654d38ad89fa3124cb8968 [0,2,0,0,0,0|0,0,0]=2 13066 B13R1.555 CCCNCCc1ncccc1C 13a3678578bb1906e81185326df20b66 [0,2,0,0,0,0|0,0,0]=2 13067 B13R1.555 CCCNCCn1ccccc1=O 16ebd1af99674ae5e60b1d7310cedd30 [0,2,0,0,0,0|2,0,0]=4 13068 B13R1.555 CCCNCCn1ncccc1=O ce76bd7b7df37f901356cabe23dd3ad2 [0,2,0,0,0,0|1,0,0]=3 13069 B13R1.555 CCCOCCc1ccccc1C 8b284ad15ff0ccc34faff373ea707ce7 [0,2,0,0,0,0|1,0,0]=3 13070 B13R1.555 CCCOCCc1ccccc1Cl 1755efd31f155372ced6fa325624afe7 [0,2,0,0,0,0|1,0,0]=3 13071 B13R1.555 CCCOCCc1ccccc1F 5a546371c6d3a39b1fcbeeaf2ca5fffc [0,2,0,0,0,0|1,0,0]=3 13072 B13R1.555 CCCOCCc1ccccc1I 5d73c5e615c8f79581f81a4444a08594 [0,2,0,0,0,0|1,0,0]=3 13073 B13R1.555 CCCOCCc1ccncc1C 8102b9a31ae0b62b887f88bc5ab5f106 [0,2,0,0,0,0|2,0,0]=4 13074 B13R1.555 CCCOCCc1ccncc1Cl 11592bc6102e83a064ca9fad4881e87e [0,2,0,0,0,0|2,0,0]=4 13075 B13R1.555 CCCOCCc1ccncc1F 5bb16318463af10a943bda7775314b32 [0,2,0,0,0,0|2,0,0]=4 13076 B13R1.555 CCCOCCc1ncccc1C 988c78086c89bdb4348098384afb0a5f [0,2,0,0,0,0|0,0,0]=2 13077 B13R1.555 CCCOCCc1ncccc1F 9b60d2c6648acd54ea599e72923434d3 [0,2,0,0,0,0|0,0,0]=2 13078 B13R1.555 CCCOCCc1nccnc1C 12156d9d49a1a38ed4f04b0df21658e2 [0,2,0,0,0,0|1,0,0]=3 13079 B13R1.555 CCCOCCn1ccccc1=O e7aea345ba25bb7a6c68841188337e9c [0,2,0,0,0,0|2,0,0]=4 13080 B13R1.555 CCNCCCc1ccccc1Br 6db57353e26258f7a2567c3d1b163969 [0,2,0,0,0,0|1,0,0]=3 13081 B13R1.555 CCNCCCc1ccccc1C b56b79b24a247ba31cf871bd33387a54 [0,2,0,0,0,0|1,0,0]=3 13082 B13R1.555 CCNCCCc1ccccc1Cl ce0c41fa4f4dbc6891d06b61aff51993 [0,2,0,0,0,0|1,0,0]=3 13083 B13R1.555 CCNCCCc1ccccc1F d3104a2ce9ac6c6cf9f35df496667fac [0,2,0,0,0,0|1,0,0]=3 13084 B13R1.555 CCNCCCn1ncccc1=O b35f50733a7fff4f2629a90abf532379 [0,2,0,0,0,0|1,0,0]=3 13085 B13R1.555 CCNCCOc1ccccc1C c2e074a65bb4e224b978336da565c108 [0,2,0,0,0,0|2,0,0]=4 13086 B13R1.555 CCNCCOc1ccccc1Cl 70c7f94cdc8a7baf8f51f5337d562fe9 [0,2,0,0,0,0|2,0,0]=4 13087 B13R1.555 CCNCCOc1ccccc1F 4de2d22e4c06c4ec58223acff5cbdb2b [0,2,0,0,0,0|2,0,0]=4 13088 B13R1.555 CCOCCCc1ccccc1Br 38433946c5e4899cf714e450be902c79 [0,2,0,0,0,0|1,0,0]=3 13089 B13R1.555 CCOCCCc1ccccc1C 46b5ea5d1d75516cee06f1d17c52bf59 [0,2,0,0,0,0|1,0,0]=3 13090 B13R1.555 CCOCCCc1ccccc1Cl cc310565aaf23421d0afe130b147cbf6 [0,2,0,0,0,0|1,0,0]=3 13091 B13R1.555 CCOCCCc1ccccc1F 58c11f57d5f17bb8b4c76b84c4b95e45 [0,2,0,0,0,0|1,0,0]=3 13092 B13R1.555 CCOCCCc1cccnc1F 850803b00d07e37c3182a6f8eb79e27a [0,2,0,0,0,0|2,0,0]=4 13093 B13R1.555 CCOCCCc1ccncc1C 49cf899f08f9a25485120b25c3207869 [0,2,0,0,0,0|2,0,0]=4 13094 B13R1.555 CCOCCCc1cnccc1C 7d7fa3a59bdc87576ad4c8312f2d1be6 [0,2,0,0,0,0|2,0,0]=4 13095 B13R1.555 CCOCCCc1ncccc1F fd9c3ed773b442386f7fa0ecb12b6be6 [0,2,0,0,0,0|0,0,0]=2 13096 B13R1.555 CCOCCNc1cccc[n+]1[O-] 68b0dc4cc03728c8b85745a29bdc9c4b [0,2,0,0,0,0|1,0,1]=4 13097 B13R1.555 CCOCCNc1ccccc1Br d2131a7de8428212140c421b3613936d [0,2,0,0,0,0|2,0,0]=4 13098 B13R1.555 CCOCCNc1ccccc1C 00d34757e78db2c32f72da653f9a7899 [0,2,0,0,0,0|2,0,0]=4 13099 B13R1.555 CCOCCNc1ccccc1Cl b8bf958eedd6e380b5ada03eb3e65929 [0,2,0,0,0,0|2,0,0]=4 13100 B13R1.555 CCOCCNc1ccccc1F 5a88f329e891636ae15b060a77b755cb [0,2,0,0,0,0|2,0,0]=4 13101 B13R1.555 CCOCCNc1ccccc1I 59763f08bc995858eaf315ae25bccd87 [0,2,0,0,0,0|2,0,0]=4 13102 B13R1.555 CCOCCNc1ccccc1S 7e35dc9f7da6bd7af548cb039cf8de47 [0,2,0,0,0,0|2,0,0]=4 13103 B13R1.555 CCOCCNc1ncc[nH]c1=O 38f2df914892d66c5c2e64bddc1e7f68 [0,2,0,0,0,0|2,0,0]=4 13104 B13R1.555 CCOCCNc1ncccc1Br 60b3019b1afa48dee39f3bd821f8907c [0,2,0,0,0,0|1,0,0]=3 13105 B13R1.555 CCOCCNc1ncccc1C c9cea25c78953cc8b6449ba01b900549 [0,2,0,0,0,0|1,0,0]=3 13106 B13R1.555 CCOCCNc1ncccc1Cl 37785535a803049e0bc106c11098d355 [0,2,0,0,0,0|1,0,0]=3 13107 B13R1.555 CCOCCNc1ncccc1F 5a1e96a48b4f373bbce7cf0e7a888366 [0,2,0,0,0,0|1,0,0]=3 13108 B13R1.555 CCOCCNc1ncccc1I 6e3d6ff366b74a7934e5e46bc2843093 [0,2,0,0,0,0|1,0,0]=3 13109 B13R1.555 CCOCCNc1ncccc1O 1a7c0c52d7cf6ce40f03cc401c94bffe [0,2,0,0,0,0|1,0,0]=3 13110 B13R1.555 CCOCCNc1nccnc1Br 54c19ce588138479b8e67780a0eb47c6 [0,2,0,0,0,0|2,0,0]=4 13111 B13R1.555 CCOCCNc1nccnc1C 676dc577c839b547e9027981b5f9bb09 [0,2,0,0,0,0|2,0,0]=4 13112 B13R1.555 CCOCCNc1nccnc1Cl 621fbc2edbdb5ebe3398da18a23da0d4 [0,2,0,0,0,0|2,0,0]=4 13113 B13R1.555 CCOCCNc1nccnc1F 4051a86e7d631bf6fab98e1bd1333a97 [0,2,0,0,0,0|2,0,0]=4 13114 B13R1.555 CCOCCNc1nccnc1I 25d5e64c052e41b7b49239a6953236b9 [0,2,0,0,0,0|2,0,0]=4 13115 B13R1.555 CCOCCNc1ncncc1Br 2e3e0c9c1ba4e487667bdcfe8b6d09fc [0,2,0,0,0,0|2,0,0]=4 13116 B13R1.555 CCOCCNc1ncncc1C 9fbc2b08461e0f11c472cd5f1ecc6657 [0,2,0,0,0,0|2,0,0]=4 13117 B13R1.555 CCOCCNc1ncncc1Cl a2bcd7f736a2674e55c9438b3f3eeef6 [0,2,0,0,0,0|2,0,0]=4 13118 B13R1.555 CCOCCNc1ncncc1F 56a18adbc4e6bef5ab48ddd108ce8be5 [0,2,0,0,0,0|2,0,0]=4 13119 B13R1.555 CCOCCNc1ncncc1I ea692e8b970697f8a76c1c12e156e1d5 [0,2,0,0,0,0|2,0,0]=4 13120 B13R1.555 CCOCCNc1nnccc1C 8d27a1a20d0272a8aded01a7a0201774 [0,2,0,0,0,0|2,0,0]=4 13121 B13R1.555 CCOCCNc1nnccc1O def5164d0550caaac0e45917098c929b [0,2,0,0,0,0|2,0,0]=4 13122 B13R1.555 CCOCCOc1cccc[n+]1[O-] f73306041fb80f163bdc5f37a237838c [0,2,0,0,0,0|1,0,1]=4 13123 B13R1.555 CCOCCOc1ccccc1Br 47d04fa9051bd6c099c5323aba839fda [0,2,0,0,0,0|2,0,0]=4 13124 B13R1.555 CCOCCOc1ccccc1C f6c1872b47672019802e835f1949d7cf [0,2,0,0,0,0|2,0,0]=4 13125 B13R1.555 CCOCCOc1ccccc1Cl 78c0c5980b10fe6057d3bd313bba35ca [0,2,0,0,0,0|2,0,0]=4 13126 B13R1.555 CCOCCOc1ccccc1F b669022624a8f380e61a0087eca76ece [0,2,0,0,0,0|2,0,0]=4 13127 B13R1.555 CCOCCOc1ccccc1I 4cd763f2396672261ef7657cb52faf95 [0,2,0,0,0,0|2,0,0]=4 13128 B13R1.555 CCOCCOc1ccccc1S 4f7645e5c2f1443833bbe23ffbd7b851 [0,2,0,0,0,0|2,0,0]=4 13129 B13R1.555 CCOCCOc1ncccc1Br cc965933ba3e111014caea4d7a7d5356 [0,2,0,0,0,0|1,0,0]=3 13130 B13R1.555 CCOCCOc1ncccc1C e76455ee18616ffcd8b11667ab1c6d69 [0,2,0,0,0,0|1,0,0]=3 13131 B13R1.555 CCOCCOc1ncccc1Cl 8c0023c2ff7f9f8ff863fd700d495497 [0,2,0,0,0,0|1,0,0]=3 13132 B13R1.555 CCOCCOc1ncccc1F 677d153015cb78fde02287c0d2fe1f9b [0,2,0,0,0,0|1,0,0]=3 13133 B13R1.555 CCOCCOc1nccnc1Br 37e80eb6b4b5f134ca6982252a1428db [0,2,0,0,0,0|2,0,0]=4 13134 B13R1.555 CCOCCOc1nccnc1C ca70a1d63af3e0710193ebd50e17457e [0,2,0,0,0,0|2,0,0]=4 13135 B13R1.555 CCOCCOc1ncncc1C 8fb0523a51cc5ba0fd9ea2155e982e9f [0,2,0,0,0,0|2,0,0]=4 13136 B13R1.555 CCOCCOc1ncncc1Cl 394a54033d64d3b0fd91933e481c1b60 [0,2,0,0,0,0|2,0,0]=4 13137 B13R1.555 CCOCCOc1ncncc1F 97d3ba5df11b17c2770b4f81496a2252 [0,2,0,0,0,0|2,0,0]=4 13138 B13R1.555 CCOCCOc1ncncc1I de5ed5882c0fd64cb4935f9dd996b931 [0,2,0,0,0,0|2,0,0]=4 13139 B13R1.555 CCOCCOc1nnccc1C fec9064849ddd3ddf20040f73f0ea387 [0,2,0,0,0,0|2,0,0]=4 13140 B13R1.555 CCOCCOc1nnccc1Cl de7a849df7268994217452ba7b9b5cda [0,2,0,0,0,0|2,0,0]=4 13141 B13R1.555 CCOCCOc1nnccc1I ccffed98b1c99c67e8cffb86441503ab [0,2,0,0,0,0|2,0,0]=4 13142 B13R1.555 CCOCCSc1ccccc1Br baa10d819bc501d9b729922bdc416a2e [0,2,0,0,0,0|2,0,0]=4 13143 B13R1.555 CCOCCSc1ccccc1Cl 72dd216e0d0885ac65bcecb4cec0f0fb [0,2,0,0,0,0|2,0,0]=4 13144 B13R1.555 CCOCCSc1ccccc1F 5ca0026ee855d0086e3e3a18777bea85 [0,2,0,0,0,0|2,0,0]=4 13145 B13R1.555 CCOCNCc1cccc[n+]1[O-] 3d86057b266a7beece70f75c08060a4b [0,2,0,0,0,0|1,0,1]=4 13146 B13R1.555 CCOCNCc1ccccc1Cl c1ca65693e14c54ebdb9252d98dd9cfd [0,2,0,0,0,0|2,0,0]=4 13147 B13R1.555 CCOCNCc1ccccc1I 1928ad5ac5d4fed5847059f727e1f1de [0,2,0,0,0,0|2,0,0]=4 13148 B13R1.555 CCOCNCc1ncccc1Br 5f5dc62142583f70f12af7ea70302f03 [0,2,0,0,0,0|1,0,0]=3 13149 B13R1.555 CCOCNCc1ncccc1C a905e270903e8cdf431954b2a0106ed1 [0,2,0,0,0,0|1,0,0]=3 13150 B13R1.555 CCOCNCc1ncccc1Cl 2ee0605852e0da7c5234a52a756dc002 [0,2,0,0,0,0|1,0,0]=3 13151 B13R1.555 CCOCNCc1ncccc1F f38f65c9a0f210888fa9c181c96f653b [0,2,0,0,0,0|1,0,0]=3 13152 B13R1.555 CCOCNCc1nccnc1Cl 9c4dbc99a588f42eee18e545bd1b9d5e [0,2,0,0,0,0|2,0,0]=4 13153 B13R1.555 CCOCNCc1nnccc1C a2ecd3b1e35a803c0edc3ef44227be18 [0,2,0,0,0,0|2,0,0]=4 13154 B13R1.555 CCOCOCc1ncccc1Cl 7704faa196931e18e19e1c3c6590f2a8 [0,2,0,0,0,0|1,0,0]=3 13155 B13R1.555 CCOCOCc1nccnc1C 2a336874497f4e6a922494f4a1b2e041 [0,2,0,0,0,0|2,0,0]=4 13156 B13R1.555 CCOCOCc1nccnc1Cl 321c9e3e02def17f3a74898a662ebcec [0,2,0,0,0,0|2,0,0]=4 13157 B13R1.555 CCSCCNc1cccc[n+]1[O-] 7eb1b427cea4d00b21136988f05740c2 [0,2,0,0,0,0|1,0,1]=4 13158 B13R1.555 CCSCCNc1ccccc1C 5a3e4ca2aab0ce219b8b4698ed987ff2 [0,2,0,0,0,0|2,0,0]=4 13159 B13R1.555 CCSCCNc1ccccc1Cl e1e9749b9029ce8e5e1941d15ea3e67b [0,2,0,0,0,0|2,0,0]=4 13160 B13R1.555 CCSCCNc1ccccc1F 21479b2f7d75e3d66cbb820be4eabe94 [0,2,0,0,0,0|2,0,0]=4 13161 B13R1.555 CCSCCNc1ccccc1I e47bb94ebbfd69a39fc15d203e66ad79 [0,2,0,0,0,0|2,0,0]=4 13162 B13R1.555 CCSCCNc1ccccc1S b2c67dc20314d905ebec31103ba0d106 [0,2,0,0,0,0|2,0,0]=4 13163 B13R1.555 CCSCCNc1ncccc1Br ed6335b77d6c8ce29d397e31f8f703a4 [0,2,0,0,0,0|1,0,0]=3 13164 B13R1.555 CCSCCNc1ncccc1C 573bcd1969a95f2818dc1279c05faa15 [0,2,0,0,0,0|1,0,0]=3 13165 B13R1.555 CCSCCNc1ncccc1Cl 49ef66920d296625158e4e8639283a84 [0,2,0,0,0,0|1,0,0]=3 13166 B13R1.555 CCSCCNc1ncccc1F 05524602024124d07d4de06630c408c3 [0,2,0,0,0,0|1,0,0]=3 13167 B13R1.555 CCSCCNc1ncccc1I 49ef9f7e4655b7c6f90cdb7df7e4772f [0,2,0,0,0,0|1,0,0]=3 13168 B13R1.555 CCSCCNc1nccnc1Br 49233e2791f390adaae8ff458ab62e17 [0,2,0,0,0,0|2,0,0]=4 13169 B13R1.555 CCSCCNc1nccnc1C d8c01c48adcae5f21efbd8610755b3ee [0,2,0,0,0,0|2,0,0]=4 13170 B13R1.555 CCSCCNc1nccnc1Cl aeea55286c465fc7070c2e67c1781917 [0,2,0,0,0,0|2,0,0]=4 13171 B13R1.555 CCSCCNc1nccnc1I 32d55b65c66b7e2530ef314f81c1a9c9 [0,2,0,0,0,0|2,0,0]=4 13172 B13R1.555 CCSCCNc1ncncc1Br f56ea71ad13996f0608338ed2e96c0d8 [0,2,0,0,0,0|2,0,0]=4 13173 B13R1.555 CCSCCNc1ncncc1C 1ec4b1e29ee3bd533eb89c0236e49735 [0,2,0,0,0,0|2,0,0]=4 13174 B13R1.555 CCSCCNc1ncncc1Cl 9500d06e66e946c203583ab8ff2bfc04 [0,2,0,0,0,0|2,0,0]=4 13175 B13R1.555 CCSCCNc1ncncc1F 3216b2cabc71b3efca501b9f240ae24c [0,2,0,0,0,0|2,0,0]=4 13176 B13R1.555 CCSCCNc1ncncc1I 119e1d4f78a8136565f89fb44060b95a [0,2,0,0,0,0|2,0,0]=4 13177 B13R1.555 CCSCCNc1nnccc1C 296721d026e1c0652dc3ff9aec8c1161 [0,2,0,0,0,0|2,0,0]=4 13178 B13R1.555 CCSCCOc1cccc[n+]1[O-] fc02c31d124a3cd26f0c7ea1195a44c0 [0,2,0,0,0,0|1,0,1]=4 13179 B13R1.555 CCSCCOc1ccccc1C 8086a44157389c20532d264583ff069a [0,2,0,0,0,0|2,0,0]=4 13180 B13R1.555 CCSCCOc1ccccc1Cl a6fc286a46e6531b5b4cad0053205990 [0,2,0,0,0,0|2,0,0]=4 13181 B13R1.555 CCSCCOc1ccccc1F a3a68d1289895f2075d84b6ded4edf0d [0,2,0,0,0,0|2,0,0]=4 13182 B13R1.555 CCSCCOc1ccccc1I c0021fc9ef755ce9249c9e48083be11f [0,2,0,0,0,0|2,0,0]=4 13183 B13R1.555 CCSCCOc1ncccc1Br e1f127dd939a3874498b3cb62e67c6bd [0,2,0,0,0,0|1,0,0]=3 13184 B13R1.555 CCSCCOc1ncccc1C c136ed5d2fe59017c1915afd7802d7c7 [0,2,0,0,0,0|1,0,0]=3 13185 B13R1.555 CCSCCOc1ncccc1Cl 030d996d93496601cca4a2a008a9a2a6 [0,2,0,0,0,0|1,0,0]=3 13186 B13R1.555 CCSCCOc1ncccc1F 44f64f42f2620de698947ba3eacb47e4 [0,2,0,0,0,0|1,0,0]=3 13187 B13R1.555 CCSCCOc1nccnc1Br d65b5287255404ef8e3ef71a53265c58 [0,2,0,0,0,0|2,0,0]=4 13188 B13R1.555 CCSCCOc1nccnc1C bf00e5fbbcf69192d5eef4aaff52e1ed [0,2,0,0,0,0|2,0,0]=4 13189 B13R1.555 CCSCCOc1ncncc1C a72d34ef381789f0b869d2922b42d272 [0,2,0,0,0,0|2,0,0]=4 13190 B13R1.555 CCSCCOc1ncncc1Cl 3a0a4b50d91989f06898dfc7b17b9cb7 [0,2,0,0,0,0|2,0,0]=4 13191 B13R1.555 CCSCCOc1ncncc1F 179473c2e54c3c0212f35e1cb9b9e65c [0,2,0,0,0,0|2,0,0]=4 13192 B13R1.555 CCSCCOc1ncncc1I 2172ec90080859bbbae0dca1752677ee [0,2,0,0,0,0|2,0,0]=4 13193 B13R1.555 CCSCCOc1nnccc1C c128880979148d969528a48969a349ac [0,2,0,0,0,0|2,0,0]=4 13194 B13R1.555 CCSCCOc1nnccc1Cl 9e6ab30bd80b7f81898647b0ce65eef0 [0,2,0,0,0,0|2,0,0]=4 13195 B13R1.555 CCSCCOc1nnccc1I d04d23bcdc348a89ae44ab1da14270d8 [0,2,0,0,0,0|2,0,0]=4 13196 B13R1.555 COCCCNc1cccc[n+]1[O-] 30dbc873e0139964600fc614908ab04a [0,2,0,0,0,0|1,0,1]=4 13197 B13R1.555 COCCCNc1ccccc1Br 375e460be6cbf08bcfbb557508e56387 [0,2,0,0,0,0|2,0,0]=4 13198 B13R1.555 COCCCNc1ccccc1C 1610ef9eab7335dd8bce8290194a1401 [0,2,0,0,0,0|2,0,0]=4 13199 B13R1.555 COCCCNc1ccccc1Cl be06246c3bb939201c67eb81f47e0594 [0,2,0,0,0,0|2,0,0]=4 13200 B13R1.555 COCCCNc1ccccc1F 27a7ffadf10ba488c0d05191f64e120f [0,2,0,0,0,0|2,0,0]=4 13201 B13R1.555 COCCCNc1ccccc1I 4e0d9b8018a63a9523c946b9d8bcd837 [0,2,0,0,0,0|2,0,0]=4 13202 B13R1.555 COCCCNc1ccccc1S 7393604ea4a7756f073a394454230add [0,2,0,0,0,0|2,0,0]=4 13203 B13R1.555 COCCCNc1ncc[nH]c1=O 17e6bad32153c49ee02c0c6a75ceed2e [0,2,0,0,0,0|2,0,0]=4 13204 B13R1.555 COCCCNc1ncccc1Br 444cd392b451b26eb3a223225ad7bd2d [0,2,0,0,0,0|1,0,0]=3 13205 B13R1.555 COCCCNc1ncccc1C c2a2697744575516e6bac5b6516e0c76 [0,2,0,0,0,0|1,0,0]=3 13206 B13R1.555 COCCCNc1ncccc1Cl 7c7e6345d661f57f44dfb7cf6391a161 [0,2,0,0,0,0|1,0,0]=3 13207 B13R1.555 COCCCNc1ncccc1F 1f8092c3020f6e7ac5a0f1ce0a3daba2 [0,2,0,0,0,0|1,0,0]=3 13208 B13R1.555 COCCCNc1ncccc1I ebbd467722efc48836a5082c7558c7a5 [0,2,0,0,0,0|1,0,0]=3 13209 B13R1.555 COCCCNc1nccnc1Br 21b2521cb24a052e9706e95a019d0d02 [0,2,0,0,0,0|2,0,0]=4 13210 B13R1.555 COCCCNc1nccnc1C eca9d742d08146b9b1318047bcafbed8 [0,2,0,0,0,0|2,0,0]=4 13211 B13R1.555 COCCCNc1nccnc1Cl 2b830f8180b9b54c02a95cf83d4c93a8 [0,2,0,0,0,0|2,0,0]=4 13212 B13R1.555 COCCCNc1nccnc1I 62b248ba20eb16ed49bfb2ec41ac05bd [0,2,0,0,0,0|2,0,0]=4 13213 B13R1.555 COCCCNc1ncncc1Br ef44d3c1f466eafb76ca4f862733ccc7 [0,2,0,0,0,0|2,0,0]=4 13214 B13R1.555 COCCCNc1ncncc1C 9cc27df6a691b670c28b17f759120b4d [0,2,0,0,0,0|2,0,0]=4 13215 B13R1.555 COCCCNc1ncncc1Cl 301bcf20c6a1449b2eed5ee3a733ed04 [0,2,0,0,0,0|2,0,0]=4 13216 B13R1.555 COCCCNc1ncncc1F 0a09f145c67d117b5e5ff8e05f21d551 [0,2,0,0,0,0|2,0,0]=4 13217 B13R1.555 COCCCNc1ncncc1I c2f5f89c765889ea983f6875f940dfad [0,2,0,0,0,0|2,0,0]=4 13218 B13R1.555 COCCCNc1nnccc1C 1dd408a21dc6712720b99c3c170a81f5 [0,2,0,0,0,0|2,0,0]=4 13219 B13R1.555 COCCCOc1cccc[n+]1[O-] c724e588bf433fb92184382409bceb8b [0,2,0,0,0,0|1,0,1]=4 13220 B13R1.555 COCCCOc1ccccc1Br f9378dd53d43e87917ad7aabf69876b2 [0,2,0,0,0,0|2,0,0]=4 13221 B13R1.555 COCCCOc1ccccc1C 10e220637d7405d9b523630b0a3a8a1a [0,2,0,0,0,0|2,0,0]=4 13222 B13R1.555 COCCCOc1ccccc1Cl 5756d5027ff9cbbeb7e28631477593f7 [0,2,0,0,0,0|2,0,0]=4 13223 B13R1.555 COCCCOc1ccccc1F 63348a2b17f6bddab9267e5716dffcdb [0,2,0,0,0,0|2,0,0]=4 13224 B13R1.555 COCCCOc1ccccc1I d65b10b7ed4b37312411b9d82dc8cd71 [0,2,0,0,0,0|2,0,0]=4 13225 B13R1.555 COCCCOc1ccccc1S 15017930f2a664297601197d5edca135 [0,2,0,0,0,0|2,0,0]=4 13226 B13R1.555 COCCCOc1ncccc1Br 58b3f8e5c4c4271169b614eb2f3cf5e4 [0,2,0,0,0,0|1,0,0]=3 13227 B13R1.555 COCCCOc1ncccc1C 429ffbfc9a5f30979bebd936ca818aeb [0,2,0,0,0,0|1,0,0]=3 13228 B13R1.555 COCCCOc1ncccc1Cl c7c0f44ce20ce279162ce38b4ab27dd1 [0,2,0,0,0,0|1,0,0]=3 13229 B13R1.555 COCCCOc1ncccc1F 160bebaeb8e8b8fb9c8919c8c02bc2b1 [0,2,0,0,0,0|1,0,0]=3 13230 B13R1.555 COCCCOc1nccnc1Br 2ce53cb86797ef53c454e3685a197254 [0,2,0,0,0,0|2,0,0]=4 13231 B13R1.555 COCCCOc1nccnc1C 7d4ffb107ac825615347527f734179b2 [0,2,0,0,0,0|2,0,0]=4 13232 B13R1.555 COCCCOc1ncncc1C 965df24619af78dc23b803f012e8aade [0,2,0,0,0,0|2,0,0]=4 13233 B13R1.555 COCCCOc1ncncc1Cl 1d232dae166da06e8b35bea995e61d08 [0,2,0,0,0,0|2,0,0]=4 13234 B13R1.555 COCCCOc1ncncc1F 8a7d6c0e885c6e2d9d5762afc69ee0fd [0,2,0,0,0,0|2,0,0]=4 13235 B13R1.555 COCCCOc1ncncc1I de25f9b8af226796607dee5fb410288d [0,2,0,0,0,0|2,0,0]=4 13236 B13R1.555 COCCCOc1nnccc1C 33ccfe3197962f256faff2de5198e4cb [0,2,0,0,0,0|2,0,0]=4 13237 B13R1.555 COCCCOc1nnccc1Cl 6acafe5ccfe7e5721917ef934dc4b8b6 [0,2,0,0,0,0|2,0,0]=4 13238 B13R1.555 COCCCOc1nnccc1I f088ad6cf1165c8caf27f00db0d3fc07 [0,2,0,0,0,0|2,0,0]=4 13239 B13R1.555 COCCNCc1cccc[n+]1[O-] fed316e31985b5266f48c9c775cc72d6 [0,2,0,0,0,0|1,0,1]=4 13240 B13R1.555 COCCNCc1ccccc1Br 35c415dfa6f3636c7011aef10d75ced0 [0,2,0,0,0,0|2,0,0]=4 13241 B13R1.555 COCCNCc1ccccc1C da9745e46c15229a0d7f2276538bbb61 [0,2,0,0,0,0|2,0,0]=4 13242 B13R1.555 COCCNCc1ccccc1Cl 15d99cbb339cf4d18b903c80652511d8 [0,2,0,0,0,0|2,0,0]=4 13243 B13R1.555 COCCNCc1ccccc1F 175578920a36abcd2daa8510a0f8cdb7 [0,2,0,0,0,0|2,0,0]=4 13244 B13R1.555 COCCNCc1ccccc1I bcf47725cdc558f2f3312094ab2f5cdb [0,2,0,0,0,0|2,0,0]=4 13245 B13R1.555 COCCNCc1ncccc1Br 3de64d929dfbd3447cf9f1876b06b065 [0,2,0,0,0,0|1,0,0]=3 13246 B13R1.555 COCCNCc1ncccc1C 219e1e346c3c932f39a38615a4d2ba8b [0,2,0,0,0,0|1,0,0]=3 13247 B13R1.555 COCCNCc1ncccc1Cl bc757da422ac328dec63ff9d9b93c829 [0,2,0,0,0,0|1,0,0]=3 13248 B13R1.555 COCCNCc1ncccc1F ad7d22f310cb4f3e8e44d89269d9a2dd [0,2,0,0,0,0|1,0,0]=3 13249 B13R1.555 COCCNCc1nccnc1C bb7bcb9cc00c8f21efa5b5723dbbe299 [0,2,0,0,0,0|2,0,0]=4 13250 B13R1.555 COCCNCc1nccnc1Cl 0ac219407c7374ad466b7c19f923d0bc [0,2,0,0,0,0|2,0,0]=4 13251 B13R1.555 COCCNCc1nnccc1C e5a12ef8eb4172485aac5e43f1b14509 [0,2,0,0,0,0|2,0,0]=4 13252 B13R1.555 COCCOCc1cccc[n+]1[O-] 34c959f2abb887c22cd01647786814db [0,2,0,0,0,0|1,0,1]=4 13253 B13R1.555 COCCOCc1ccccc1Br 24cc4c5d34d04e0307a944dcbf91638b [0,2,0,0,0,0|2,0,0]=4 13254 B13R1.555 COCCOCc1ccccc1C 80658ed53b4020799e651c814d654ae3 [0,2,0,0,0,0|2,0,0]=4 13255 B13R1.555 COCCOCc1ccccc1Cl cd308a66d01b1c3fc6535a8cfbb1fd27 [0,2,0,0,0,0|2,0,0]=4 13256 B13R1.555 COCCOCc1ccccc1F 4b423388e92f508e6011127f4c18dfc7 [0,2,0,0,0,0|2,0,0]=4 13257 B13R1.555 COCCOCc1ccccc1I bd2a4e712d631b834b973adf1e4792b8 [0,2,0,0,0,0|2,0,0]=4 13258 B13R1.555 COCCOCc1ccccc1S da05128f96fe723a279077d8537f16ef [0,2,0,0,0,0|2,0,0]=4 13259 B13R1.555 COCCOCc1ncccc1Br 8d6f2e37fb206e6ce5760e561e44da4e [0,2,0,0,0,0|1,0,0]=3 13260 B13R1.555 COCCOCc1ncccc1C 1d9e0dc321bc4f1ade9ee6a2cd406150 [0,2,0,0,0,0|1,0,0]=3 13261 B13R1.555 COCCOCc1ncccc1Cl 8ab78e4ae2335818058584af1ace23aa [0,2,0,0,0,0|1,0,0]=3 13262 B13R1.555 COCCOCc1ncccc1F 062262c55167f5186a72aaf1a8eb3722 [0,2,0,0,0,0|1,0,0]=3 13263 B13R1.555 COCCOCc1nccnc1C a9fee49b11602f2789b05b7c1bf4185a [0,2,0,0,0,0|2,0,0]=4 13264 B13R1.555 COCCOCc1nccnc1Cl 992adf57f83f322f6965dba9f8bda10d [0,2,0,0,0,0|2,0,0]=4 13265 B13R1.555 COCCOCc1ncncc1Br 2babf9db89bc3d32c9e15fc4aac0777d [0,2,0,0,0,0|2,0,0]=4 13266 B13R1.555 COCCOCc1nnccc1C cd7544bc3db561012c35e135f4e53c64 [0,2,0,0,0,0|2,0,0]=4 13267 B13R1.555 COCNCCc1ccccc1Cl 6d4a179259b10c87a95b872b616e1727 [0,2,0,0,0,0|2,0,0]=4 13268 B13R1.555 COCNCCc1ccccc1F d0c64cc6fba7e2f67f4da2fbf6fed2eb [0,2,0,0,0,0|2,0,0]=4 13269 B13R1.555 COCNCCc1ncccc1Br 96938a33b4d850026adcea0eae32d5e4 [0,2,0,0,0,0|1,0,0]=3 13270 B13R1.555 COCNCCc1ncccc1C d5d26d2f538895a0f204f1af486dfec8 [0,2,0,0,0,0|1,0,0]=3 13271 B13R1.555 COCNCCn1ncccc1=O acf733eeccd10434d69c8ccbf05c94c6 [0,2,0,0,0,0|2,0,0]=4 13272 B13R1.555 COCOCCc1ccccc1Br 976a45d72b0b0b4711a4cb1f1ee6cbc3 [0,2,0,0,0,0|2,0,0]=4 13273 B13R1.555 COCOCCc1ccccc1Cl 3fe3c9ee923f0eb8e26dccf7f4b5d9e8 [0,2,0,0,0,0|2,0,0]=4 13274 B13R1.555 COCOCCc1ccccc1F 7ee36a28b27c5eff16567d9f7d13948c [0,2,0,0,0,0|2,0,0]=4 13275 B13R1.555 COCOCCc1ccccc1I 700b00a65cdf825215e746925c3273be [0,2,0,0,0,0|2,0,0]=4 13276 B13R1.555 COCOCCc1ncccc1C 0bc7b5aa9eab54d8618020222281e50d [0,2,0,0,0,0|1,0,0]=3 13277 B13R1.555 COCOCCc1ncccc1F de992fab7af260b658290d83f2cbf6a0 [0,2,0,0,0,0|1,0,0]=3 13278 B13R1.555 COCOCCc1nccnc1C e8365b2d7a0b7fbea1e6a503e6a20af6 [0,2,0,0,0,0|2,0,0]=4 13279 B13R1.555 CSCCCNc1cccc[n+]1[O-] f5e4a1d24bd1a1675513170ab8a1abca [0,2,0,0,0,0|1,0,1]=4 13280 B13R1.555 CSCCCNc1ccccc1Br 2c662d24be396db2b12fb88d95a9ee31 [0,2,0,0,0,0|2,0,0]=4 13281 B13R1.555 CSCCCNc1ccccc1C 7cbca81b67ce6a14f123ca3e5794b879 [0,2,0,0,0,0|2,0,0]=4 13282 B13R1.555 CSCCCNc1ccccc1Cl 4edcd4e02a0528f3b4d511813fef6197 [0,2,0,0,0,0|2,0,0]=4 13283 B13R1.555 CSCCCNc1ccccc1F 9b78cf35b4b12d206bbc0aca926cf2f0 [0,2,0,0,0,0|2,0,0]=4 13284 B13R1.555 CSCCCNc1ccccc1I 804c792741503a638d4e472999ffd85e [0,2,0,0,0,0|2,0,0]=4 13285 B13R1.555 CSCCCNc1ccccc1S b640778db03c7f1d1d3bd2596c3089fe [0,2,0,0,0,0|2,0,0]=4 13286 B13R1.555 CSCCCNc1ncc[nH]c1=O 4cbd243bb6346e13221d4c5ce591e038 [0,2,0,0,0,0|2,0,0]=4 13287 B13R1.555 CSCCCNc1ncccc1Br 64f5845b7a8ebcebc5c2e055697c090e [0,2,0,0,0,0|1,0,0]=3 13288 B13R1.555 CSCCCNc1ncccc1C d8ad9ac3b6132b45da0f1e80b703a570 [0,2,0,0,0,0|1,0,0]=3 13289 B13R1.555 CSCCCNc1ncccc1Cl f2d5289f25b1ac4785547fb0c00375fc [0,2,0,0,0,0|1,0,0]=3 13290 B13R1.555 CSCCCNc1ncccc1F bcb2bdbfdba0c1cb3eb2bd6aaa01e027 [0,2,0,0,0,0|1,0,0]=3 13291 B13R1.555 CSCCCNc1ncccc1I d01b2efef74838913439fc43d3ea29df [0,2,0,0,0,0|1,0,0]=3 13292 B13R1.555 CSCCCNc1nccnc1Br 0a5a8cf68b2b5b1f59faeb40d544fc2f [0,2,0,0,0,0|2,0,0]=4 13293 B13R1.555 CSCCCNc1nccnc1C d7a9392f27356f93d5f2195ebc5acb5d [0,2,0,0,0,0|2,0,0]=4 13294 B13R1.555 CSCCCNc1nccnc1Cl aa0b3db56b4a232093399c2e48480655 [0,2,0,0,0,0|2,0,0]=4 13295 B13R1.555 CSCCCNc1nccnc1F 02f42703607dc722817458c86ad291c3 [0,2,0,0,0,0|2,0,0]=4 13296 B13R1.555 CSCCCNc1nccnc1I 0af42c0aa39a4c6879b9d2ab82204b42 [0,2,0,0,0,0|2,0,0]=4 13297 B13R1.555 CSCCCNc1ncncc1Br b21c607fa699fbdcfe573ee76c3b9a68 [0,2,0,0,0,0|2,0,0]=4 13298 B13R1.555 CSCCCNc1ncncc1C e58208267e0373303bcdd3c4bd5dd186 [0,2,0,0,0,0|2,0,0]=4 13299 B13R1.555 CSCCCNc1ncncc1Cl 95b2c16adcb5a0453111419251a874e8 [0,2,0,0,0,0|2,0,0]=4 13300 B13R1.555 CSCCCNc1ncncc1F 6e317260335126bbf73de0d8bf310d9c [0,2,0,0,0,0|2,0,0]=4 13301 B13R1.555 CSCCCNc1ncncc1I bd4e84258a23edefc8cd4589c3564afa [0,2,0,0,0,0|2,0,0]=4 13302 B13R1.555 CSCCCNc1nnccc1C f6c932446a481874f34a461d07d316a2 [0,2,0,0,0,0|2,0,0]=4 13303 B13R1.555 CSCCCOc1cccc[n+]1[O-] bd4ccc497743bf6ee6871e88c26a834c [0,2,0,0,0,0|1,0,1]=4 13304 B13R1.555 CSCCCOc1ccccc1Br 71bd04d45c305bfd1fcb84e826043e99 [0,2,0,0,0,0|2,0,0]=4 13305 B13R1.555 CSCCCOc1ccccc1C 5b4dfba652a0b7f33ddcce8412c8e86a [0,2,0,0,0,0|2,0,0]=4 13306 B13R1.555 CSCCCOc1ccccc1Cl d29d37a9f82cbb722577b60a1de6b0c1 [0,2,0,0,0,0|2,0,0]=4 13307 B13R1.555 CSCCCOc1ccccc1F eb3f9eb9ba0bd851002011ac803c8023 [0,2,0,0,0,0|2,0,0]=4 13308 B13R1.555 CSCCCOc1ccccc1I dfe220a17e4b33813c84609c60f01a5f [0,2,0,0,0,0|2,0,0]=4 13309 B13R1.555 CSCCCOc1ccccc1S d5c559b2bb70e0b4b5c234334a09b6fb [0,2,0,0,0,0|2,0,0]=4 13310 B13R1.555 CSCCCOc1ncccc1Br d666b861f525efc3a3032a3ee56aa1f6 [0,2,0,0,0,0|1,0,0]=3 13311 B13R1.555 CSCCCOc1ncccc1C 98ec5f1c8c2828f61c302ff0608b8f86 [0,2,0,0,0,0|1,0,0]=3 13312 B13R1.555 CSCCCOc1ncccc1Cl 973c774757061a5fee90c13c1728c510 [0,2,0,0,0,0|1,0,0]=3 13313 B13R1.555 CSCCCOc1ncccc1F c5b56b6bcdd6cfa652568d2cdb05c07b [0,2,0,0,0,0|1,0,0]=3 13314 B13R1.555 CSCCCOc1nccnc1Br 1b2845c210f0b5f22bafc435db01f1ef [0,2,0,0,0,0|2,0,0]=4 13315 B13R1.555 CSCCCOc1nccnc1C 54d37799fe81df0c6a61295fb878822f [0,2,0,0,0,0|2,0,0]=4 13316 B13R1.555 CSCCCOc1ncncc1C d246e3bd9cf7853d0ae2501760808266 [0,2,0,0,0,0|2,0,0]=4 13317 B13R1.555 CSCCCOc1ncncc1Cl 66ac6ae3924c7a9e017d7be59168e9b8 [0,2,0,0,0,0|2,0,0]=4 13318 B13R1.555 CSCCCOc1ncncc1F fd85cd5b8d2336377b39ef854b3d9453 [0,2,0,0,0,0|2,0,0]=4 13319 B13R1.555 CSCCCOc1ncncc1I 7d813cbcb59fb43f22f084f0b95f73b1 [0,2,0,0,0,0|2,0,0]=4 13320 B13R1.555 CSCCCOc1nnccc1C 530c3a199c72de089c0611417e7f3206 [0,2,0,0,0,0|2,0,0]=4 13321 B13R1.555 CSCCCOc1nnccc1Cl 732055489838a759d83939c236c61c92 [0,2,0,0,0,0|2,0,0]=4 13322 B13R1.555 CSCCCOc1nnccc1I e4e23da9146531ae34a5e9ae10636cd3 [0,2,0,0,0,0|2,0,0]=4 13323 B13R1.555 CSCCNCc1cccc[n+]1[O-] 6f588711769f6d5bb6cd4c78baaa62c0 [0,2,0,0,0,0|1,0,1]=4 13324 B13R1.555 CSCCNCc1ccccc1Br 9d014fe9cd8a1714f3d3758839caba1c [0,2,0,0,0,0|2,0,0]=4 13325 B13R1.555 CSCCNCc1ccccc1C 6b67d1d84e4e0b31f7574196e52e6d22 [0,2,0,0,0,0|2,0,0]=4 13326 B13R1.555 CSCCNCc1ccccc1Cl aa1d5e48e3fc967adbd620d31729679c [0,2,0,0,0,0|2,0,0]=4 13327 B13R1.555 CSCCNCc1ccccc1F bab24cec888a552072f8077895dddc84 [0,2,0,0,0,0|2,0,0]=4 13328 B13R1.555 CSCCNCc1ccccc1I 1e7dc5a0a402e386a0cdfbfe69e0e5ba [0,2,0,0,0,0|2,0,0]=4 13329 B13R1.555 CSCCNCc1ncccc1Br 8ae2a243a64f4ec2a55bb3f536fc8b8b [0,2,0,0,0,0|1,0,0]=3 13330 B13R1.555 CSCCNCc1ncccc1C 9367b87cc541eedd5dd766b55ef30a90 [0,2,0,0,0,0|1,0,0]=3 13331 B13R1.555 CSCCNCc1ncccc1Cl 1627421653628d551c433f7ce223af88 [0,2,0,0,0,0|1,0,0]=3 13332 B13R1.555 CSCCNCc1ncccc1F 7d4c87e36226ff7611679cdccccc3f1a [0,2,0,0,0,0|1,0,0]=3 13333 B13R1.555 CSCCNCc1nccnc1C 0aa3ca4d8b6a548ba5cec24773e96e8c [0,2,0,0,0,0|2,0,0]=4 13334 B13R1.555 CSCCNCc1nccnc1Cl 8acbf24d581af6c7da19e1da89f79295 [0,2,0,0,0,0|2,0,0]=4 13335 B13R1.555 CSCCNCc1nnccc1C a4ecc2b7fe34c11dd7356476125875e6 [0,2,0,0,0,0|2,0,0]=4 13336 B13R1.555 CSCCOCc1cccc[n+]1[O-] e1027544e7594241da4de325d7515d48 [0,2,0,0,0,0|1,0,1]=4 13337 B13R1.555 CSCCOCc1ccccc1Br 1979e944bb65917502ee207dd57a0871 [0,2,0,0,0,0|2,0,0]=4 13338 B13R1.555 CSCCOCc1ccccc1C f5063508a8d2a5f7d03e883b3d94ee27 [0,2,0,0,0,0|2,0,0]=4 13339 B13R1.555 CSCCOCc1ccccc1Cl 3f64c05a428eaff798dbeb8ea161dc47 [0,2,0,0,0,0|2,0,0]=4 13340 B13R1.555 CSCCOCc1ccccc1F bc9f12f4de7716fdb5e34e95434f9642 [0,2,0,0,0,0|2,0,0]=4 13341 B13R1.555 CSCCOCc1ccccc1I 48fadcb098fdbc9ff8b6b0d33d12b971 [0,2,0,0,0,0|2,0,0]=4 13342 B13R1.555 CSCCOCc1ccccc1S d17ff31863420aab75f7361b88a7c63f [0,2,0,0,0,0|2,0,0]=4 13343 B13R1.555 CSCCOCc1ncccc1Br a819ea224ee1f9cd0857e386082ebe8c [0,2,0,0,0,0|1,0,0]=3 13344 B13R1.555 CSCCOCc1ncccc1C 37597110f78dd7d6df1f4bbfa738d32f [0,2,0,0,0,0|1,0,0]=3 13345 B13R1.555 CSCCOCc1ncccc1Cl 3c5ac2b2eb3d8da8c1f3ba78359ccc68 [0,2,0,0,0,0|1,0,0]=3 13346 B13R1.555 CSCCOCc1ncccc1F 36b0f046582156fbc85a5f2d3a6a37ab [0,2,0,0,0,0|1,0,0]=3 13347 B13R1.555 CSCCOCc1nccnc1C ad60f91ce82e325d50c6f6332c063241 [0,2,0,0,0,0|2,0,0]=4 13348 B13R1.555 CSCCOCc1nccnc1Cl 4dbed4abb68e8c1cc31bc78ec2e49e5d [0,2,0,0,0,0|2,0,0]=4 13349 B13R1.555 CSCCOCc1ncncc1Br d0d6d6ccc965d054754008307fe6bdd9 [0,2,0,0,0,0|2,0,0]=4 13350 B13R1.555 CSCCOCc1nnccc1C 04ca7d6b1e4e86bcef4911eebf931393 [0,2,0,0,0,0|2,0,0]=4 13351 B13R1.555 CSCNCCc1ccccc1Cl 06a19226ab67ac2995f74b8909009d7c [0,2,0,0,0,0|2,0,0]=4 13352 B13R1.555 CSCNCCc1ccccc1F 167b3c399172daed1dfbb053d62003a6 [0,2,0,0,0,0|2,0,0]=4 13353 B13R1.555 CSCNCCc1ncccc1Br 4eef85de8f1589fc3d38c8018ea49f95 [0,2,0,0,0,0|1,0,0]=3 13354 B13R1.555 CSCNCCc1ncccc1C d2f06f912fe120570fe1fe10e33d980e [0,2,0,0,0,0|1,0,0]=3 13355 B13R1.555 CSCNCCn1ncccc1=O 9ecff3810b371d9d6ce3c0883c01f465 [0,2,0,0,0,0|2,0,0]=4 13356 B13R1.555 CSCOCCc1ccccc1Cl 58c06f434c0a67a7b3baaffcb2097743 [0,2,0,0,0,0|2,0,0]=4 13357 B13R1.555 CSCOCCc1ccccc1F c4447fe10b8dcdc7a86edf7d23118d6a [0,2,0,0,0,0|2,0,0]=4 13358 B13R1.555 CSCOCCc1ccccc1I 4c10fadc6db0233e73f604dc42a3df18 [0,2,0,0,0,0|2,0,0]=4 13359 B13R1.555 CSCOCCc1ncccc1C f4c2543c57bedb7bda5512697df78036 [0,2,0,0,0,0|1,0,0]=3 13360 B13R1.555 CSCOCCc1ncccc1F 0c2c00ffa3e1030dc48e8bb14fdd4d18 [0,2,0,0,0,0|1,0,0]=3 13361 B13R1.555 CSCOCCc1nccnc1C bef669bbeedb7814c7076b648df0c1d4 [0,2,0,0,0,0|2,0,0]=4 13362 B13R1.555 Cc1ccccc1CCCNCF 210ac5efd77d8e80c70562e4ce49a5b8 [0,2,0,0,0,0|2,0,0]=4 13363 B13R1.555 Cc1ccccc1CCCNCO c90fdf1252eb7edb6637345387ba0680 [0,2,0,0,0,0|2,0,0]=4 13364 B13R1.555 Cc1ccccc1CCCOCF 323af87a993fa6633aa5b43eaca587ed [0,2,0,0,0,0|2,0,0]=4 13365 B13R1.555 Cc1ccccc1CCNCCF 89478365e6a19a1ef556ceae4c504cf1 [0,2,0,0,0,0|2,0,0]=4 13366 B13R1.555 Cc1ccccc1CCNCCS e9770f2bcd683b54f25674411f9b01a7 [0,2,0,0,0,0|2,0,0]=4 13367 B13R1.555 Cc1ccccc1CCOCCF 79377846407be6e03ebb7e3e64ac7062 [0,2,0,0,0,0|2,0,0]=4 13368 B13R1.555 Cc1ccccc1CCOCCS 76ed6f51ac7c0041ba4237b39dcafead [0,2,0,0,0,0|2,0,0]=4 13369 B13R1.555 Cc1ccccc1CNCCCCl 6bc7c0c671b8f46693fc562bccf2f64b [0,2,0,0,0,0|2,0,0]=4 13370 B13R1.555 Cc1ccccc1CNCCCF 039a6806c34fe72955140550b984d132 [0,2,0,0,0,0|2,0,0]=4 13371 B13R1.555 Cc1ccccc1CNCCCO 9a3f2945d59c186066922438e7fda691 [0,2,0,0,0,0|2,0,0]=4 13372 B13R1.555 Cc1ccccc1CNCCCS f4fa747a0ef48d04b3cb6e075cd84ce0 [0,2,0,0,0,0|2,0,0]=4 13373 B13R1.555 Cc1ccccc1COCCCF efd5779ec07da6ed3952a1e8f0049a29 [0,2,0,0,0,0|2,0,0]=4 13374 B13R1.555 Cc1ccccc1COCCCS 1073e96825973b9a9b4e2677d6c7da55 [0,2,0,0,0,0|2,0,0]=4 13375 B13R1.555 Cc1ccccc1NCCCCCl 95ee1fe9f0a64d24eb37877326f4e007 [0,2,0,0,0,0|2,0,0]=4 13376 B13R1.555 Cc1ccccc1NCCCCF 0ba8679cd8e5bdfd1cb79b7b6a59372b [0,2,0,0,0,0|2,0,0]=4 13377 B13R1.555 Cc1ccccc1NCCCCO 4d4675ecedfc1b42c923d9d990cbdf6c [0,2,0,0,0,0|2,0,0]=4 13378 B13R1.555 Cc1ccccc1NCCCCS d71bb35270a1fb1687e6dec8b569e1df [0,2,0,0,0,0|2,0,0]=4 13379 B13R1.555 Cc1ccccc1OCCCCF a48725c6f7bc1ba8a2aee76fa4d68299 [0,2,0,0,0,0|2,0,0]=4 13380 B13R1.555 Cc1cccnc1CCNCC#N 6d49cf0b7d4fc9998ac6906ce6e2b1bb [0,2,0,0,0,0|1,0,1]=4 13381 B13R1.555 Cc1cccnc1CCNCC=O 94756d48364323e5c8251eb3a08ec4ce [0,2,0,0,0,0|1,0,1]=4 13382 B13R1.555 Cc1cccnc1CCNCCF d64bb56c81f70f3183f8073610b0bb98 [0,2,0,0,0,0|1,0,0]=3 13383 B13R1.555 Cc1cccnc1CCNCCO a9f87a6b0c54e93eda4ed0a43745ff51 [0,2,0,0,0,0|1,0,0]=3 13384 B13R1.555 Cc1cccnc1CCNCCS 60017b415f1055c8209f146a5ba3fc07 [0,2,0,0,0,0|1,0,0]=3 13385 B13R1.555 Cc1cccnc1CCOCC#N 2710f3a6b05fb54350bbe2f21ba23fe7 [0,2,0,0,0,0|1,0,1]=4 13386 B13R1.555 Cc1cccnc1CCOCC=O e6bbfac95dcf0272f4c4d1d3429640f8 [0,2,0,0,0,0|1,0,1]=4 13387 B13R1.555 Cc1cccnc1CCOCCF e1d2a5a616b1c66bdb4b2ac388820a4a [0,2,0,0,0,0|1,0,0]=3 13388 B13R1.555 Cc1cccnc1CCOCCS e4a04eef3e4059fdffd98b5db86fdb3a [0,2,0,0,0,0|1,0,0]=3 13389 B13R1.555 Cc1cccnc1CNCCC#N 726648fe2e99fd5e29b80e1293e8556d [0,2,0,0,0,0|1,0,1]=4 13390 B13R1.555 Cc1cccnc1CNCCC=O 426c0f688c29aba6faad81612d76a5a1 [0,2,0,0,0,0|1,0,1]=4 13391 B13R1.555 Cc1cccnc1CNCCCCl 7f2e26646108272d27b4b6769f967cfe [0,2,0,0,0,0|1,0,0]=3 13392 B13R1.555 Cc1cccnc1CNCCCF a9c066df891202c5f4ca65fdccd36f3c [0,2,0,0,0,0|1,0,0]=3 13393 B13R1.555 Cc1cccnc1CNCCCO 64d204dbde064a9c0821c89437f35763 [0,2,0,0,0,0|1,0,0]=3 13394 B13R1.555 Cc1cccnc1CNCCCS 6ad68ff54b21747d753760242085582d [0,2,0,0,0,0|1,0,0]=3 13395 B13R1.555 Cc1cccnc1CNCCON 4c1eff00dc2c7aa748037733dbd0e6da [0,2,0,0,0,0|2,0,0]=4 13396 B13R1.555 Cc1cccnc1COCCC#N 312811c654bb3639161ef9ece067fc17 [0,2,0,0,0,0|1,0,1]=4 13397 B13R1.555 Cc1cccnc1COCCC=O 831372ac4a2d01c38bd4eeadff3b8043 [0,2,0,0,0,0|1,0,1]=4 13398 B13R1.555 Cc1cccnc1COCCCF 467dae4a21cd7e2265e855fa00c94f17 [0,2,0,0,0,0|1,0,0]=3 13399 B13R1.555 Cc1cccnc1COCCCS fe2a41bae7866fbd829ef09291517b92 [0,2,0,0,0,0|1,0,0]=3 13400 B13R1.555 Cc1cccnc1NCCCC#N 2fd6f50b9c69e0c324283194c3994892 [0,2,0,0,0,0|1,0,1]=4 13401 B13R1.555 Cc1cccnc1NCCCC=O 7b0be223271b5b5cd55ca22076fd0b36 [0,2,0,0,0,0|1,0,1]=4 13402 B13R1.555 Cc1cccnc1NCCCCCl 1141363750155d6ffd11d22111febdfb [0,2,0,0,0,0|1,0,0]=3 13403 B13R1.555 Cc1cccnc1NCCCCF c5f68981067fb314769d934a93b3d38f [0,2,0,0,0,0|1,0,0]=3 13404 B13R1.555 Cc1cccnc1NCCCCO 4a3848cd5c8298890acf44da415575c2 [0,2,0,0,0,0|1,0,0]=3 13405 B13R1.555 Cc1cccnc1OCCCC#N c4fbd1860064bceb058a7ddd9421fdd5 [0,2,0,0,0,0|1,0,1]=4 13406 B13R1.555 Cc1cccnc1OCCCC=O 95531ebf45abce5f3a76340598973c1c [0,2,0,0,0,0|1,0,1]=4 13407 B13R1.555 Cc1cccnc1OCCCCF 965af0e0a3f1893706c019a70a943c92 [0,2,0,0,0,0|1,0,0]=3 13408 B13R1.555 Cc1ccnnc1CNCCCF d7d47abea20c0faf72ed4eeccdbd8cc2 [0,2,0,0,0,0|2,0,0]=4 13409 B13R1.555 Cc1ccnnc1CNCCCO 02de3d1eda0289534e1c77ded356f822 [0,2,0,0,0,0|2,0,0]=4 13410 B13R1.555 Cc1ccnnc1CNCCCS 064bfeb1cf72048cdef90e91c42cf2e3 [0,2,0,0,0,0|2,0,0]=4 13411 B13R1.555 Cc1ccnnc1COCCCF 4be7d6c87e1f4dc55687f91b7a2947ce [0,2,0,0,0,0|2,0,0]=4 13412 B13R1.555 Cc1ccnnc1COCCCS 0cb09ac9b44c632f4dd4520939430c7d [0,2,0,0,0,0|2,0,0]=4 13413 B13R1.555 Cc1ccnnc1NCCCCF d11625857b2f796f73384fb4eedb0348 [0,2,0,0,0,0|2,0,0]=4 13414 B13R1.555 Cc1ccnnc1NCCCCO 3001e0adabac18b3be1335e6bcb36b4a [0,2,0,0,0,0|2,0,0]=4 13415 B13R1.555 Cc1ccnnc1OCCCCF 86f4de46cb41fe57dfff95aa283809c1 [0,2,0,0,0,0|2,0,0]=4 13416 B13R1.555 Cc1cncnc1NCCCCF ba974bce58cba79ef832ea76e1d1336a [0,2,0,0,0,0|2,0,0]=4 13417 B13R1.555 Cc1cncnc1NCCCCO a820b1b9610a2e8070de1fc693c643d2 [0,2,0,0,0,0|2,0,0]=4 13418 B13R1.555 Cc1cncnc1OCCCCF a7831960b5b7eeae9f985e2f6ce610fa [0,2,0,0,0,0|2,0,0]=4 13419 B13R1.555 Cc1nccnc1CCOCCF 2fd1eebbd7fe4aaff41089ed029405a3 [0,2,0,0,0,0|2,0,0]=4 13420 B13R1.555 Cc1nccnc1CCOCCS 99cc65a46f6e7c3538eeb7aebd75a4d8 [0,2,0,0,0,0|2,0,0]=4 13421 B13R1.555 Cc1nccnc1CNCCCCl d79dd6b97d779e89d8d88971922a6bc3 [0,2,0,0,0,0|2,0,0]=4 13422 B13R1.555 Cc1nccnc1CNCCCO 80b76d54a5b7b87efd01bfdfba9ee0d9 [0,2,0,0,0,0|2,0,0]=4 13423 B13R1.555 Cc1nccnc1COCCCF d8144bb4bcafeae87e77ac179d5bad98 [0,2,0,0,0,0|2,0,0]=4 13424 B13R1.555 Cc1nccnc1COCCCS 0bdd978e683c0c44805e912d28a61f14 [0,2,0,0,0,0|2,0,0]=4 13425 B13R1.555 Cc1nccnc1NCCCCCl d1a4749f8fae2bced274cce8ad24c59a [0,2,0,0,0,0|2,0,0]=4 13426 B13R1.555 Cc1nccnc1NCCCCF b65f42ba68926135a50f150a317657ad [0,2,0,0,0,0|2,0,0]=4 13427 B13R1.555 Cc1nccnc1NCCCCO ea9281b717f7f0001b9983e154c79946 [0,2,0,0,0,0|2,0,0]=4 13428 B13R1.555 Cc1nccnc1OCCCCF ea8c87293eafa31c345260edec1adf0e [0,2,0,0,0,0|2,0,0]=4 13429 B13R1.555 ClCCCNCc1ccccc1Br 02c1b81543a45277b348ff10062df340 [0,2,0,0,0,0|2,0,0]=4 13430 B13R1.555 ClCCCNCc1ccccc1Cl abde7c843395cac14539b9e5440795ae [0,2,0,0,0,0|2,0,0]=4 13431 B13R1.555 ClCCCNCc1ccccc1I 0539b0de70a17d58453f447f4c807316 [0,2,0,0,0,0|2,0,0]=4 13432 B13R1.555 ClCCCNCc1ncccc1Br 1ac4a8c4a5f0c07148da07720dd3a2bc [0,2,0,0,0,0|1,0,0]=3 13433 B13R1.555 ClCCCNCc1ncccc1Cl 4ac10de108413249172f65fbfcfe7804 [0,2,0,0,0,0|1,0,0]=3 13434 B13R1.555 ClCCCNCc1nccnc1Cl 50745e6ff5282904544aa61546a0c6e1 [0,2,0,0,0,0|2,0,0]=4 13435 B13R1.555 Clc1ccccc1CCNCCI 8e499a6c1503e31b2626628711e6fe15 [0,2,0,0,0,0|2,0,0]=4 13436 B13R1.555 FCCCCNc1ccccc1Cl 7ec6f41ccfe720b30bd6c885cab468b0 [0,2,0,0,0,0|2,0,0]=4 13437 B13R1.555 FCCCCNc1ccccc1F a43c066e89f88e0d1f1bbdc8f58979f3 [0,2,0,0,0,0|2,0,0]=4 13438 B13R1.555 FCCCCNc1ccccc1I 18aa3cc9a3f6c84fca88d94761cfeded [0,2,0,0,0,0|2,0,0]=4 13439 B13R1.555 FCCCCNc1ccccc1S 19c3a921f40b2844f909accd04898415 [0,2,0,0,0,0|2,0,0]=4 13440 B13R1.555 FCCCCNc1ncccc1Br d04663b7ec7d3608c01266692430acfb [0,2,0,0,0,0|1,0,0]=3 13441 B13R1.555 FCCCCNc1ncccc1Cl 04e0e9ddf3e3c00bf60e9a7a56424a08 [0,2,0,0,0,0|1,0,0]=3 13442 B13R1.555 FCCCCNc1ncccc1F 1e15a33b3d640ee55d69901c9c61ae1f [0,2,0,0,0,0|1,0,0]=3 13443 B13R1.555 FCCCCNc1ncccc1I 69b8f6f26f57d00a64e1f270f6a0d785 [0,2,0,0,0,0|1,0,0]=3 13444 B13R1.555 FCCCCNc1nccnc1Br cd75f86811952f8a8cf6ba3472978441 [0,2,0,0,0,0|2,0,0]=4 13445 B13R1.555 FCCCCNc1nccnc1Cl 1fcae1877cfc0fe98163f6294c67114d [0,2,0,0,0,0|2,0,0]=4 13446 B13R1.555 FCCCCNc1nccnc1I bd86e2bed661c2f581cbdadb7bd0fa2f [0,2,0,0,0,0|2,0,0]=4 13447 B13R1.555 FCCCCNc1ncncc1Br 3b50eeb768f1149a8ea01d954dc2c662 [0,2,0,0,0,0|2,0,0]=4 13448 B13R1.555 FCCCCNc1ncncc1Cl 182cf2d92d0646546226f620507f14b8 [0,2,0,0,0,0|2,0,0]=4 13449 B13R1.555 FCCCCNc1ncncc1F d32291b758761a9e979e917eb0413961 [0,2,0,0,0,0|2,0,0]=4 13450 B13R1.555 FCCCCNc1ncncc1I 0953561bac388adcd70d3523f4067223 [0,2,0,0,0,0|2,0,0]=4 13451 B13R1.555 FCCCCOc1ccccc1Cl b6c6c7adc34a37a776bf25acd225b148 [0,2,0,0,0,0|2,0,0]=4 13452 B13R1.555 FCCCCOc1ccccc1F a5d122d2d35e0af8991f7ff36c53d6b1 [0,2,0,0,0,0|2,0,0]=4 13453 B13R1.555 FCCCCOc1ccccc1I 4fe5359bc17efc165e74da5b51e29876 [0,2,0,0,0,0|2,0,0]=4 13454 B13R1.555 FCCCCOc1ccccc1S 29ed9f9e7512a3f2ad336397ab9406ce [0,2,0,0,0,0|2,0,0]=4 13455 B13R1.555 FCCCCOc1ncccc1Br defe88611b2d572f2939e3df7f84e63f [0,2,0,0,0,0|1,0,0]=3 13456 B13R1.555 FCCCCOc1ncccc1Cl e5592e217a3ef2f13ef07c5341bcdbdd [0,2,0,0,0,0|1,0,0]=3 13457 B13R1.555 FCCCCOc1ncccc1F 30c7a53f856197c89c7ce798c1c66284 [0,2,0,0,0,0|1,0,0]=3 13458 B13R1.555 FCCCCOc1nccnc1Br c3d3b10bd76afd68c98b33d03df6aa73 [0,2,0,0,0,0|2,0,0]=4 13459 B13R1.555 FCCCCOc1ncncc1Cl f88a03b10c45005ba88d182bca408ccb [0,2,0,0,0,0|2,0,0]=4 13460 B13R1.555 FCCCCOc1ncncc1F d11348fada12edca9a29ecf9dd906beb [0,2,0,0,0,0|2,0,0]=4 13461 B13R1.555 FCCCCOc1ncncc1I c3586e24ab21a5d3341eb8aa5742300a [0,2,0,0,0,0|2,0,0]=4 13462 B13R1.555 FCCCCOc1nnccc1Cl 4864e49fc1610f12f5f2886e4842df7b [0,2,0,0,0,0|2,0,0]=4 13463 B13R1.555 FCCCCOc1nnccc1I 13c0718e0244b91e10182c6674214095 [0,2,0,0,0,0|2,0,0]=4 13464 B13R1.555 FCCCNCc1ccccc1Br 8ffc71325d86280f8b41c700bb5b275e [0,2,0,0,0,0|2,0,0]=4 13465 B13R1.555 FCCCNCc1ccccc1Cl 3bea528d71e86ae77bcba562229f45e7 [0,2,0,0,0,0|2,0,0]=4 13466 B13R1.555 FCCCNCc1ccccc1F 7a60510d9f0c31cf20170784dd6bf67a [0,2,0,0,0,0|2,0,0]=4 13467 B13R1.555 FCCCNCc1ccccc1I a2889358b80353b84ecc49387998f453 [0,2,0,0,0,0|2,0,0]=4 13468 B13R1.555 FCCCNCc1ncccc1Br a978743ddee76307d191bca10b12e5af [0,2,0,0,0,0|1,0,0]=3 13469 B13R1.555 FCCCNCc1ncccc1Cl 33c83b2cb4aec7d988566e29827beb33 [0,2,0,0,0,0|1,0,0]=3 13470 B13R1.555 FCCCNCc1ncccc1F 49a70cd60d77393c059bb329bcbd48e7 [0,2,0,0,0,0|1,0,0]=3 13471 B13R1.555 FCCCNCc1nccnc1Cl bf78fbfda12f8c57cc9f103f02e6006c [0,2,0,0,0,0|2,0,0]=4 13472 B13R1.555 FCCCOCc1ccccc1Br 16c53e0472c79d864bb4ee837e4513ba [0,2,0,0,0,0|2,0,0]=4 13473 B13R1.555 FCCCOCc1ccccc1Cl e1b33a73979b1cd05a3148371e9583e4 [0,2,0,0,0,0|2,0,0]=4 13474 B13R1.555 FCCCOCc1ccccc1F 4d24c8aec5c6b2423da44d818c7fbf8e [0,2,0,0,0,0|2,0,0]=4 13475 B13R1.555 FCCCOCc1ccccc1I be15cf4f1bc086349dbc522635852ae8 [0,2,0,0,0,0|2,0,0]=4 13476 B13R1.555 FCCCOCc1ccccc1S 038dd4faf9ecab1556b408b246f3c157 [0,2,0,0,0,0|2,0,0]=4 13477 B13R1.555 FCCCOCc1ncccc1Br 201867dbdee4d5837a717505dc011fde [0,2,0,0,0,0|1,0,0]=3 13478 B13R1.555 FCCCOCc1ncccc1Cl 6458b0967adbc8463c5b97ef369d6410 [0,2,0,0,0,0|1,0,0]=3 13479 B13R1.555 FCCCOCc1ncccc1F cd05874dbc9035618e17a5200032b3dd [0,2,0,0,0,0|1,0,0]=3 13480 B13R1.555 FCCCOCc1nccnc1Cl 81240a82ba6706a174ace21fd91458be [0,2,0,0,0,0|2,0,0]=4 13481 B13R1.555 FCCCOCc1ncncc1Br 37d23079acec598d5e28577fc5b3cf84 [0,2,0,0,0,0|2,0,0]=4 13482 B13R1.555 FCCNCCc1ccccc1Cl 75d1c02c660de1f6039cc1deafa9ebc0 [0,2,0,0,0,0|2,0,0]=4 13483 B13R1.555 FCCNCCc1ccccc1F 3b247550624ba402a91ae6098e8c7a5d [0,2,0,0,0,0|2,0,0]=4 13484 B13R1.555 FCCNCCc1ccccc1I f28ace9208c1d8882e74c56492635e05 [0,2,0,0,0,0|2,0,0]=4 13485 B13R1.555 FCCNCCc1ncccc1Br 034604261685b6ade7febc7589ad66c8 [0,2,0,0,0,0|1,0,0]=3 13486 B13R1.555 FCCOCCc1ccccc1Br f0cd3a645b2594a87820bd0ebb130820 [0,2,0,0,0,0|2,0,0]=4 13487 B13R1.555 FCCOCCc1ccccc1Cl 8d80124a631ab2dbc353bae270e4786d [0,2,0,0,0,0|2,0,0]=4 13488 B13R1.555 FCCOCCc1ccccc1F 31a8b28218f4f7099bf84e336a3f3fae [0,2,0,0,0,0|2,0,0]=4 13489 B13R1.555 FCCOCCc1ccccc1I a5a1ad75e438d1be69e93c85afd300fe [0,2,0,0,0,0|2,0,0]=4 13490 B13R1.555 FCCOCCc1ncccc1F 0b59d7514534730ed05504492c64f73a [0,2,0,0,0,0|1,0,0]=3 13491 B13R1.555 FCNCCCc1ccccc1Br 98b1b408529ac67376e33d8b361cd434 [0,2,0,0,0,0|2,0,0]=4 13492 B13R1.555 FCNCCCc1ccccc1Cl 9354f0d6f44d046c81575b6ee3bb2a6d [0,2,0,0,0,0|2,0,0]=4 13493 B13R1.555 FCNCCCc1ccccc1F 987aee13c80cd618c564781416a93a81 [0,2,0,0,0,0|2,0,0]=4 13494 B13R1.555 FCOCCCc1ccccc1Br 0830d62255c0f10756e1db464687fd49 [0,2,0,0,0,0|2,0,0]=4 13495 B13R1.555 FCOCCCc1ccccc1Cl 2d07d9d1574c06cb182b2446ce1b2354 [0,2,0,0,0,0|2,0,0]=4 13496 B13R1.555 FCOCCCc1ccccc1F 652ebb32baf245c33fc0aef560f99060 [0,2,0,0,0,0|2,0,0]=4 13497 B13R1.555 FCOCCCc1ncccc1F 1f5ddfd025a89b482d37f21d7a116554 [0,2,0,0,0,0|1,0,0]=3 13498 B13R1.555 FCOCCOc1ncccc1Br 10a917cb3f2c6916af6c7327aa309535 [0,2,0,0,0,0|2,0,0]=4 13499 B13R1.555 Fc1ccccc1CCNCCBr 63e1a7c0d26950ec6e2b52fc2e920691 [0,2,0,0,0,0|2,0,0]=4 13500 B13R1.555 Fc1ccccc1CCNCCI bbad8d0fab5ef3e053f9f12aa9f25bbc [0,2,0,0,0,0|2,0,0]=4 13501 B13R1.555 Fc1ccccc1CCNCCS 63dd09f165b73ae5676b7fdafad47801 [0,2,0,0,0,0|2,0,0]=4 13502 B13R1.555 Fc1ccccc1CCOCCS e77199ebfa4cd4993821ddcf6db59786 [0,2,0,0,0,0|2,0,0]=4 13503 B13R1.555 Fc1ccccc1CNCCCCl 50c34608dd76a50fc67a0f9916d70340 [0,2,0,0,0,0|2,0,0]=4 13504 B13R1.555 Fc1ccccc1CNCCCS 468e9ccf5c2441063dc19a44244d1e58 [0,2,0,0,0,0|2,0,0]=4 13505 B13R1.555 Fc1ccccc1COCCCS 9c0b24cc89cb697e0a1520fb0ac01f1b [0,2,0,0,0,0|2,0,0]=4 13506 B13R1.555 Fc1ccccc1NCCCCCl 07d6d303dc8193f460782c76a1ce83a5 [0,2,0,0,0,0|2,0,0]=4 13507 B13R1.555 Fc1ccccc1NCCCCS 85fc97cd92bd450488557aa12e6fe1dc [0,2,0,0,0,0|2,0,0]=4 13508 B13R1.555 Fc1cccnc1CCOCCS dd6ff7024e775359eb68ca5d99c11cf1 [0,2,0,0,0,0|1,0,0]=3 13509 B13R1.555 Fc1cccnc1CNCCCCl 3f9e99462eaa47f52f05fc25d7e53e99 [0,2,0,0,0,0|1,0,0]=3 13510 B13R1.555 Fc1cccnc1CNCCCS b01d1adb428a1a00a77426946b2a6ff9 [0,2,0,0,0,0|1,0,0]=3 13511 B13R1.555 Fc1cccnc1COCCCS 6c5dbad88f5b10cc88aa09c2f60e1d61 [0,2,0,0,0,0|1,0,0]=3 13512 B13R1.555 Fc1cccnc1NCCCCCl b8821fc97cf85026b70ef7ea576ae3f0 [0,2,0,0,0,0|1,0,0]=3 13513 B13R1.555 Fc1nccnc1NCCCCCl 48a918a737142494316e0b449a58e160 [0,2,0,0,0,0|2,0,0]=4 13514 B13R1.555 ICCNCCc1ccccc1I 2f97601d40cb20db73f78999c0c7f84b [0,2,0,0,0,0|2,0,0]=4 13515 B13R1.555 N#CCCCNc1ncccc1Br 754cb3188d1912a67c33251b8d7affe5 [0,2,0,0,0,0|1,0,1]=4 13516 B13R1.555 N#CCCCNc1ncccc1Cl 510171f57ddc244f828f917f354ea657 [0,2,0,0,0,0|1,0,1]=4 13517 B13R1.555 N#CCCCNc1ncccc1F 4aeb9d6e6c9e7cb5d4e6d114e6a082fe [0,2,0,0,0,0|1,0,1]=4 13518 B13R1.555 N#CCCCNc1ncccc1I aaff320c94c48b6b731520ae1c24eb55 [0,2,0,0,0,0|1,0,1]=4 13519 B13R1.555 N#CCCCOc1ncccc1Br ade1390434f8cc02e754aee78f78373a [0,2,0,0,0,0|1,0,1]=4 13520 B13R1.555 N#CCCCOc1ncccc1Cl 0f29a914e6082584be50b3937b01f595 [0,2,0,0,0,0|1,0,1]=4 13521 B13R1.555 N#CCCCOc1ncccc1F a84beb8ca90443e21d825d1dbeaba9ff [0,2,0,0,0,0|1,0,1]=4 13522 B13R1.555 N#CCCNCc1ncccc1Br 93387d41e31b4ddbf08767590a3deaea [0,2,0,0,0,0|1,0,1]=4 13523 B13R1.555 N#CCCNCc1ncccc1Cl 0c551d3e61d4c2dab25a48b08d5a2c53 [0,2,0,0,0,0|1,0,1]=4 13524 B13R1.555 N#CCCNCc1ncccc1F d57fc14f94a2203dd4c69d3b79b501f7 [0,2,0,0,0,0|1,0,1]=4 13525 B13R1.555 N#CCCOCc1ncccc1Br fcd546cf79d814b5ff2b7a843cca5aaf [0,2,0,0,0,0|1,0,1]=4 13526 B13R1.555 N#CCCOCc1ncccc1Cl ef04a21c81c5a3d793c8e7dc865d3c69 [0,2,0,0,0,0|1,0,1]=4 13527 B13R1.555 N#CCCOCc1ncccc1F f1f6bea2a6e75f007048ce308bd211f6 [0,2,0,0,0,0|1,0,1]=4 13528 B13R1.555 N#CCNCCc1ncccc1Br 4f01b1c7e37830e15a2e8a177fb05f51 [0,2,0,0,0,0|1,0,1]=4 13529 B13R1.555 N#CCOCCc1ncccc1F 8333fce45e419efb5d843278249636ac [0,2,0,0,0,0|1,0,1]=4 13530 B13R1.555 NOCCNCc1ncccc1Br fcf7b8664f867b424934ad768be4b812 [0,2,0,0,0,0|2,0,0]=4 13531 B13R1.555 NOCCNCc1ncccc1Cl 15e0071b6f8c98b4476d7cd104c49276 [0,2,0,0,0,0|2,0,0]=4 13532 B13R1.555 NOCCNCc1ncccc1F 6cf73b8954d0e178fc0ab3f847d9b8c7 [0,2,0,0,0,0|2,0,0]=4 13533 B13R1.555 O=CCCCNc1ncccc1Br 395aaaa027fa8aa89f7f579b80491390 [0,2,0,0,0,0|1,0,1]=4 13534 B13R1.555 O=CCCCNc1ncccc1Cl f5853566dd6ebfdc070ee13bcf4d4508 [0,2,0,0,0,0|1,0,1]=4 13535 B13R1.555 O=CCCCNc1ncccc1F b3000d745f2497b877a780321e7ec874 [0,2,0,0,0,0|1,0,1]=4 13536 B13R1.555 O=CCCCNc1ncccc1I d27c4bcc9976634218c6c60d0c588c1d [0,2,0,0,0,0|1,0,1]=4 13537 B13R1.555 O=CCCCOc1ncccc1Br 90b885a39db5d0ba91eb6867d7b219a4 [0,2,0,0,0,0|1,0,1]=4 13538 B13R1.555 O=CCCCOc1ncccc1Cl dedece520540b77b93230ca05ea9809c [0,2,0,0,0,0|1,0,1]=4 13539 B13R1.555 O=CCCCOc1ncccc1F 445f6ba1dd5064696401316ef9ca2de3 [0,2,0,0,0,0|1,0,1]=4 13540 B13R1.555 O=CCCNCc1ncccc1Br 97ecc33b40401c580c1fc75e470f2af9 [0,2,0,0,0,0|1,0,1]=4 13541 B13R1.555 O=CCCNCc1ncccc1Cl 874096299df437fd91ba25aadf9dde2a [0,2,0,0,0,0|1,0,1]=4 13542 B13R1.555 O=CCCNCc1ncccc1F 24f9733597620140ddc9b24da34f14ef [0,2,0,0,0,0|1,0,1]=4 13543 B13R1.555 O=CCCOCc1ncccc1Br 6319bd0c6ecdaacd8d2f15e7ede83204 [0,2,0,0,0,0|1,0,1]=4 13544 B13R1.555 O=CCCOCc1ncccc1Cl 7dc38cf29bd4be38eea588639c0fea18 [0,2,0,0,0,0|1,0,1]=4 13545 B13R1.555 O=CCCOCc1ncccc1F 9bf57870f2cf15e38ad4d1fbd5f8f529 [0,2,0,0,0,0|1,0,1]=4 13546 B13R1.555 O=CCNCCc1ncccc1Br 17700e901bb2254039b7c37b706da2ff [0,2,0,0,0,0|1,0,1]=4 13547 B13R1.555 O=CCOCCc1ncccc1F 8fd2d1928f50c95b32c65cb201de7779 [0,2,0,0,0,0|1,0,1]=4 13548 B13R1.555 O=c1[nH]ccnc1NCCCCCl f3ab12b7e36841d45a6d23564541a716 [0,2,0,0,0,0|2,0,0]=4 13549 B13R1.555 O=c1[nH]ccnc1NCCCCO 01f9eff1f4eafc4f39831af428f40446 [0,2,0,0,0,0|2,0,0]=4 13550 B13R1.555 O=c1[nH]ccnc1NCCCCS 25d7cba98463cdd9f858dbeb5aaa3ce6 [0,2,0,0,0,0|2,0,0]=4 13551 B13R1.555 O=c1cccnn1CCCNCF 0fa3deec2aa07f7c973cba01b6e04617 [0,2,0,0,0,0|2,0,0]=4 13552 B13R1.555 O=c1cccnn1CCCNCO f095991eebc17f9f81c9e13a6e169852 [0,2,0,0,0,0|2,0,0]=4 13553 B13R1.555 O=c1cccnn1CCNCCF 0893c55bdd7fb176348a326e9de0ccae [0,2,0,0,0,0|2,0,0]=4 13554 B13R1.555 O=c1cccnn1CCNCCO 5a79abdc421d82e477b4eb6ca95d2f63 [0,2,0,0,0,0|2,0,0]=4 13555 B13R1.555 O=c1cccnn1CCNCCS 4cd6302769b370fab81c3293d8760f03 [0,2,0,0,0,0|2,0,0]=4 13556 B13R1.555 OCCCCNc1ccccc1Cl 1827a4d601cc34094795c38bf4f1053e [0,2,0,0,0,0|2,0,0]=4 13557 B13R1.555 OCCCCNc1ccccc1F 39d3e4e21c3f91642dcc48b9a1bbd99a [0,2,0,0,0,0|2,0,0]=4 13558 B13R1.555 OCCCCNc1ccccc1I 6f1f356e2f71dde96a8b53be06ba6e49 [0,2,0,0,0,0|2,0,0]=4 13559 B13R1.555 OCCCCNc1ccccc1S 7d5cda0b0769d8ba02ff509c3c4ee246 [0,2,0,0,0,0|2,0,0]=4 13560 B13R1.555 OCCCCNc1ncccc1Br e61e7e7b3ea90aaa641fc6e2267ae0ba [0,2,0,0,0,0|1,0,0]=3 13561 B13R1.555 OCCCCNc1ncccc1Cl 13865e79e47880c11e392919707d5edd [0,2,0,0,0,0|1,0,0]=3 13562 B13R1.555 OCCCCNc1ncccc1F 4ef4fb63099e4ec47b2b8f533cedc574 [0,2,0,0,0,0|1,0,0]=3 13563 B13R1.555 OCCCCNc1ncccc1I 735a3323326b3761fa5c6571ad61aaad [0,2,0,0,0,0|1,0,0]=3 13564 B13R1.555 OCCCCNc1nccnc1Br a72529e28c443f3671001ec545271d12 [0,2,0,0,0,0|2,0,0]=4 13565 B13R1.555 OCCCCNc1nccnc1Cl a2b9b79575206bd18d04472aef30cca3 [0,2,0,0,0,0|2,0,0]=4 13566 B13R1.555 OCCCCNc1nccnc1F f1ced2f2aa95788dde1530fc9cc5b576 [0,2,0,0,0,0|2,0,0]=4 13567 B13R1.555 OCCCCNc1nccnc1I 08cad458424968a1cbe486ffc00271fc [0,2,0,0,0,0|2,0,0]=4 13568 B13R1.555 OCCCCNc1ncncc1Br 0fca518ee84ca56d845c2ba383ffd14e [0,2,0,0,0,0|2,0,0]=4 13569 B13R1.555 OCCCCNc1ncncc1Cl c3182dff6e38c515392a3ee9cae81ec4 [0,2,0,0,0,0|2,0,0]=4 13570 B13R1.555 OCCCCNc1ncncc1F 00ef2bef2189cc6a398859e4ac7fb389 [0,2,0,0,0,0|2,0,0]=4 13571 B13R1.555 OCCCCNc1ncncc1I ef6fe9f9df267a2898ffcd7e5bb65232 [0,2,0,0,0,0|2,0,0]=4 13572 B13R1.555 OCCCNCc1ccccc1Br d0517f9b0d3d4bd5be2b1c465d12ef6b [0,2,0,0,0,0|2,0,0]=4 13573 B13R1.555 OCCCNCc1ccccc1Cl 867de592e5ce6944ede790ccc38c9a15 [0,2,0,0,0,0|2,0,0]=4 13574 B13R1.555 OCCCNCc1ccccc1F 66c1f65512fe9b789614a90cf30d22b9 [0,2,0,0,0,0|2,0,0]=4 13575 B13R1.555 OCCCNCc1ccccc1I 5e0aea02b55ec538c500df285e128577 [0,2,0,0,0,0|2,0,0]=4 13576 B13R1.555 OCCCNCc1ncccc1Br d682443dfd071395c18cec9cf915704d [0,2,0,0,0,0|1,0,0]=3 13577 B13R1.555 OCCCNCc1ncccc1Cl b72f731f56dcadcaf44d0739ff98920a [0,2,0,0,0,0|1,0,0]=3 13578 B13R1.555 OCCCNCc1ncccc1F 9965f7a29a1c835b421ff26bcd7ebced [0,2,0,0,0,0|1,0,0]=3 13579 B13R1.555 OCCCNCc1nccnc1Cl e3a1e65384fa9cf2dab27f8cde231866 [0,2,0,0,0,0|2,0,0]=4 13580 B13R1.555 OCCNCCc1ccccc1Cl bfe88ed94d29a89abfc4b03402fd15e1 [0,2,0,0,0,0|2,0,0]=4 13581 B13R1.555 OCCNCCc1ccccc1F 332bfd03601c48564f1ec1a3678cde51 [0,2,0,0,0,0|2,0,0]=4 13582 B13R1.555 OCCNCCc1ccccc1I 32f46529c2431bb674c38035d22f6fab [0,2,0,0,0,0|2,0,0]=4 13583 B13R1.555 OCCNCCc1ncccc1Br 436e5430c02b5bd5282e98222007941a [0,2,0,0,0,0|1,0,0]=3 13584 B13R1.555 OCNCCCc1ccccc1Br 7b1aa3e33515934c05c8c899c54ec4d4 [0,2,0,0,0,0|2,0,0]=4 13585 B13R1.555 OCNCCCc1ccccc1Cl c25936dca871330d32c5ba0dd2d5f578 [0,2,0,0,0,0|2,0,0]=4 13586 B13R1.555 OCNCCCc1ccccc1F 530754131354c164b351b15ae27fb7ff [0,2,0,0,0,0|2,0,0]=4 13587 B13R1.555 Oc1ccccc1NCCCCCl d4064f50c4c6b9f4320cc704595d43eb [0,2,0,0,0,0|2,0,0]=4 13588 B13R1.555 Oc1cccnc1NCCCCCl 6da90be93034b12821b30af86c0356fd [0,2,0,0,0,0|1,0,0]=3 13589 B13R1.555 SCCCNCc1ccccc1Br 93debec163b1646fb37727b2706093fb [0,2,0,0,0,0|2,0,0]=4 13590 B13R1.555 SCCCNCc1ccccc1Cl 89ec73f414c3f3ba3f3651939eed7d0a [0,2,0,0,0,0|2,0,0]=4 13591 B13R1.555 SCCCNCc1ccccc1I 527aa15f26b9cf20b399e8beedef05ed [0,2,0,0,0,0|2,0,0]=4 13592 B13R1.555 SCCCNCc1ncccc1Br 8329dc5bf882d958710e3f8f93c06027 [0,2,0,0,0,0|1,0,0]=3 13593 B13R1.555 SCCCNCc1ncccc1Cl 6a2276e043a7302ea10c9b19601d4cf2 [0,2,0,0,0,0|1,0,0]=3 13594 B13R1.555 SCCCNCc1nccnc1Cl 6f997effd40bb5ab4c4f8e78e3062027 [0,2,0,0,0,0|2,0,0]=4 13595 B13R1.555 SCCCOCc1ccccc1Br 7f7228a1f571b127d326dc0c67ce6fb5 [0,2,0,0,0,0|2,0,0]=4 13596 B13R1.555 SCCCOCc1ccccc1Cl 27947fe91c4b9b351a72639c503ad434 [0,2,0,0,0,0|2,0,0]=4 13597 B13R1.555 SCCCOCc1ccccc1I 615519b9ae85d0a5aa7e334aa83defe5 [0,2,0,0,0,0|2,0,0]=4 13598 B13R1.555 SCCCOCc1ccccc1S 7e9078a606424f540082ea5bc2d91458 [0,2,0,0,0,0|2,0,0]=4 13599 B13R1.555 SCCCOCc1ncccc1Br 26bc883887cf90ee9b258a072fffc012 [0,2,0,0,0,0|1,0,0]=3 13600 B13R1.555 SCCCOCc1ncccc1Cl f1fb0ae757a0f0fdcd5e471e5c16ca2e [0,2,0,0,0,0|1,0,0]=3 13601 B13R1.555 SCCCOCc1nccnc1Cl edd586978bb339ac76538137ab1056b1 [0,2,0,0,0,0|2,0,0]=4 13602 B13R1.555 SCCCOCc1ncncc1Br 36e6001092fdb8665100d7f0df9b2366 [0,2,0,0,0,0|2,0,0]=4 13603 B13R1.555 SCCNCCc1ccccc1Br 559f20841bb9a9c4dd3af866af5f4672 [0,2,0,0,0,0|2,0,0]=4 13604 B13R1.555 SCCNCCc1ccccc1Cl 0d65df709a040fb66916da70a1c800c2 [0,2,0,0,0,0|2,0,0]=4 13605 B13R1.555 SCCNCCc1ccccc1I dca2807f25013792841cc2f999581778 [0,2,0,0,0,0|2,0,0]=4 13606 B13R1.555 SCCNCCc1ncccc1Br 25a0f884d262a62f71947876aef4eb11 [0,2,0,0,0,0|1,0,0]=3 13607 B13R1.555 SCCOCCc1ccccc1Br 0a6e21752792f4794c2ca84e5f719568 [0,2,0,0,0,0|2,0,0]=4 13608 B13R1.555 SCCOCCc1ccccc1Cl a3cd340ea2415e34eac532e6392ea446 [0,2,0,0,0,0|2,0,0]=4 13609 B13R1.555 SCCOCCc1ccccc1I d90d47a93e9f99183a195ca6cccb71fe [0,2,0,0,0,0|2,0,0]=4 13610 B13R1.555 Sc1ccccc1NCCCCCl 7873706adf54668529b330584294c8b0 [0,2,0,0,0,0|2,0,0]=4 13611 B13R1.555 [O-][n+]1ccccc1CNCCCCl 1f652a5363ea886a4209caee71c8376a [0,2,0,0,0,0|1,0,1]=4 13612 B13R1.555 [O-][n+]1ccccc1CNCCCF a1002386e9b49dd0c48d70d9d6a86817 [0,2,0,0,0,0|1,0,1]=4 13613 B13R1.555 [O-][n+]1ccccc1CNCCCO b3ecc01bb7ebb0d7e3c06b126c03ec29 [0,2,0,0,0,0|1,0,1]=4 13614 B13R1.555 [O-][n+]1ccccc1CNCCCS 7d4be147dc116a38375d32237556898a [0,2,0,0,0,0|1,0,1]=4 13615 B13R1.555 [O-][n+]1ccccc1COCCCF bf7fad9dfda1686068117c344b480397 [0,2,0,0,0,0|1,0,1]=4 13616 B13R1.555 [O-][n+]1ccccc1NCCCCCl ee22cc5a15cde5565a992055b8a41b1f [0,2,0,0,0,0|1,0,1]=4 13617 B13R1.555 [O-][n+]1ccccc1NCCCCF 66d2a3f86c5acba40245246657266188 [0,2,0,0,0,0|1,0,1]=4 13618 B13R1.555 [O-][n+]1ccccc1NCCCCO c64e00228888d7056c5d2fa0507a4892 [0,2,0,0,0,0|1,0,1]=4 13619 B13R1.555 [O-][n+]1ccccc1NCCCCS 43f3c02cab65b82f5c84d2eaf6c66fca [0,2,0,0,0,0|1,0,1]=4 13620 B13R1.555 [O-][n+]1ccccc1OCCCCF 8d34b6b300dd41534ffc65985f6eda7b [0,2,0,0,0,0|1,0,1]=4 13621 B13R1.718 BrCC(Br)CNCc1ccccc1 b58b32acfda9c38f27de0959db216db5 [0,2,0,0,0,0|2,0,0]=4 13622 B13R1.718 BrCC(Br)CNCc1ccccn1 3b6bde56c0e856caf302067efb0d5871 [0,2,0,0,0,0|1,0,0]=3 13623 B13R1.718 BrCC(Br)CNCc1cccnn1 dc22ba0263bf6921575dc174c8d3ac77 [0,2,0,0,0,0|2,0,0]=4 13624 B13R1.718 BrCC(Br)CNCc1ccncn1 a8a987244bbeafb54836763df93031d0 [0,2,0,0,0,0|2,0,0]=4 13625 B13R1.718 BrCC(Br)CNCc1ncccn1 7311c98619342088b75dacc3300157ba [0,2,0,0,0,0|2,0,0]=4 13626 B13R1.718 BrCC(Br)COCc1ccccc1 313bfc2d064ffc3420f240e401102d08 [0,2,0,0,0,0|2,0,0]=4 13627 B13R1.718 BrCC(Br)COCc1ccccn1 23dae8838a0363d61d3af279d9acc891 [0,2,0,0,0,0|1,0,0]=3 13628 B13R1.718 BrCC(Br)COCc1cccnn1 4eb8d2dbd65f60501a9ba9d6fe084ac7 [0,2,0,0,0,0|2,0,0]=4 13629 B13R1.718 BrCC(Br)COCc1ccncn1 9f1007a5da0900b3e8564dfc5838dec6 [0,2,0,0,0,0|2,0,0]=4 13630 B13R1.718 BrCC(Br)COCc1ncccn1 8cc66ecc2cfec20ccc7108b795f2b9fb [0,2,0,0,0,0|2,0,0]=4 13631 B13R1.718 C#CC(C)NCCc1ccccc1 2c8d145f05d337c5583fb92a59a977f3 [0,2,0,0,0,0|2,0,0]=4 13632 B13R1.718 C#CC(C)NCCc1ccccn1 34ffc885e9539d4e1b1043bd5f39e18b [0,2,0,0,0,0|1,0,0]=3 13633 B13R1.718 C#CC(C)NCCc1cnccn1 9ed7e2617fc90d8d939b4d43c0fabefb [0,2,0,0,0,0|2,0,0]=4 13634 B13R1.718 C#CC(C)OCCc1ccccc1 b402d4668ff8547081a9183c2915db76 [0,2,0,0,0,0|2,0,0]=4 13635 B13R1.718 C#CC(C)OCCc1ccccn1 5f2cc180b59156135739dab25b61935b [0,2,0,0,0,0|1,0,0]=3 13636 B13R1.718 C#C[C@@H](C)NCCc1ccccc1 f689b53bc0096babd332bbdd9b580f5c [0,2,0,0,0,0|2,0,0]=4 13637 B13R1.718 C#C[C@@H](C)NCCc1ccccn1 8cdbd4194f352281c605c57d0a397498 [0,2,0,0,0,0|1,0,0]=3 13638 B13R1.718 C#C[C@@H](C)OCCc1ccccc1 c10330c3e2c6a9ac224cf1954de7909b [0,2,0,0,0,0|2,0,0]=4 13639 B13R1.718 C#C[C@@H](C)OCCc1ccccn1 00bfb41bfffe0baf44d7d7749b0e6fba [0,2,0,0,0,0|1,0,0]=3 13640 B13R1.718 C#C[C@H](C)NCCc1ccccc1 c2c8a94b54a28eae255c4c75946be3f5 [0,2,0,0,0,0|2,0,0]=4 13641 B13R1.718 C#C[C@H](C)NCCc1ccccn1 aef9cc8bcf582c4c34abad00b039f019 [0,2,0,0,0,0|1,0,0]=3 13642 B13R1.718 C#C[C@H](C)OCCc1ccccc1 ccd277818f91f3957e5917ac41af9fad [0,2,0,0,0,0|2,0,0]=4 13643 B13R1.718 C#C[C@H](C)OCCc1ccccn1 fa787fc17c57fa6a4ae78bc53896eb49 [0,2,0,0,0,0|1,0,0]=3 13644 B13R1.718 C/C(=C\I)/COCc1ccccn1 1157fb9b20fd1d825a6bcd785d1b7351 [0,2,0,0,0,0|1,0,1]=4 13645 B13R1.718 C=C(CC)CNCc1ccccc1 7b6d15ba80b42d586edb2259dfbe6885 [0,2,0,0,0,0|1,0,1]=4 13646 B13R1.718 C=C(CC)CNCc1ccccn1 b492076e221fe6304b78ba04822b66a7 [0,2,0,0,0,0|0,0,1]=3 13647 B13R1.718 C=C(CC)CNCc1cccnn1 4b02f6cc5d3d1fb5b16091359392835e [0,2,0,0,0,0|1,0,1]=4 13648 B13R1.718 C=C(CC)CNCc1ccncn1 19927fda735867d551f12a95d5f0e5be [0,2,0,0,0,0|1,0,1]=4 13649 B13R1.718 C=C(CC)CNCc1cnccn1 8308b0cc389c66ee303ba67049657d2d [0,2,0,0,0,0|1,0,1]=4 13650 B13R1.718 C=C(CC)CNCc1ncccn1 0f305743982dd21c4388d708eaf8f644 [0,2,0,0,0,0|1,0,1]=4 13651 B13R1.718 C=C(CC)COCc1ccccn1 668fd012d649c82f064aae74274b92a8 [0,2,0,0,0,0|0,0,1]=3 13652 B13R1.718 C=C(CC)COCc1cccnn1 86acd66f793aba799db43c7452f88000 [0,2,0,0,0,0|1,0,1]=4 13653 B13R1.718 C=C(CC)COCc1ccncn1 0df7ea2632964a3aa159a80b47ca1720 [0,2,0,0,0,0|1,0,1]=4 13654 B13R1.718 C=C(CC)COCc1cnccn1 8738664d83d7b2ad0d05484eac64e97e [0,2,0,0,0,0|1,0,1]=4 13655 B13R1.718 C=C(CC)COCc1ncccn1 5127ba27718a699ba9cf49c7d0f372b5 [0,2,0,0,0,0|1,0,1]=4 13656 B13R1.718 C=C(CNCc1ccccn1)OC 0cc694157159def81697d8a97d5cce66 [0,2,0,0,0,0|1,0,1]=4 13657 B13R1.718 C=C(CO)CNCc1ccccn1 14d58f4612680b4d51b293f460d860f7 [0,2,0,0,0,0|1,0,1]=4 13658 B13R1.718 C=C(COCc1ccccn1)OC 2ffa97eb582c18b6fe6106ac6ddad5f3 [0,2,0,0,0,0|1,0,1]=4 13659 B13R1.718 C=CC(C)COCc1ccccc1 b8b8b2053d46c3f0017ad5c27e992dc4 [0,2,0,0,0,0|2,0,0]=4 13660 B13R1.718 C=CC(C)COCc1ccccn1 6135169582364f99c98b280d1fae2026 [0,2,0,0,0,0|1,0,0]=3 13661 B13R1.718 C=CC(C)COCc1cccnn1 bf771714c3e9092e1b119595bfe813b5 [0,2,0,0,0,0|2,0,0]=4 13662 B13R1.718 C=CC(C)COCc1ccncn1 ad3dede543c0872d2f8304162c781ac2 [0,2,0,0,0,0|2,0,0]=4 13663 B13R1.718 C=CC(C)COCc1ncccn1 c58935ed05f9a62909d54bb987d48ba8 [0,2,0,0,0,0|2,0,0]=4 13664 B13R1.718 C=CC(C)NCCc1ccccc1 85c7749c79d31c16f0650eadc1b41e4c [0,2,0,0,0,0|2,0,0]=4 13665 B13R1.718 C=CC(C)NCCc1ccccn1 37e526d124906a8ce764bf4383252db0 [0,2,0,0,0,0|1,0,0]=3 13666 B13R1.718 C=CC(C)NCCc1ccncn1 beb7b7c0ff8d509ea6c9d7c50b766e14 [0,2,0,0,0,0|2,0,0]=4 13667 B13R1.718 C=CC(C)NCCc1cnccn1 52cf9d6aee71db7c8ace127a7a645a14 [0,2,0,0,0,0|2,0,0]=4 13668 B13R1.718 C=CC(C)NCCc1ncccn1 1ffab77e143da5a80aad4578f145cfd3 [0,2,0,0,0,0|2,0,0]=4 13669 B13R1.718 C=CC(C)OCCc1ccccc1 da81578e4b507de20e78dbecd775df0e [0,2,0,0,0,0|2,0,0]=4 13670 B13R1.718 C=CC(C)OCCc1ccccn1 c9ef52fbb2648eedf9ce555ed49fad25 [0,2,0,0,0,0|1,0,0]=3 13671 B13R1.718 C=CC(C)OCCc1ccncn1 7903b533023566b957fb34ce5bd5e1a5 [0,2,0,0,0,0|2,0,0]=4 13672 B13R1.718 C=CC(C)OCCc1cnccn1 8b5d801ba453543afc5b47fa1aa20f4b [0,2,0,0,0,0|2,0,0]=4 13673 B13R1.718 C=CC(C)OCCc1ncccn1 de6613e8d0dd2c9e34c4e7c3903f32fe [0,2,0,0,0,0|2,0,0]=4 13674 B13R1.718 C=CC(O)CNCc1ccccn1 6984dc4da8d400a362833655dc43bccc [0,2,0,0,0,0|0,0,2]=4 13675 B13R1.718 C=C[C@H](C)OCCc1ccccc1 f517f43a0bad406910238c246a64d17e [0,2,0,0,0,0|2,0,0]=4 13676 B13R1.718 C=C[C@H](C)OCCc1ccccn1 16ba5737299318aa979749105c6b3f93 [0,2,0,0,0,0|1,0,0]=3 13677 B13R1.718 CC(=CI)COCc1ccccn1 a4e440dd2f16fdbbf5367c5887abcee8 [0,2,0,0,0,0|1,0,1]=4 13678 B13R1.718 CC(C#N)CNCc1ccccc1 4b2992bdcc2a65b08374b408fe423fce [0,2,0,0,0,0|2,0,0]=4 13679 B13R1.718 CC(C#N)CNCc1ccccn1 89f8c79fff489cd145b436d4d52c530e [0,2,0,0,0,0|1,0,0]=3 13680 B13R1.718 CC(C#N)CNCc1cccnn1 448a32f1dc5fdf71358a987e73a1f11c [0,2,0,0,0,0|2,0,0]=4 13681 B13R1.718 CC(C#N)CNCc1ccncn1 a5413f74379a5b7179c695e5aa009f6c [0,2,0,0,0,0|2,0,0]=4 13682 B13R1.718 CC(C#N)CNCc1cnccn1 1c1741a8f062d221b92f6908b7f9a34b [0,2,0,0,0,0|2,0,0]=4 13683 B13R1.718 CC(C#N)CNCc1ncccn1 0be3efc90d6b1e2df7b667a014da916a [0,2,0,0,0,0|2,0,0]=4 13684 B13R1.718 CC(C#N)COCc1ccccc1 dd6e89064953942042b98316280a869f [0,2,0,0,0,0|2,0,0]=4 13685 B13R1.718 CC(C#N)COCc1ccccn1 3d2eaf0a4ce4f67e4cc689cb42adf7f7 [0,2,0,0,0,0|1,0,0]=3 13686 B13R1.718 CC(C#N)COCc1cccnn1 a18b27756c90922c8438e5bc827681e8 [0,2,0,0,0,0|2,0,0]=4 13687 B13R1.718 CC(C#N)COCc1ccncn1 3b5f52e24490db5c312181b69c7fe641 [0,2,0,0,0,0|2,0,0]=4 13688 B13R1.718 CC(C#N)COCc1cnccn1 5c91bafb207983eee8525ad7fb9bca4f [0,2,0,0,0,0|2,0,0]=4 13689 B13R1.718 CC(C#N)COCc1ncccn1 2453d7db7c8f323df9dd80d4e00ff996 [0,2,0,0,0,0|2,0,0]=4 13690 B13R1.718 CC(C#N)NCCc1ccccc1 e419384d24d209b8092563a987296f12 [0,2,0,0,0,0|2,0,0]=4 13691 B13R1.718 CC(C#N)NCCc1ccccn1 4f6a3d14cb57089093165f75e170ae29 [0,2,0,0,0,0|1,0,0]=3 13692 B13R1.718 CC(C=O)NCCc1ccccc1 369aedf3fd977678630d6ac85371f8c9 [0,2,0,0,0,0|2,0,0]=4 13693 B13R1.718 CC(C=O)NCCc1ccccn1 bb61eba4dab3d84b63c0644b0add725c [0,2,0,0,0,0|1,0,0]=3 13694 B13R1.718 CC(C=O)NCCc1ccncn1 1e81c60b0b5316267afbc7eb9ab31110 [0,2,0,0,0,0|2,0,0]=4 13695 B13R1.718 CC(C=O)NCCc1cnccn1 49d90d042da0286d527de87e6a62e593 [0,2,0,0,0,0|2,0,0]=4 13696 B13R1.718 CC(C=O)NCCc1ncccn1 d081442b64dc7caa297f9b0aa5d546d9 [0,2,0,0,0,0|2,0,0]=4 13697 B13R1.718 CC(C=O)OCCc1ccccc1 66951901da9b91faee03fbd7b536dc4f [0,2,0,0,0,0|2,0,0]=4 13698 B13R1.718 CC(C=O)OCCc1ccccn1 93345d72c247e06c9d4a1f5919b2de0c [0,2,0,0,0,0|1,0,0]=3 13699 B13R1.718 CC(C=O)OCCc1ccncn1 1c4c93a3bfe0f1672e1af0eb75a32213 [0,2,0,0,0,0|2,0,0]=4 13700 B13R1.718 CC(C=O)OCCc1cnccn1 87c7e67e7c7debc2e22dcc64dbf42aa2 [0,2,0,0,0,0|2,0,0]=4 13701 B13R1.718 CC(C=O)OCCc1ncccn1 52f0b5ed021796f3740e14030bd548d6 [0,2,0,0,0,0|2,0,0]=4 13702 B13R1.718 CC(CF)OCCc1ccccc1 10dacae2642b054565528321a819e915 [0,2,0,0,0,0|2,0,0]=4 13703 B13R1.718 CC(CF)OCCc1ccccn1 6e608ea6a17141565a119b65106bffa8 [0,2,0,0,0,0|1,0,0]=3 13704 B13R1.718 CC(CO)CCNc1ccccc1 4d37090ae4c8c4516bf50e1daccfb4da [0,2,0,0,0,0|2,0,0]=4 13705 B13R1.718 CC(CO)CCNc1ccccn1 089ea5f0ec0e8b67707f6e1f4409a619 [0,2,0,0,0,0|1,0,0]=3 13706 B13R1.718 CC(CO)CCNc1cccnn1 97d0855660a66e427a56fe1e566acd5d [0,2,0,0,0,0|2,0,0]=4 13707 B13R1.718 CC(CO)CCNc1ccncn1 e745b86022fd28d38830c958c31024d8 [0,2,0,0,0,0|2,0,0]=4 13708 B13R1.718 CC(CO)CCNc1cnccn1 f529c56dba202170446a8772f8f254b3 [0,2,0,0,0,0|2,0,0]=4 13709 B13R1.718 CC(CO)CCNc1ncccn1 6fea4692075d32cfd8fd5a723e0a86b0 [0,2,0,0,0,0|2,0,0]=4 13710 B13R1.718 CC(CO)CNCc1ccccc1 a8ab15a9d308f0c4a33f134b0e8343dd [0,2,0,0,0,0|2,0,0]=4 13711 B13R1.718 CC(CO)CNCc1ccccn1 6560315a39a5c206bce3a439a8b36cd2 [0,2,0,0,0,0|1,0,0]=3 13712 B13R1.718 CC(CO)CNCc1cccnn1 403d1ac8073dfc3d4305e7b7345c58cb [0,2,0,0,0,0|2,0,0]=4 13713 B13R1.718 CC(CO)CNCc1ccncn1 987de23fd72f25b538bc34e452fb9d64 [0,2,0,0,0,0|2,0,0]=4 13714 B13R1.718 CC(CO)CNCc1cnccn1 ebe04a40bb047d18c15e044dcfbc6b4a [0,2,0,0,0,0|2,0,0]=4 13715 B13R1.718 CC(CO)CNCc1ncccn1 fa4013a2e8a115627a3919509b444d07 [0,2,0,0,0,0|2,0,0]=4 13716 B13R1.718 CC(CO)NCCc1ccccc1 ca980b8870daab798e4fdf7c12f222e9 [0,2,0,0,0,0|2,0,0]=4 13717 B13R1.718 CC(CO)NCCc1ccccn1 016681df2dd6b7fa7d2d6f6091d9a476 [0,2,0,0,0,0|1,0,0]=3 13718 B13R1.718 CC(CO)NCCc1ccncn1 65188cd7b2de51d7a1e2def632ccaff8 [0,2,0,0,0,0|2,0,0]=4 13719 B13R1.718 CC(CO)NCCc1cnccn1 73d6fc96f1eb2ae273fae8a465357133 [0,2,0,0,0,0|2,0,0]=4 13720 B13R1.718 CC(CO)NCCc1ncccn1 7b51814b0fe098513330a54213fd41c2 [0,2,0,0,0,0|2,0,0]=4 13721 B13R1.718 CC(CS)OCCc1ccccc1 c835925d704a2473612a5e1bc4083289 [0,2,0,0,0,0|2,0,0]=4 13722 B13R1.718 CC(CS)OCCc1ccccn1 cf535ce640e15817fd28d6e10f92f6d7 [0,2,0,0,0,0|1,0,0]=3 13723 B13R1.718 CCC(=O)CNCc1ccccc1 379e58d542b4d413818ec926fe2743ec [0,2,0,0,0,0|1,0,1]=4 13724 B13R1.718 CCC(=O)CNCc1ccccn1 d37cbcc9e23f6135510e302fb375a72b [0,2,0,0,0,0|0,0,1]=3 13725 B13R1.718 CCC(=O)CNCc1cccnn1 42c53f8a84cbb5419b9273c3b12f9ace [0,2,0,0,0,0|1,0,1]=4 13726 B13R1.718 CCC(=O)CNCc1ccncn1 1e9e3895aa21a285ce471c3015080a02 [0,2,0,0,0,0|1,0,1]=4 13727 B13R1.718 CCC(=O)CNCc1cnccn1 c4bf00204b9f96e260797f9477875ae6 [0,2,0,0,0,0|1,0,1]=4 13728 B13R1.718 CCC(=O)CNCc1ncccn1 f6c38153da9999ee950217016a73c6a6 [0,2,0,0,0,0|1,0,1]=4 13729 B13R1.718 CCC(=O)COCc1ccccc1 266396ee78f62f5a5e858c0195fee052 [0,2,0,0,0,0|1,0,1]=4 13730 B13R1.718 CCC(=O)COCc1ccccn1 d5dd7913528cc6fadedb3ba4e0b85c1a [0,2,0,0,0,0|0,0,1]=3 13731 B13R1.718 CCC(=O)COCc1cccnn1 426fde90efa623a6220cd43eb935fb76 [0,2,0,0,0,0|1,0,1]=4 13732 B13R1.718 CCC(=O)COCc1ccncn1 1143dead9c0f1b0c17893b71213a6ec6 [0,2,0,0,0,0|1,0,1]=4 13733 B13R1.718 CCC(=O)COCc1cnccn1 9418d22fab4ad5d01e09471a2f384550 [0,2,0,0,0,0|1,0,1]=4 13734 B13R1.718 CCC(=O)COCc1ncccn1 3ab742256529db0ec26cd0dce9c4e325 [0,2,0,0,0,0|1,0,1]=4 13735 B13R1.718 CCC(=O)NCCc1ccccc1 5d7fd1b17306dee08da5fe69e0aad8af [0,2,0,0,0,0|1,0,1]=4 13736 B13R1.718 CCC(=O)NCCc1ccccn1 8ff236b760dbcab6c961d04aef4daa87 [0,2,0,0,0,0|0,0,1]=3 13737 B13R1.718 CCC(=O)NCCc1ccncn1 169c22832199f1232a27fed3d65db1ce [0,2,0,0,0,0|1,0,1]=4 13738 B13R1.718 CCC(=O)NCCc1cnccn1 8e7b478c8fddad20021e54d0b0fccb37 [0,2,0,0,0,0|1,0,1]=4 13739 B13R1.718 CCC(=O)NCCc1ncccn1 4a4fe222276c027ffc692816dd889bfe [0,2,0,0,0,0|1,0,1]=4 13740 B13R1.718 CCC(=O)OCOc1ccccn1 a912980d29246a587450a161678e1ce0 [0,2,0,0,0,0|1,0,1]=4 13741 B13R1.718 CCC(C)CCNc1ccccc1 b42133b77396dfed20aa3240ac9ca29a [0,2,0,0,0,0|1,0,0]=3 13742 B13R1.718 CCC(C)CCNc1ccccn1 0d19499f049ce40b320001eda50ce47e [0,2,0,0,0,0|0,0,0]=2 13743 B13R1.718 CCC(C)CCNc1cccnc1 01ef39519abd460d72cf23c291bc26e2 [0,2,0,0,0,0|2,0,0]=4 13744 B13R1.718 CCC(C)CCNc1cccnn1 86de3ce4bc9e304069c80fc1db7be7ba [0,2,0,0,0,0|1,0,0]=3 13745 B13R1.718 CCC(C)CCNc1ccncc1 3a523442f381971c509485e440831a01 [0,2,0,0,0,0|2,0,0]=4 13746 B13R1.718 CCC(C)CCNc1ccncn1 cd14e4f25df487272b7f627996e149f3 [0,2,0,0,0,0|1,0,0]=3 13747 B13R1.718 CCC(C)CCNc1cnccn1 6b2044950a3975f7494fb57cf75d54af [0,2,0,0,0,0|1,0,0]=3 13748 B13R1.718 CCC(C)CCNc1cnncn1 4040e902d3833c35dda4bca510bc28d0 [0,2,0,0,0,0|2,0,0]=4 13749 B13R1.718 CCC(C)CCNc1ncccn1 1c4eb9bd051a2b8a7d421b764b005455 [0,2,0,0,0,0|1,0,0]=3 13750 B13R1.718 CCC(C)CCNc1nccnn1 c7f7129c357d42aba324ee46b05c69f4 [0,2,0,0,0,0|2,0,0]=4 13751 B13R1.718 CCC(C)CCNc1ncncn1 b60903ebaa93da965977e2f1b7e14252 [0,2,0,0,0,0|2,0,0]=4 13752 B13R1.718 CCC(C)CCOc1ccccn1 bd11a35883ef61e8f6d1e2415310e6f3 [0,2,0,0,0,0|0,0,0]=2 13753 B13R1.718 CCC(C)CCOc1cccnc1 ed4367460491fb46c46dee5ed7230757 [0,2,0,0,0,0|2,0,0]=4 13754 B13R1.718 CCC(C)CCOc1ccncc1 310c23f83a48703aa58c066af4c44b93 [0,2,0,0,0,0|2,0,0]=4 13755 B13R1.718 CCC(C)CCOc1cnccn1 4ed6097fda635854cfdfe19dc52e68e0 [0,2,0,0,0,0|1,0,0]=3 13756 B13R1.718 CCC(C)CCOc1cncnn1 8f31e023ade5d01da7f396e231b35d15 [0,2,0,0,0,0|2,0,0]=4 13757 B13R1.718 CCC(C)CCOc1ncccn1 bc8d49c917bbddbead549a29693d2fd5 [0,2,0,0,0,0|1,0,0]=3 13758 B13R1.718 CCC(C)CNCc1ccccc1 9212151e95985ff645dd6e0e56bfbd96 [0,2,0,0,0,0|1,0,0]=3 13759 B13R1.718 CCC(C)CNCc1ccccn1 24e1cda0c261324c19050c8d16a46171 [0,2,0,0,0,0|0,0,0]=2 13760 B13R1.718 CCC(C)CNCc1cccnc1 0f74b619bf6c30b422c0cd7902a59adb [0,2,0,0,0,0|2,0,0]=4 13761 B13R1.718 CCC(C)CNCc1cccnn1 7aaa15f35407153ea7aae2879fa2c7d7 [0,2,0,0,0,0|1,0,0]=3 13762 B13R1.718 CCC(C)CNCc1ccncc1 131e88e99bc0c64c8ac2511df1285b83 [0,2,0,0,0,0|2,0,0]=4 13763 B13R1.718 CCC(C)CNCc1ccncn1 29c3a550f936aed260a7164524f4a505 [0,2,0,0,0,0|1,0,0]=3 13764 B13R1.718 CCC(C)CNCc1cnccn1 53a2b17453d04ac53134625796082a35 [0,2,0,0,0,0|1,0,0]=3 13765 B13R1.718 CCC(C)CNCc1ncccn1 2f82df10b5825ccc550f3b6a392b7568 [0,2,0,0,0,0|1,0,0]=3 13766 B13R1.718 CCC(C)COCc1ccccc1 a8db5027fb548c7a3aa4f8e3aac3f29d [0,2,0,0,0,0|1,0,0]=3 13767 B13R1.718 CCC(C)COCc1ccccn1 7b83d988cff80e11b11e235047a147c3 [0,2,0,0,0,0|0,0,0]=2 13768 B13R1.718 CCC(C)COCc1cccnc1 fe6d4d34907cd3ec66bebb4fc3bae3e9 [0,2,0,0,0,0|2,0,0]=4 13769 B13R1.718 CCC(C)COCc1cccnn1 766a430483c360077a1e920f0cf61d35 [0,2,0,0,0,0|1,0,0]=3 13770 B13R1.718 CCC(C)COCc1ccncc1 e66edb448c616cc26f66a154df8920b0 [0,2,0,0,0,0|2,0,0]=4 13771 B13R1.718 CCC(C)COCc1ccncn1 72ca604305de8941c07ec9de6fa0c6d3 [0,2,0,0,0,0|1,0,0]=3 13772 B13R1.718 CCC(C)COCc1cnccn1 6aa20e2a507d0d3eaa308ad18aa2332f [0,2,0,0,0,0|1,0,0]=3 13773 B13R1.718 CCC(C)COCc1ncccn1 2d688608eae5fe1b141ae3e8646fb569 [0,2,0,0,0,0|1,0,0]=3 13774 B13R1.718 CCC(C)NCCc1ccccc1 04fedbf0cb6009843db62b814f469f4d [0,2,0,0,0,0|1,0,0]=3 13775 B13R1.718 CCC(C)NCCc1ccccn1 fe6d040ea3832d34e25d3609e9efc0a1 [0,2,0,0,0,0|0,0,0]=2 13776 B13R1.718 CCC(C)NCCc1cccnc1 d811ad79d3d6c5c6d4bf56938672c80c [0,2,0,0,0,0|2,0,0]=4 13777 B13R1.718 CCC(C)NCCc1ccncc1 b506ba27a728915626c9aa4cc38d5704 [0,2,0,0,0,0|2,0,0]=4 13778 B13R1.718 CCC(C)NCCc1ccncn1 27d5b569b39c3e8c7ace2a132e58646a [0,2,0,0,0,0|1,0,0]=3 13779 B13R1.718 CCC(C)NCCc1cnccn1 52e21a30589f2de0665df7f45c479ea7 [0,2,0,0,0,0|1,0,0]=3 13780 B13R1.718 CCC(C)NCCc1ncccn1 62d053203d408e35b4b4455e4ab822b0 [0,2,0,0,0,0|1,0,0]=3 13781 B13R1.718 CCC(C)OCCc1ccccc1 ebd850bb8f2f6a99345d946634614b34 [0,2,0,0,0,0|1,0,0]=3 13782 B13R1.718 CCC(C)OCCc1ccccn1 e899f44f624b8ae2a554dcfb20338a54 [0,2,0,0,0,0|0,0,0]=2 13783 B13R1.718 CCC(C)OCCc1cccnc1 c08fd956c3743d0834335d3a0a892f39 [0,2,0,0,0,0|2,0,0]=4 13784 B13R1.718 CCC(C)OCCc1ccncc1 d3708fcfb6aa0a9ede1fec5a868adbfb [0,2,0,0,0,0|2,0,0]=4 13785 B13R1.718 CCC(C)OCCc1ccncn1 65c68a167f3567fc5ade1601d9f60037 [0,2,0,0,0,0|1,0,0]=3 13786 B13R1.718 CCC(C)OCCc1cnccn1 a27b38f7ae29fc68ab0331ba343a26b0 [0,2,0,0,0,0|1,0,0]=3 13787 B13R1.718 CCC(C)OCCc1ncccn1 4a597381b37d66e7da02235ac3e78db1 [0,2,0,0,0,0|1,0,0]=3 13788 B13R1.718 CCC(O)CNCc1ccccc1 5df21e5b8da54e62a8351afe56b24c4a [0,2,0,0,0,0|1,0,0]=3 13789 B13R1.718 CCC(O)CNCc1ccccn1 d127f7de937d460d83b0c4e835fc6be6 [0,2,0,0,0,0|0,0,0]=2 13790 B13R1.718 CCC(O)CNCc1cccnc1 fa13230d7f791de8096094c12ab9a7be [0,2,0,0,0,0|2,0,0]=4 13791 B13R1.718 CCC(O)CNCc1cccnn1 cb4aefa2e2b401ddb0feafe2fd74c61e [0,2,0,0,0,0|1,0,0]=3 13792 B13R1.718 CCC(O)CNCc1ccncc1 659ed5a37387812620efbb61e0898e1a [0,2,0,0,0,0|2,0,0]=4 13793 B13R1.718 CCC(O)CNCc1ccncn1 5306492d05873f43356e8172bdd345a4 [0,2,0,0,0,0|1,0,0]=3 13794 B13R1.718 CCC(O)CNCc1cnccn1 4600414d0a6f860a9a2890a229dcd834 [0,2,0,0,0,0|1,0,0]=3 13795 B13R1.718 CCC(O)CNCc1ncccn1 375f17d07d987e972975c5d3570b7e86 [0,2,0,0,0,0|1,0,0]=3 13796 B13R1.718 CCN(C)CCCc1ccccc1 0fcd92cbf113da90360df3090d73dab6 [0,2,0,0,0,0|1,0,0]=3 13797 B13R1.718 CCN(C)CCCc1ccccn1 ed387976743ca9ef2172d2aed443ce62 [0,2,0,0,0,0|0,0,0]=2 13798 B13R1.718 CCN(C)CCCc1cccnc1 08e064d80b82aa312dcb907da5935698 [0,2,0,0,0,0|2,0,0]=4 13799 B13R1.718 CCN(C)CCCc1ccncc1 090fc1c3989d53ad9c583f0f644b34b5 [0,2,0,0,0,0|2,0,0]=4 13800 B13R1.718 CCN(C)CCOc1ccccc1 b36b1e616b4c6056ffba3ad5a2f8e9e2 [0,2,0,0,0,0|2,0,0]=4 13801 B13R1.718 CCN(C)CCSc1ccccc1 a98a0865a25951bfeff6b5260e689ee9 [0,2,0,0,0,0|2,0,0]=4 13802 B13R1.718 CCN(C)CCSc1ccccn1 c09dfa58a4643857ce6d8ba2d360b643 [0,2,0,0,0,0|1,0,0]=3 13803 B13R1.718 CCS(=O)CCNc1ccccn1 de57fbd9b11b5ce1f00ba2ad703a5308 [0,2,0,0,0,0|1,0,0]=3 13804 B13R1.718 CCS(=O)CCNc1cccnn1 e6e8d9a393837ac4689bed6007f3557e [0,2,0,0,0,0|2,0,0]=4 13805 B13R1.718 CCS(=O)CCNc1cnccn1 82a9be4ec942d06838c1efd5fa063882 [0,2,0,0,0,0|2,0,0]=4 13806 B13R1.718 CCS(=O)CCNc1ncccn1 826af082032529d666b232dc829d437f [0,2,0,0,0,0|2,0,0]=4 13807 B13R1.718 CCS(=O)CCOc1ccccn1 27d15aa6c60d45ec0e757350b2620620 [0,2,0,0,0,0|1,0,0]=3 13808 B13R1.718 CCS(=O)CCOc1cnccn1 cbbaf7a7f197d7e521af613f53ab7364 [0,2,0,0,0,0|2,0,0]=4 13809 B13R1.718 CCS(=O)CCOc1ncccn1 9c192d178a4c2786e2b9ddf30bd7d707 [0,2,0,0,0,0|2,0,0]=4 13810 B13R1.718 CC[C@@H](C)CNCc1ccccc1 3e755e1966c9036c01c574cad72da958 [0,2,0,0,0,0|1,0,0]=3 13811 B13R1.718 CC[C@@H](C)CNCc1ccccn1 8f482b4c968ad45d74783469da4625ec [0,2,0,0,0,0|0,0,0]=2 13812 B13R1.718 CC[C@@H](C)CNCc1cccnc1 11254f22f22914b59ea1c00a88413366 [0,2,0,0,0,0|2,0,0]=4 13813 B13R1.718 CC[C@@H](C)CNCc1cccnn1 4bdca5d72d3207a67cc665dc13f7bb4e [0,2,0,0,0,0|1,0,0]=3 13814 B13R1.718 CC[C@@H](C)CNCc1ccncc1 51791b0e5f0c50b487dabdbead40044a [0,2,0,0,0,0|2,0,0]=4 13815 B13R1.718 CC[C@@H](C)CNCc1ccncn1 6f5fb0f01f6ea3e588f8d44fead007af [0,2,0,0,0,0|1,0,0]=3 13816 B13R1.718 CC[C@@H](C)CNCc1cnccn1 13bbeb47ad60d29a21adef95ebc1e883 [0,2,0,0,0,0|1,0,0]=3 13817 B13R1.718 CC[C@@H](C)CNCc1ncccn1 eaf42b5d5b359b4622ba801f2a5d2c4c [0,2,0,0,0,0|1,0,0]=3 13818 B13R1.718 CC[C@@H](C)COCc1ccccc1 3acbc56912048406996b8b9ea7a10564 [0,2,0,0,0,0|1,0,0]=3 13819 B13R1.718 CC[C@@H](C)COCc1ccccn1 618f3b9796e3c4139e4546044d36cf66 [0,2,0,0,0,0|0,0,0]=2 13820 B13R1.718 CC[C@@H](C)COCc1cccnc1 2082720fd42b4aa1edce5af9da79dea5 [0,2,0,0,0,0|2,0,0]=4 13821 B13R1.718 CC[C@@H](C)COCc1cccnn1 2878945f0ba11a4e5aed5a84e6508c98 [0,2,0,0,0,0|1,0,0]=3 13822 B13R1.718 CC[C@@H](C)COCc1ccncc1 41b531a174290966234eea8ec43f0d04 [0,2,0,0,0,0|2,0,0]=4 13823 B13R1.718 CC[C@@H](C)COCc1ccncn1 f6c695a5f49c459672e8f6b117c4d10c [0,2,0,0,0,0|1,0,0]=3 13824 B13R1.718 CC[C@@H](C)COCc1cnccn1 e47e141e86f26a829ceb3ce5715f2b95 [0,2,0,0,0,0|1,0,0]=3 13825 B13R1.718 CC[C@@H](C)COCc1ncccn1 e92cd6564d507c01343353176778fe9f [0,2,0,0,0,0|1,0,0]=3 13826 B13R1.718 CC[C@@H](C)NCCc1ccccc1 e9d3e12ce5c5fe10ecfef40b36bd9295 [0,2,0,0,0,0|1,0,0]=3 13827 B13R1.718 CC[C@@H](C)NCCc1ccccn1 f7ebab828ca2f6be9c3b33aa3dd6dbe7 [0,2,0,0,0,0|0,0,0]=2 13828 B13R1.718 CC[C@@H](C)NCCc1cccnc1 f3c3da2070322882317bc4767bc887bc [0,2,0,0,0,0|2,0,0]=4 13829 B13R1.718 CC[C@@H](C)NCCc1ccncc1 a2eaf66e025a64954325e257f25941ff [0,2,0,0,0,0|2,0,0]=4 13830 B13R1.718 CC[C@@H](C)OCCc1ccccc1 2f036ce5b90828a6d2f870c2a2025003 [0,2,0,0,0,0|1,0,0]=3 13831 B13R1.718 CC[C@@H](C)OCCc1ccccn1 c8dfdc4d34e2a9d7a3e1dcfc6e82b851 [0,2,0,0,0,0|0,0,0]=2 13832 B13R1.718 CC[C@@H](C)OCCc1cccnc1 41a64098193fe71415d4ac451b43fca7 [0,2,0,0,0,0|2,0,0]=4 13833 B13R1.718 CC[C@@H](C)OCCc1ccncc1 f3ce52893ae2613a1f9244fa8f44d808 [0,2,0,0,0,0|2,0,0]=4 13834 B13R1.718 CC[C@@H](O)CNCc1ccccc1 442d164a8251681b791974d837cea552 [0,2,0,0,0,0|1,0,0]=3 13835 B13R1.718 CC[C@@H](O)CNCc1ccccn1 f1c9fbda99cbc87879628833c6984590 [0,2,0,0,0,0|0,0,0]=2 13836 B13R1.718 CC[C@@H](O)CNCc1cccnc1 4990261c74598a011657339abb494d29 [0,2,0,0,0,0|2,0,0]=4 13837 B13R1.718 CC[C@@H](O)CNCc1cccnn1 579167ac99135f45d14f198aa2479439 [0,2,0,0,0,0|1,0,0]=3 13838 B13R1.718 CC[C@@H](O)CNCc1ccncn1 8607890bf0d8487a01b22e71364fd9e6 [0,2,0,0,0,0|1,0,0]=3 13839 B13R1.718 CC[C@@H](O)CNCc1ncccn1 c0697e6bd25ad3471ba0873d1d5d9850 [0,2,0,0,0,0|1,0,0]=3 13840 B13R1.718 CC[C@H](C)CNCc1ccccc1 57f32a8258da15a9bcf0119991ef3cbb [0,2,0,0,0,0|1,0,0]=3 13841 B13R1.718 CC[C@H](C)CNCc1ccccn1 3f914e701726efd5ff6121ae17150fc4 [0,2,0,0,0,0|0,0,0]=2 13842 B13R1.718 CC[C@H](C)CNCc1cccnc1 13376d16a9a0740e92da57b6537717c2 [0,2,0,0,0,0|2,0,0]=4 13843 B13R1.718 CC[C@H](C)CNCc1cccnn1 d500742127eee3213fecd0c9d84d3da7 [0,2,0,0,0,0|1,0,0]=3 13844 B13R1.718 CC[C@H](C)CNCc1ccncc1 7a94ad5037af910dd5014fec903b540b [0,2,0,0,0,0|2,0,0]=4 13845 B13R1.718 CC[C@H](C)CNCc1ccncn1 12bb969ae345fc34b802cbcbbf37479c [0,2,0,0,0,0|1,0,0]=3 13846 B13R1.718 CC[C@H](C)CNCc1cnccn1 b315448c8bfa33c00588c311a5d94ad2 [0,2,0,0,0,0|1,0,0]=3 13847 B13R1.718 CC[C@H](C)CNCc1ncccn1 e5d66013c0970814381ab4a1e41b7e28 [0,2,0,0,0,0|1,0,0]=3 13848 B13R1.718 CC[C@H](C)COCc1ccccc1 3b63c6ed8446e2d55321d06d46f32904 [0,2,0,0,0,0|1,0,0]=3 13849 B13R1.718 CC[C@H](C)COCc1ccccn1 66f5981fc79bdf4b8dd51e817064c9e6 [0,2,0,0,0,0|0,0,0]=2 13850 B13R1.718 CC[C@H](C)COCc1cccnc1 04109a15eb726aa89d0dda7ba084fd90 [0,2,0,0,0,0|2,0,0]=4 13851 B13R1.718 CC[C@H](C)COCc1cccnn1 afa8e9a3379c6b073967bf12f1802729 [0,2,0,0,0,0|1,0,0]=3 13852 B13R1.718 CC[C@H](C)COCc1ccncc1 31d735532f7f405c7342d5e6e7b328b5 [0,2,0,0,0,0|2,0,0]=4 13853 B13R1.718 CC[C@H](C)COCc1ccncn1 5c8a01415a45671e0025c9cc734598e6 [0,2,0,0,0,0|1,0,0]=3 13854 B13R1.718 CC[C@H](C)COCc1cnccn1 f4beb94c082fa47c8e400bc2f9d1a62d [0,2,0,0,0,0|1,0,0]=3 13855 B13R1.718 CC[C@H](C)COCc1ncccn1 25e66a2b7d04b79c5a9924f75fc26f8e [0,2,0,0,0,0|1,0,0]=3 13856 B13R1.718 CC[C@H](C)NCCc1ccccc1 5bd761bea609e39e2c4848d512bd6573 [0,2,0,0,0,0|1,0,0]=3 13857 B13R1.718 CC[C@H](C)NCCc1ccccn1 a4d51fae7d9f29581ff83fc8e65c4b23 [0,2,0,0,0,0|0,0,0]=2 13858 B13R1.718 CC[C@H](C)NCCc1cccnc1 6563b6f6ef2abf876373103666f50882 [0,2,0,0,0,0|2,0,0]=4 13859 B13R1.718 CC[C@H](C)NCCc1ccncc1 210ce4c420b08f79902b74c8b0b4b94e [0,2,0,0,0,0|2,0,0]=4 13860 B13R1.718 CC[C@H](C)OCCc1ccccc1 fd47c0386d3a87c182e4a46502f572e0 [0,2,0,0,0,0|1,0,0]=3 13861 B13R1.718 CC[C@H](C)OCCc1ccccn1 fdc69678de6406a9826576be1762a1d8 [0,2,0,0,0,0|0,0,0]=2 13862 B13R1.718 CC[C@H](C)OCCc1cccnc1 80c7f12edab426452259c8834c353483 [0,2,0,0,0,0|2,0,0]=4 13863 B13R1.718 CC[C@H](C)OCCc1ccncc1 8b403596e7c5b3c9eceb3171dd160f4d [0,2,0,0,0,0|2,0,0]=4 13864 B13R1.718 CN(C=O)CCSc1ccccn1 71704646f2b2f0fcde34300145dde59c [0,2,0,0,0,0|2,0,0]=4 13865 B13R1.718 CN(CF)CCSc1ccccn1 868c0b2515c6cdebdcc9af568c2d23da [0,2,0,0,0,0|2,0,0]=4 13866 B13R1.718 CN(CO)CCSc1ccccn1 509c5327bdba09ce3c131bb8c7ff20dd [0,2,0,0,0,0|2,0,0]=4 13867 B13R1.718 CNC(=O)CCNc1ccccn1 b5e269f8e9268eaad94eba4a6f47275c [0,2,0,0,0,0|1,0,1]=4 13868 B13R1.718 CNC(=O)CCOc1ccccn1 f28656fc0551a973ee712ccce7e2e225 [0,2,0,0,0,0|1,0,1]=4 13869 B13R1.718 CNC(=O)CNCc1ccccn1 e434960a4d9522c4546a026fda6e6d8a [0,2,0,0,0,0|1,0,1]=4 13870 B13R1.718 CNC(=O)COCc1ccccn1 78cd978f066aee6c94747109ad9ddbea [0,2,0,0,0,0|1,0,1]=4 13871 B13R1.718 COC(=O)CCNc1ccccn1 8b8ecc4192d355f55b158920649b72e9 [0,2,0,0,0,0|1,0,1]=4 13872 B13R1.718 COC(=O)CCOc1ccccn1 f11015687f960a0ca8a5bbd67f1f31d4 [0,2,0,0,0,0|1,0,1]=4 13873 B13R1.718 COC(=O)CNCc1ccccn1 1a20f57ea765e29967f50a2b801b615a [0,2,0,0,0,0|1,0,1]=4 13874 B13R1.718 COC(=O)COCc1ccccn1 732d69078b0bdefc362078b022d75fb3 [0,2,0,0,0,0|1,0,1]=4 13875 B13R1.718 COC(C)CNCc1ccccc1 935d8bcd6bac3c25b8154fa2d564e57b [0,2,0,0,0,0|2,0,0]=4 13876 B13R1.718 COC(C)CNCc1ccccn1 7d324311a47f57421db02c642a1de64e [0,2,0,0,0,0|1,0,0]=3 13877 B13R1.718 COC(C)CNCc1cccnn1 f04e37592cce774a75e0f2db9d6a9e4d [0,2,0,0,0,0|2,0,0]=4 13878 B13R1.718 COC(C)CNCc1ccncn1 fff9b03263d6c14dcd2615e8475250fd [0,2,0,0,0,0|2,0,0]=4 13879 B13R1.718 COC(C)CNCc1cnccn1 f521602c0ad26eea9960791bb3f0cb25 [0,2,0,0,0,0|2,0,0]=4 13880 B13R1.718 COC(C)CNCc1ncccn1 42b2d4d926e025b18213abfa4f0aa7f3 [0,2,0,0,0,0|2,0,0]=4 13881 B13R1.718 COC(C)COCc1ccccc1 abc0b1f0547ce39d198869ca56fd0562 [0,2,0,0,0,0|2,0,0]=4 13882 B13R1.718 COC(C)COCc1ccccn1 9c0c3387109963140ce660d78f59fae9 [0,2,0,0,0,0|1,0,0]=3 13883 B13R1.718 COC(C)COCc1cccnn1 70d2d53360c2c1fdb3bb36818492fccd [0,2,0,0,0,0|2,0,0]=4 13884 B13R1.718 COC(C)COCc1ccncn1 c8db68b2557d26dffed2f6321b96c734 [0,2,0,0,0,0|2,0,0]=4 13885 B13R1.718 COC(C)COCc1cnccn1 b609b75417ad0f61cdca1a692b679b39 [0,2,0,0,0,0|2,0,0]=4 13886 B13R1.718 COC(C)COCc1ncccn1 2ff8a7aefda69aaa9c5d76bbddde70cf [0,2,0,0,0,0|2,0,0]=4 13887 B13R1.718 CO[C@@H](C)CNCc1ccccc1 9f07176a9fb98435253fe40059f5c78c [0,2,0,0,0,0|2,0,0]=4 13888 B13R1.718 CO[C@@H](C)CNCc1ccccn1 11d0640868b38d18ffdc6a6f8e360405 [0,2,0,0,0,0|1,0,0]=3 13889 B13R1.718 CO[C@@H](C)CNCc1cccnn1 6742299dca4fb37edc28601fd53eda0e [0,2,0,0,0,0|2,0,0]=4 13890 B13R1.718 CO[C@@H](C)CNCc1ccncn1 2cdd3164062c683c1a0c0f8fb037a5c5 [0,2,0,0,0,0|2,0,0]=4 13891 B13R1.718 CO[C@@H](C)CNCc1cnccn1 1860a1cc126f523c42843af2a5fc3daf [0,2,0,0,0,0|2,0,0]=4 13892 B13R1.718 CO[C@@H](C)CNCc1ncccn1 2578fbc1aa2028f782efd90b563dd970 [0,2,0,0,0,0|2,0,0]=4 13893 B13R1.718 CO[C@@H](C)COCc1ccccc1 88aecf7f711ca4c8fca58ebe797b8738 [0,2,0,0,0,0|2,0,0]=4 13894 B13R1.718 CO[C@@H](C)COCc1ccccn1 8a34b39242aa0ff73d3fc5dfa1b96beb [0,2,0,0,0,0|1,0,0]=3 13895 B13R1.718 CO[C@@H](C)COCc1cccnn1 72da3c1586b7ff175cdf66943d977790 [0,2,0,0,0,0|2,0,0]=4 13896 B13R1.718 CO[C@@H](C)COCc1ccncn1 f58daa4e20f7c3a894b1b9b37f0bdf59 [0,2,0,0,0,0|2,0,0]=4 13897 B13R1.718 CO[C@@H](C)COCc1cnccn1 7cc1a44ccfe504ddfb8d94ac0914612c [0,2,0,0,0,0|2,0,0]=4 13898 B13R1.718 CO[C@@H](C)COCc1ncccn1 4ec7d8e94be14e19c198891e00c4896f [0,2,0,0,0,0|2,0,0]=4 13899 B13R1.718 CO[C@H](C)CNCc1ccccc1 1add30759e3e93204168617275f53841 [0,2,0,0,0,0|2,0,0]=4 13900 B13R1.718 CO[C@H](C)CNCc1ccccn1 47a882164f5933818de2ad21cc6cc181 [0,2,0,0,0,0|1,0,0]=3 13901 B13R1.718 CO[C@H](C)CNCc1cccnn1 b77cfb0271701c442d3c521e20517c5b [0,2,0,0,0,0|2,0,0]=4 13902 B13R1.718 CO[C@H](C)CNCc1ccncn1 5d362d07dfac59bf36c0951587e09e25 [0,2,0,0,0,0|2,0,0]=4 13903 B13R1.718 CO[C@H](C)CNCc1cnccn1 75f937163d111b250516e4cf2f6deb1e [0,2,0,0,0,0|2,0,0]=4 13904 B13R1.718 CO[C@H](C)CNCc1ncccn1 b4291fe8e70c9da97d4818f305a79024 [0,2,0,0,0,0|2,0,0]=4 13905 B13R1.718 CO[C@H](C)COCc1ccccc1 c455f4df22b5e153ceb05224bc6c1d03 [0,2,0,0,0,0|2,0,0]=4 13906 B13R1.718 CO[C@H](C)COCc1ccccn1 4e0a6a78364c66be69256e55434e3b7d [0,2,0,0,0,0|1,0,0]=3 13907 B13R1.718 CO[C@H](C)COCc1cccnn1 5fc3a8700b38f14f617ad39b8c186a8f [0,2,0,0,0,0|2,0,0]=4 13908 B13R1.718 CO[C@H](C)COCc1ccncn1 bfd12885f91214c8cb29bc5d1cfb9ef2 [0,2,0,0,0,0|2,0,0]=4 13909 B13R1.718 CO[C@H](C)COCc1cnccn1 48077019a2feba2325a2a5bdc007b20d [0,2,0,0,0,0|2,0,0]=4 13910 B13R1.718 CO[C@H](C)COCc1ncccn1 797d8dbbf42d01c1d742d53d60707ac6 [0,2,0,0,0,0|2,0,0]=4 13911 B13R1.718 C[C@@H](CO)CCNc1ccccc1 64eab2116b6261f4048d30e4ad5a6f62 [0,2,0,0,0,0|2,0,0]=4 13912 B13R1.718 C[C@@H](CO)CCNc1cccnn1 ea6d7a11e417f33cddebde382207b06b [0,2,0,0,0,0|2,0,0]=4 13913 B13R1.718 C[C@@H](CO)CCNc1ccncn1 10e9fd8493aa62982a02718091b0c08a [0,2,0,0,0,0|2,0,0]=4 13914 B13R1.718 C[C@@H](CO)CNCc1ccccc1 e2f2b6480afeb47c9d182f8bf342ee78 [0,2,0,0,0,0|2,0,0]=4 13915 B13R1.718 C[C@@H](CO)CNCc1ccccn1 624b5acd3d811f8a7d0711998df552f5 [0,2,0,0,0,0|1,0,0]=3 13916 B13R1.718 C[C@@H](CO)CNCc1cccnn1 6410b48e51aa248768c856e814fc0cd7 [0,2,0,0,0,0|2,0,0]=4 13917 B13R1.718 C[C@@H](CO)CNCc1ccncn1 b3b7b0678bd92da8c9909be0aa2a2845 [0,2,0,0,0,0|2,0,0]=4 13918 B13R1.718 C[C@@H](CO)CNCc1cnccn1 97ac979de0dd947046a5077c2cd8cc4b [0,2,0,0,0,0|2,0,0]=4 13919 B13R1.718 C[C@@H](CO)CNCc1ncccn1 65b2157300e7fea7ebd18387ce758e9f [0,2,0,0,0,0|2,0,0]=4 13920 B13R1.718 C[C@@H](CO)NCCc1ccccc1 becda43359cccf2ad88f7b4db8f3be9f [0,2,0,0,0,0|2,0,0]=4 13921 B13R1.718 C[C@@H](CO)NCCc1ccccn1 c5e8ea5ea171b001729be6671a15f573 [0,2,0,0,0,0|1,0,0]=3 13922 B13R1.718 C[C@@H](CO)NCCc1ccncn1 556a6fd3f7d1ab8df0e152362be7fdcc [0,2,0,0,0,0|2,0,0]=4 13923 B13R1.718 C[C@@H](CO)NCCc1cnccn1 e84ccfa1728f099cb7891e7e0f4d3d3c [0,2,0,0,0,0|2,0,0]=4 13924 B13R1.718 C[C@@H](CO)NCCc1ncccn1 a0835faeb1584612b1e59046e6b4284a [0,2,0,0,0,0|2,0,0]=4 13925 B13R1.718 C[C@H](C=O)NCCc1ccccc1 bd6dd098fe0df74c78dc8f01b3196352 [0,2,0,0,0,0|2,0,0]=4 13926 B13R1.718 C[C@H](C=O)NCCc1ccccn1 c977a8364ba24cc1d61310fcbf27fa2a [0,2,0,0,0,0|1,0,0]=3 13927 B13R1.718 C[C@H](C=O)NCCc1ccncn1 d73f764ddb2aa22c1dc4ed82e51cb6ae [0,2,0,0,0,0|2,0,0]=4 13928 B13R1.718 C[C@H](C=O)NCCc1cnccn1 dcd4dac9ab59cb6c0763e4d429bd3882 [0,2,0,0,0,0|2,0,0]=4 13929 B13R1.718 C[C@H](C=O)NCCc1ncccn1 3a53d6f5ce0b96b2b579db258ecc3336 [0,2,0,0,0,0|2,0,0]=4 13930 B13R1.718 C[C@H](C=O)OCCc1ccccc1 8c7ec29912b16ed581054220a3356151 [0,2,0,0,0,0|2,0,0]=4 13931 B13R1.718 C[C@H](C=O)OCCc1ccccn1 810a565c503d34919809d2194eb1275f [0,2,0,0,0,0|1,0,0]=3 13932 B13R1.718 C[C@H](C=O)OCCc1ccncn1 241e58bb990017c66d21354b98d549a0 [0,2,0,0,0,0|2,0,0]=4 13933 B13R1.718 C[C@H](C=O)OCCc1cnccn1 3abc2685f03c1ec9082d14cbb21a0ce7 [0,2,0,0,0,0|2,0,0]=4 13934 B13R1.718 C[C@H](C=O)OCCc1ncccn1 9d8a9d714c9da39553208cc3276c097e [0,2,0,0,0,0|2,0,0]=4 13935 B13R1.718 C[C@H](CO)CNCc1ccccc1 92800f4bfb7229bb709a604d05a50f8b [0,2,0,0,0,0|2,0,0]=4 13936 B13R1.718 C[C@H](CO)CNCc1ccccn1 c9ad8a7651d307f1ff828516023bbe47 [0,2,0,0,0,0|1,0,0]=3 13937 B13R1.718 C[C@H](CO)CNCc1cccnn1 2091a433fa1859700664cda29687428f [0,2,0,0,0,0|2,0,0]=4 13938 B13R1.718 C[C@H](CO)CNCc1ccncn1 c4bdbb5af5da87fb9ae50556bcb8a3fb [0,2,0,0,0,0|2,0,0]=4 13939 B13R1.718 C[C@H](CO)CNCc1cnccn1 d930ebbaf15fa44fac2d3947c5399c33 [0,2,0,0,0,0|2,0,0]=4 13940 B13R1.718 C[C@H](CO)CNCc1ncccn1 4e36e45208f77f51d8e11d077dc09f97 [0,2,0,0,0,0|2,0,0]=4 13941 B13R1.718 C[C@H](CO)NCCc1ccccc1 2a41261301307fce936b23ca5418cc20 [0,2,0,0,0,0|2,0,0]=4 13942 B13R1.718 C[C@H](CO)NCCc1ccccn1 f1fd243df6dff79c3d86e824cd42de64 [0,2,0,0,0,0|1,0,0]=3 13943 B13R1.718 C[C@H](CO)NCCc1ccncn1 9ded89c7e7d824d2cde957ef08f0e8bc [0,2,0,0,0,0|2,0,0]=4 13944 B13R1.718 C[C@H](CO)NCCc1cnccn1 927018b36306906d825ae8b4a6f80f2c [0,2,0,0,0,0|2,0,0]=4 13945 B13R1.718 C[C@H](CO)NCCc1ncccn1 c09fbb0ad15a00496c0336c73e74df4b [0,2,0,0,0,0|2,0,0]=4 13946 B13R1.718 C[C@H](CS)OCCc1ccccc1 f9b1b9175172eabe9502e1f20520b92a [0,2,0,0,0,0|2,0,0]=4 13947 B13R1.718 C[C@H](CS)OCCc1ccccn1 5847a5c15424f2bb93da7d12ea3178a3 [0,2,0,0,0,0|1,0,0]=3 13948 B13R1.718 ClCC(Cl)COCc1ccccc1 d12322f8a7b092d05f034f37cd13991d [0,2,0,0,0,0|2,0,0]=4 13949 B13R1.718 ClCC(Cl)COCc1ccccn1 118354aaf34e67baff878c0087929895 [0,2,0,0,0,0|1,0,0]=3 13950 B13R1.718 ClCC(Cl)COCc1cccnn1 d5f651e70f05269960adaea6af9c7064 [0,2,0,0,0,0|2,0,0]=4 13951 B13R1.718 ClCC(Cl)COCc1ccncn1 152deb57a5b91e3f35415e1e6e06fd26 [0,2,0,0,0,0|2,0,0]=4 13952 B13R1.718 ClCC(Cl)COCc1ncccn1 e40aed6552881321b8a13bc1ac33734d [0,2,0,0,0,0|2,0,0]=4 13953 B13R1.718 O=C(CF)NCCc1ccccn1 50d92d1bfd960be51534e45157ac7563 [0,2,0,0,0,0|1,0,1]=4 13954 B13R1.718 O=C(CO)CNCc1ccccn1 b4585d94654c08bb5fbdd8247502c547 [0,2,0,0,0,0|1,0,1]=4 13955 B13R1.718 O=C(CO)NCCc1ccccn1 456df6a075b8bafd16fed309d27cf7e8 [0,2,0,0,0,0|1,0,1]=4 13956 B13R1.718 O=C(CS)NCCc1ccccn1 df755efe53bd0a7791f4a7df524a8b3a [0,2,0,0,0,0|1,0,1]=4 13957 B13R1.718 OC(CF)CNCc1ccccc1 29c345fed18c163df8bb2ed652691484 [0,2,0,0,0,0|2,0,0]=4 13958 B13R1.718 OC(CF)CNCc1ccccn1 5071165548b8903832e129ebff988d89 [0,2,0,0,0,0|1,0,0]=3 13959 B13R1.718 OC(CF)CNCc1cccnn1 1b56cbdefafc2767cb777cd6daf13754 [0,2,0,0,0,0|2,0,0]=4 13960 B13R1.718 OC(CF)CNCc1ccncn1 4a81fb04f092199874419f08eb24d368 [0,2,0,0,0,0|2,0,0]=4 13961 B13R1.718 OC(CF)CNCc1cnccn1 3adcd2e8e88988d66ca230ed148e2e43 [0,2,0,0,0,0|2,0,0]=4 13962 B13R1.718 OC(CF)CNCc1ncccn1 0af83098669cc8c09fac31a8193f6110 [0,2,0,0,0,0|2,0,0]=4 13963 B13R1.718 OCC(F)CNCc1ccccc1 244608a5191f35d15a9a09d6eefb2a7e [0,2,0,0,0,0|2,0,0]=4 13964 B13R1.718 OCC(F)CNCc1ccccn1 501dba398eacf785e9d5af5731072af2 [0,2,0,0,0,0|1,0,0]=3 13965 B13R1.718 OCC(F)CNCc1cccnn1 8db6b63f8d714fb3960bfbc620f7dc82 [0,2,0,0,0,0|2,0,0]=4 13966 B13R1.718 OCC(F)CNCc1ccncn1 c9093b9c4667c0b3570b52a9d1f2a794 [0,2,0,0,0,0|2,0,0]=4 13967 B13R1.718 OCC(F)CNCc1ncccn1 e16b39a68dc75ccbadf5ecdc41334790 [0,2,0,0,0,0|2,0,0]=4 13968 B13R1.718 OCC(O)CCNc1ccccc1 1c3b9de4d883af7fb997db036d207d12 [0,2,0,0,0,0|2,0,0]=4 13969 B13R1.718 OCC(O)CCNc1ccccn1 44abe0f0b0e231f28f9d15e96d5f8bc1 [0,2,0,0,0,0|1,0,0]=3 13970 B13R1.718 OCC(O)CCNc1cccnn1 3e28bc2ca57f5eda4148861af306400b [0,2,0,0,0,0|2,0,0]=4 13971 B13R1.718 OCC(O)CCNc1ccncn1 1dbde44ddb3daae93bf8e9b4d74c700b [0,2,0,0,0,0|2,0,0]=4 13972 B13R1.718 OCC(O)CCNc1cnccn1 3fcd3e60eb39afea986c436db9d14d8b [0,2,0,0,0,0|2,0,0]=4 13973 B13R1.718 OCC(O)CNCc1ccccc1 10b7e4262107d48cf003832f5cb1c48c [0,2,0,0,0,0|2,0,0]=4 13974 B13R1.718 OCC(O)CNCc1ccccn1 7ed5048990e8918868456e0fed6394f0 [0,2,0,0,0,0|1,0,0]=3 13975 B13R1.718 OCC(O)CNCc1cccnn1 778beb9e65625f1efc09e119213e1f10 [0,2,0,0,0,0|2,0,0]=4 13976 B13R1.718 OCC(O)CNCc1ccncn1 9d47d7cb6c317625edc83b5d75bb44a8 [0,2,0,0,0,0|2,0,0]=4 13977 B13R1.718 OCC(O)CNCc1cnccn1 19e0feef17ccc0b0dbecbe0da4e5da00 [0,2,0,0,0,0|2,0,0]=4 13978 B13R1.718 OCC(O)CNCc1ncccn1 94993eeede8d5d306f75c8213b21452c [0,2,0,0,0,0|2,0,0]=4 13979 B13R1.718 OCC(O)COCc1ccccc1 bd5ea9844f1ddb361d6cf950f4f789f5 [0,2,0,0,0,0|2,0,0]=4 13980 B13R1.718 OCC(O)COCc1ccccn1 90acdc4cb454f093370c1a5a9deaefd0 [0,2,0,0,0,0|1,0,0]=3 13981 B13R1.718 OCC(O)COCc1cccnn1 95b8c6e65d49a91eac7162d761f8e971 [0,2,0,0,0,0|2,0,0]=4 13982 B13R1.718 OCC(O)COCc1ccncn1 2d077385de903ef1ae586a1bee006e71 [0,2,0,0,0,0|2,0,0]=4 13983 B13R1.718 OCC(O)COCc1cnccn1 9c5b61684b8f6bb2fd164b604c0cac14 [0,2,0,0,0,0|2,0,0]=4 13984 B13R1.718 OCC(O)COCc1ncccn1 4e3b44ac7c5b4ddf84b35d943302180d [0,2,0,0,0,0|2,0,0]=4 13985 B13R1.718 OC[C@@H](F)CNCc1ccccc1 332d23e9ac872b67c6e0047480e015b3 [0,2,0,0,0,0|2,0,0]=4 13986 B13R1.718 OC[C@@H](F)CNCc1ccccn1 58d0b6938aecb7c6b73447e9d8396c41 [0,2,0,0,0,0|1,0,0]=3 13987 B13R1.718 OC[C@@H](F)CNCc1cccnn1 28336a92d3b57ae004daad5176b480d3 [0,2,0,0,0,0|2,0,0]=4 13988 B13R1.718 OC[C@@H](F)CNCc1ccncn1 450ed5ad5d39450d39644fabf06110e4 [0,2,0,0,0,0|2,0,0]=4 13989 B13R1.718 OC[C@@H](F)CNCc1ncccn1 3fc3b9b41feaa9f966de9c32ddad6121 [0,2,0,0,0,0|2,0,0]=4 13990 B13R1.718 OC[C@@H](O)CNCc1ccccc1 f728b5b7979ca926a75153faa67f16f6 [0,2,0,0,0,0|2,0,0]=4 13991 B13R1.718 OC[C@@H](O)CNCc1ccccn1 c87e9010487a215b42319c2250b37cc4 [0,2,0,0,0,0|1,0,0]=3 13992 B13R1.718 OC[C@@H](O)CNCc1cccnn1 d1427dfef4022732a9e8df37c0648d8e [0,2,0,0,0,0|2,0,0]=4 13993 B13R1.718 OC[C@@H](O)CNCc1ccncn1 0533729e0d879010d392c80f3d076463 [0,2,0,0,0,0|2,0,0]=4 13994 B13R1.718 OC[C@@H](O)CNCc1cnccn1 bb098af91f423972d81fe8ffe30960a6 [0,2,0,0,0,0|2,0,0]=4 13995 B13R1.718 OC[C@@H](O)CNCc1ncccn1 289831abfa2c7714e22ce2fbe1abb4e5 [0,2,0,0,0,0|2,0,0]=4 13996 B13R1.718 OC[C@@H](O)COCc1ccccc1 5c80659e749ab7eada73498294e7773c [0,2,0,0,0,0|2,0,0]=4 13997 B13R1.718 OC[C@@H](O)COCc1ccccn1 968b1c3c9843f57870539fc42b4d1c12 [0,2,0,0,0,0|1,0,0]=3 13998 B13R1.718 OC[C@@H](O)COCc1cccnn1 b1b31d256ecfd26bbcda151dca5a0439 [0,2,0,0,0,0|2,0,0]=4 13999 B13R1.718 OC[C@@H](O)COCc1ccncn1 72a8e992e0aaec2da12751d9289d77bc [0,2,0,0,0,0|2,0,0]=4 14000 B13R1.718 OC[C@@H](O)COCc1cnccn1 d0ab469b95ed142a442914e53c6272f8 [0,2,0,0,0,0|2,0,0]=4 14001 B13R1.718 OC[C@@H](O)COCc1ncccn1 38894f199cab16aa9a17a0462fe82544 [0,2,0,0,0,0|2,0,0]=4 14002 B13R1.718 OC[C@H](F)CNCc1ccccc1 da94ebd7bb5ca16b0c08affc7573db81 [0,2,0,0,0,0|2,0,0]=4 14003 B13R1.718 OC[C@H](F)CNCc1ccccn1 104163af92c14021b441de147081035a [0,2,0,0,0,0|1,0,0]=3 14004 B13R1.718 OC[C@H](F)CNCc1cccnn1 379ade495834ba0766bd1a801ab454b3 [0,2,0,0,0,0|2,0,0]=4 14005 B13R1.718 OC[C@H](F)CNCc1ccncn1 5cbf56cc0b36046d351f464bf277fd2c [0,2,0,0,0,0|2,0,0]=4 14006 B13R1.718 OC[C@H](F)CNCc1ncccn1 5fab2e2e5e763d4e267c02b737556e79 [0,2,0,0,0,0|2,0,0]=4 14007 B13R1.718 OC[C@H](O)CNCc1ccccc1 e8f6692d108ebc12a57f59d0133d16d6 [0,2,0,0,0,0|2,0,0]=4 14008 B13R1.718 OC[C@H](O)CNCc1ccccn1 57b140d96e93304db3aff81789485e44 [0,2,0,0,0,0|1,0,0]=3 14009 B13R1.718 OC[C@H](O)CNCc1cccnn1 2bd0406927942012231524d0cb1c762c [0,2,0,0,0,0|2,0,0]=4 14010 B13R1.718 OC[C@H](O)CNCc1ccncn1 51ce85c2430c6fdf4f3306085087ebfa [0,2,0,0,0,0|2,0,0]=4 14011 B13R1.718 OC[C@H](O)CNCc1cnccn1 dfcd533d5dfd51b1c2c5d78a63d18fac [0,2,0,0,0,0|2,0,0]=4 14012 B13R1.718 OC[C@H](O)CNCc1ncccn1 e4ec24fa2c90d989d13821ced4732a47 [0,2,0,0,0,0|2,0,0]=4 14013 B13R1.718 OC[C@H](O)COCc1ccccc1 78b4838e76aaf78bf6362dc57b2a4d86 [0,2,0,0,0,0|2,0,0]=4 14014 B13R1.718 OC[C@H](O)COCc1ccccn1 57312c5c12f7b487a45cb6122c03bb0c [0,2,0,0,0,0|1,0,0]=3 14015 B13R1.718 OC[C@H](O)COCc1cccnn1 88c6c4429fac3a369ea24509274ca015 [0,2,0,0,0,0|2,0,0]=4 14016 B13R1.718 OC[C@H](O)COCc1ccncn1 564d17d599e3a50fe90c8e01140bbcd4 [0,2,0,0,0,0|2,0,0]=4 14017 B13R1.718 OC[C@H](O)COCc1cnccn1 1cac1ab2a7fedea9083dd57255953adc [0,2,0,0,0,0|2,0,0]=4 14018 B13R1.718 OC[C@H](O)COCc1ncccn1 d8343500b920f98d80f3a4e359ac09ae [0,2,0,0,0,0|2,0,0]=4 14019 B13R1.718 SCC(S)COCc1ccccc1 88271685b7cb8bfb9d3c1fc004140dc4 [0,2,0,0,0,0|2,0,0]=4 14020 B13R1.718 SCC(S)COCc1ccccn1 b54b4c001755a00f7f6ce23be44465da [0,2,0,0,0,0|1,0,0]=3 14021 B13R1.718 SCC(S)COCc1cccnn1 0ed102d9ee56080cb6fef54ac27f2180 [0,2,0,0,0,0|2,0,0]=4 14022 B13R1.718 SCC(S)COCc1ccncn1 552d175a5329509ed4eb37c1caf6dd71 [0,2,0,0,0,0|2,0,0]=4 14023 B13R1.718 SCC(S)COCc1ncccn1 af513d6b65f16017536817aaf8215988 [0,2,0,0,0,0|2,0,0]=4 14024 B13R1.11 C=C(CC)CN(C)c1ccccn1 ef1ffa40f66de598ec6ceed5eb5fed5d [0,2,0,0,0,0|1,0,1]=4 14025 B13R1.11 CC(CO)CN(C)c1ccccn1 506c4f51e759aaabda5549f83d544122 [0,2,0,0,0,0|2,0,0]=4 14026 B13R1.11 CC(CO)NC(C)c1ccccn1 963dc843d15e04a92fc3a281eb2e1d43 [0,2,0,0,0,0|2,0,0]=4 14027 B13R1.11 CC(CO)N[C@@H](C)c1ccccn1 4a229c34f1fd9706da678c0242250e33 [0,2,0,0,0,0|2,0,0]=4 14028 B13R1.11 CC(CO)N[C@H](C)c1ccccn1 045b12f978c170c034379f00d7afaff4 [0,2,0,0,0,0|2,0,0]=4 14029 B13R1.11 CC(N[C@@H](C)CO)c1ccccn1 2f60c66e53808ce91292ba7518984f11 [0,2,0,0,0,0|2,0,0]=4 14030 B13R1.11 CC(N[C@H](C)CO)c1ccccn1 22965acc8e9aa67970c3b1f0783bf5f7 [0,2,0,0,0,0|2,0,0]=4 14031 B13R1.11 CCC(=O)CN(C)c1ccccn1 41ad76af9925e39add0ca1c1ae2fa326 [0,2,0,0,0,0|1,0,1]=4 14032 B13R1.11 CCC(=O)NC(C)c1ccccn1 a76a5f8d404739c03a2908b0448027aa [0,2,0,0,0,0|1,0,1]=4 14033 B13R1.11 CCC(=O)N[C@@H](C)c1ccccn1 c6012fa9c850fbd6e20389bde136fdc3 [0,2,0,0,0,0|1,0,1]=4 14034 B13R1.11 CCC(=O)N[C@H](C)c1ccccn1 c08390a596659fa01ce54980230cf815 [0,2,0,0,0,0|1,0,1]=4 14035 B13R1.11 CCC(C)CN(C)c1ccccc1 e6b53dde7a74db55ad58a05fdea07312 [0,2,0,0,0,0|2,0,0]=4 14036 B13R1.11 CCC(C)CN(C)c1ccccn1 e18890c7395d68e3aff459c5f74eb593 [0,2,0,0,0,0|1,0,0]=3 14037 B13R1.11 CCC(C)CN(C)c1ccncn1 dc822c40b3e03c2639deff5b18570812 [0,2,0,0,0,0|2,0,0]=4 14038 B13R1.11 CCC(C)CN(C)c1cnccn1 262cc7fd8e04c5ba4fe4cf71022e0d67 [0,2,0,0,0,0|2,0,0]=4 14039 B13R1.11 CCC(C)CN(C)c1ncccn1 006826a06747d57aa66806a8e6c54929 [0,2,0,0,0,0|2,0,0]=4 14040 B13R1.11 CCC(C)NC(=O)c1ccccn1 b23862632c23cd8ceeb2c5565276c22d [0,2,0,0,0,0|1,0,1]=4 14041 B13R1.11 CCC(C)NC(C)c1ccccn1 498a104f9878200df566fbdf24b20802 [0,2,0,0,0,0|1,0,0]=3 14042 B13R1.11 CCC(C)NC(C)c1cccnn1 3d3657a031f268d2abc89b586f425253 [0,2,0,0,0,0|2,0,0]=4 14043 B13R1.11 CCC(C)NC(C)c1ccncn1 ef46a2346f24df77f9358b5bdf192792 [0,2,0,0,0,0|2,0,0]=4 14044 B13R1.11 CCC(C)NC(C)c1cnccn1 4649f9c4f270aad94f7a551b416ebff9 [0,2,0,0,0,0|2,0,0]=4 14045 B13R1.11 CCC(C)NC(C)c1ncccn1 f6c0b0781675743caa4a59c60ae34b1d [0,2,0,0,0,0|2,0,0]=4 14046 B13R1.11 CCC(C)N[C@@H](C)c1ccccn1 3d3a429d4eb95f1b789a2c00d4bda22c [0,2,0,0,0,0|1,0,0]=3 14047 B13R1.11 CCC(C)N[C@H](C)c1ccccn1 18fdbc9cc9f4d92c9ecbf2680367e8c0 [0,2,0,0,0,0|1,0,0]=3 14048 B13R1.11 CCC(C)OC(C)c1ccccc1 23996e8320585cc0f93c0989f3fb53ed [0,2,0,0,0,0|2,0,0]=4 14049 B13R1.11 CCC(C)OC(C)c1ccccn1 950cafcb86fdf11b17caa04898a7b20f [0,2,0,0,0,0|1,0,0]=3 14050 B13R1.11 CCC(C)OC(C)c1cccnn1 f69e660c7acdbe8c4b7e8b0ab59d166e [0,2,0,0,0,0|2,0,0]=4 14051 B13R1.11 CCC(C)OC(C)c1cnccn1 57838261f77e2bfc021aca68b2860f32 [0,2,0,0,0,0|2,0,0]=4 14052 B13R1.11 CCC(C)OC(C)c1ncccn1 055355554f98e3a4da3748e0b2c7ebb8 [0,2,0,0,0,0|2,0,0]=4 14053 B13R1.11 CCC(C)O[C@@H](C)c1ccccc1 a545d3c69554c273a1806cb61b834219 [0,2,0,0,0,0|2,0,0]=4 14054 B13R1.11 CCC(C)O[C@@H](C)c1ccccn1 131ce7b73a877c68147476eef823886d [0,2,0,0,0,0|1,0,0]=3 14055 B13R1.11 CCC(C)O[C@@H](C)c1ccncn1 44c9b6917cad9444166747d2ea96abb5 [0,2,0,0,0,0|2,0,0]=4 14056 B13R1.11 CCC(C)O[C@@H](C)c1cnccn1 e6b709cbbb09c618c50d061cf9bb7c9b [0,2,0,0,0,0|2,0,0]=4 14057 B13R1.11 CCC(C)O[C@@H](C)c1ncccn1 b34a4cbdf7f4665de5d0c2f021f4ac97 [0,2,0,0,0,0|2,0,0]=4 14058 B13R1.11 CCC(C)O[C@H](C)c1ccccc1 f0a1bee70840c95fe08a6ed0b3477055 [0,2,0,0,0,0|2,0,0]=4 14059 B13R1.11 CCC(C)O[C@H](C)c1ccccn1 7a3c864382f535b22e728ce5200ecee2 [0,2,0,0,0,0|1,0,0]=3 14060 B13R1.11 CCC(C)O[C@H](C)c1cccnn1 a12abe30b2969f7426b4600a43d86679 [0,2,0,0,0,0|2,0,0]=4 14061 B13R1.11 CCC(C)O[C@H](C)c1cnccn1 4acf62f94d3485db28042cf2221bbbb9 [0,2,0,0,0,0|2,0,0]=4 14062 B13R1.11 CCC(C)O[C@H](C)c1ncccn1 1e15006e45b88238d8ed86e06e5ebf7e [0,2,0,0,0,0|2,0,0]=4 14063 B13R1.11 CCC(O)CN(C)c1ccccc1 a4b445ea92b447b0b0e76cfd44ad0af7 [0,2,0,0,0,0|2,0,0]=4 14064 B13R1.11 CCC(O)CN(C)c1cnccn1 bf0a7fbe820b1ba4cd5dccdb173a3ffc [0,2,0,0,0,0|2,0,0]=4 14065 B13R1.11 CCN(C)CC(=O)c1ccccn1 692e9b0e5f182df69b2bdc19a5397b48 [0,2,0,0,0,0|1,0,1]=4 14066 B13R1.11 CCN(C)CC(O)c1ccccc1 d45ab040335d9c291ff1d0dee78bd157 [0,2,0,0,0,0|2,0,0]=4 14067 B13R1.11 CCN(C)CC(O)c1cnccn1 d0d781e0abcc28766c9a5583568ce9dd [0,2,0,0,0,0|2,0,0]=4 14068 B13R1.11 CCN(C)C[C@H](O)c1ccccc1 f912c0d939165dc0f095ac8f10acbab6 [0,2,0,0,0,0|2,0,0]=4 14069 B13R1.11 CC[C@@H](C)CN(C)c1ccccn1 3d4e8cfb993799cfb09035053bd2054a [0,2,0,0,0,0|1,0,0]=3 14070 B13R1.11 CC[C@@H](C)CN(C)c1ccncn1 21aeaadd27d2e202b15b0c41a7216023 [0,2,0,0,0,0|2,0,0]=4 14071 B13R1.11 CC[C@@H](C)CN(C)c1cnccn1 ec09314e94153105d6d2047a8c15f6ca [0,2,0,0,0,0|2,0,0]=4 14072 B13R1.11 CC[C@@H](C)CN(C)c1ncccn1 9c3a441201ada4f48faa6abbb0bfb4b2 [0,2,0,0,0,0|2,0,0]=4 14073 B13R1.11 CC[C@@H](C)NC(=O)c1ccccn1 16d74b3271ede29f75b491ebd74a934f [0,2,0,0,0,0|1,0,1]=4 14074 B13R1.11 CC[C@H](C)CN(C)c1ccccc1 5ad2d6fc9d65f8f5d517bc8783d741f0 [0,2,0,0,0,0|2,0,0]=4 14075 B13R1.11 CC[C@H](C)CN(C)c1ccccn1 93c523d225eca58ecac056a15a38b188 [0,2,0,0,0,0|1,0,0]=3 14076 B13R1.11 CC[C@H](C)CN(C)c1ccncn1 f0cabb6607caac4dfd5c80faae684af9 [0,2,0,0,0,0|2,0,0]=4 14077 B13R1.11 CC[C@H](C)CN(C)c1cnccn1 b8727e3a763aa57570c324fa517e309a [0,2,0,0,0,0|2,0,0]=4 14078 B13R1.11 CC[C@H](C)CN(C)c1ncccn1 026972050cfaf9288d5160358d8808a8 [0,2,0,0,0,0|2,0,0]=4 14079 B13R1.11 CC[C@H](C)NC(=O)c1ccccn1 890b757afc220f85813795e6e40e1ec8 [0,2,0,0,0,0|1,0,1]=4 14080 B13R1.11 COC(C)CN(C)c1ccccn1 c34455aab2c9e792f9038feb2ea42876 [0,2,0,0,0,0|2,0,0]=4 14081 B13R1.11 CO[C@@H](C)CN(C)c1ccccn1 f99a02c49f556c8223c3a3c0fa472b7d [0,2,0,0,0,0|2,0,0]=4 14082 B13R1.11 CO[C@H](C)CN(C)c1ccccn1 5016771b4dcce86534e8fb23122f378b [0,2,0,0,0,0|2,0,0]=4 14083 B13R1.11 C[C@@H](CO)CN(C)c1ccccn1 5dc116d9c5ffaf286eb576edce541c96 [0,2,0,0,0,0|2,0,0]=4 14084 B13R1.11 C[C@@H](CO)N[C@H](C)c1ccccn1 a43159b8efdee8f9ff586e3897dea16f [0,2,0,0,0,0|2,0,0]=4 14085 B13R1.11 C[C@H](CO)CN(C)c1ccccn1 9f2e45d3272b4ad5500949b7c98e882f [0,2,0,0,0,0|2,0,0]=4 14086 B13R1.11 C[C@H](CO)N[C@@H](C)c1ccccn1 6048e7941b2c42461e4f523bed1c041b [0,2,0,0,0,0|2,0,0]=4 14087 B13R1.11 C[C@H](CO)N[C@H](C)c1ccccn1 fe7d79aa50d4a4756fb1da39327d0bb2 [0,2,0,0,0,0|2,0,0]=4 14088 B13R1.11 C[C@H](N[C@@H](C)CO)c1ccccn1 6333bce3cff1eb923db36e801919bf69 [0,2,0,0,0,0|2,0,0]=4 14089 B13R1.15 C=C(CC)CNc1cc(ccn1)Br 47710e5d75507e8f001ce933b38946c4 [0,2,0,0,0,0|1,0,1]=4 14090 B13R1.15 C=C(CC)CNc1cc(ccn1)C 878dc509f0f0b2201f0354a82aceb690 [0,2,0,0,0,0|1,0,1]=4 14091 B13R1.15 C=C(CC)CNc1cc(ccn1)Cl 52e8a94d3129402c2cb376bf24c1393f [0,2,0,0,0,0|1,0,1]=4 14092 B13R1.15 C=C(CC)CNc1cc(ccn1)F e30ad688462494571a5d455abecc9c64 [0,2,0,0,0,0|1,0,1]=4 14093 B13R1.15 C=C(CC)CNc1cc(ccn1)I e619fdc55609dc221b0cb35afcd80ec7 [0,2,0,0,0,0|1,0,1]=4 14094 B13R1.15 C=C(CC)CNc1cccc(n1)Br b71a2d269b06e4b6cf693fb09c2cf39b [0,2,0,0,0,0|1,0,1]=4 14095 B13R1.15 C=C(CC)CNc1cccc(n1)C 8e2b5d95452d03680715a7496f7c556d [0,2,0,0,0,0|1,0,1]=4 14096 B13R1.15 C=C(CC)CNc1cccc(n1)Cl 22257c782a808925102e0ec5fd062aa7 [0,2,0,0,0,0|1,0,1]=4 14097 B13R1.15 C=C(CC)CNc1cccc(n1)F 9191e82caed31ec219d62812d04b5c21 [0,2,0,0,0,0|1,0,1]=4 14098 B13R1.15 C=C(CC)CNc1cccc(n1)I 5fc72c76c1b463db7c8c6d65808a8a0a [0,2,0,0,0,0|1,0,1]=4 14099 B13R1.15 C=C(CC)COc1cc(ccn1)Br 065ea6a5aac96f75c48e04299239d82c [0,2,0,0,0,0|1,0,1]=4 14100 B13R1.15 C=C(CC)COc1cc(ccn1)Cl de5f1528b7005ebd9fd50bf971a07529 [0,2,0,0,0,0|1,0,1]=4 14101 B13R1.15 C=C(CC)COc1cc(ccn1)F 6411525a8f3e8bcd2b73d949fcba58bb [0,2,0,0,0,0|1,0,1]=4 14102 B13R1.15 C=C(CC)COc1cccc(n1)Br fc9d71ad63eef01cc3329c0680cb62f0 [0,2,0,0,0,0|1,0,1]=4 14103 B13R1.15 C=C(CC)COc1cccc(n1)C 63c6e068cc438e8695fd0e4dd2966cc9 [0,2,0,0,0,0|1,0,1]=4 14104 B13R1.15 C=C(CC)COc1cccc(n1)F 2ce0015f2f80c0a2133b79152db88312 [0,2,0,0,0,0|1,0,1]=4 14105 B13R1.15 CC(CF)OCc1cc(ccn1)Br 8633ca353fe23dcbaa2cbf9e2cc0d5d6 [0,2,0,0,0,0|2,0,0]=4 14106 B13R1.15 CC(CF)OCc1cc(ccn1)Cl 7d172dc05e4b94d42b41701c2014867b [0,2,0,0,0,0|2,0,0]=4 14107 B13R1.15 CC(CF)OCc1cccc(n1)Br e12ded9258d61e014d3158ed6b6e53a5 [0,2,0,0,0,0|2,0,0]=4 14108 B13R1.15 CC(CF)OCc1cccc(n1)Cl e834368e1c45c5839bb71a836ba2fe16 [0,2,0,0,0,0|2,0,0]=4 14109 B13R1.15 CC(CF)OCc1cccc(n1)F 79e2e2bf9997c1084a39b5c6693ce614 [0,2,0,0,0,0|2,0,0]=4 14110 B13R1.15 CC(CO)CNc1cc(ccn1)Br 0dc1d13785f5d0df161fb7eb3d8d47ab [0,2,0,0,0,0|2,0,0]=4 14111 B13R1.15 CC(CO)CNc1cc(ccn1)Cl e632b33a0a16db0da117d4f202641415 [0,2,0,0,0,0|2,0,0]=4 14112 B13R1.15 CC(CO)CNc1cc(ccn1)F c38355a126c8e26611b6680fb1db73d2 [0,2,0,0,0,0|2,0,0]=4 14113 B13R1.15 CC(CO)CNc1cc(ccn1)I ea11cf4500f00b2c29d707345781b474 [0,2,0,0,0,0|2,0,0]=4 14114 B13R1.15 CC(CO)CNc1cccc(n1)Br 167da3d78cf0213003fb15b6888ae692 [0,2,0,0,0,0|2,0,0]=4 14115 B13R1.15 CC(CO)CNc1cccc(n1)Cl 2cc47c608c91d749dac4a26f4bf7aa6d [0,2,0,0,0,0|2,0,0]=4 14116 B13R1.15 CC(CO)CNc1cccc(n1)F ae98320726448fe2271a0b469cc5af88 [0,2,0,0,0,0|2,0,0]=4 14117 B13R1.15 CC(CO)CNc1cccc(n1)I 0e99b463269a2e59488270b74a6d0ec9 [0,2,0,0,0,0|2,0,0]=4 14118 B13R1.15 CC(CO)NCc1cc(ccn1)Br 865fabb60856bebe215cb935872003e8 [0,2,0,0,0,0|2,0,0]=4 14119 B13R1.15 CC(CO)NCc1cc(ccn1)Cl e94315260f4305814f2a545e11bd207a [0,2,0,0,0,0|2,0,0]=4 14120 B13R1.15 CC(CO)NCc1cccc(n1)Br 4e45c0df7ebf4a3d66701bc357f0ee07 [0,2,0,0,0,0|2,0,0]=4 14121 B13R1.15 CC(CO)NCc1cccc(n1)Cl a55e2fb63acf0c058a2901f9b3d95689 [0,2,0,0,0,0|2,0,0]=4 14122 B13R1.15 CC(CO)NCc1cccc(n1)F c459f3a63bd87f6c191649cec1a4fe10 [0,2,0,0,0,0|2,0,0]=4 14123 B13R1.15 CC(CS)OCc1cc(ccn1)Br 2248a45d15b7dd74530fd260a3a2ff26 [0,2,0,0,0,0|2,0,0]=4 14124 B13R1.15 CC(CS)OCc1cc(ccn1)Cl ca729745811ce8f9d3bd599248607210 [0,2,0,0,0,0|2,0,0]=4 14125 B13R1.15 CC(CS)OCc1cccc(n1)Br 366c0b0163d953a2494502648471d101 [0,2,0,0,0,0|2,0,0]=4 14126 B13R1.15 CC(CS)OCc1cccc(n1)Cl c464860a89dad0fee9797da28745d7fd [0,2,0,0,0,0|2,0,0]=4 14127 B13R1.15 CC(CS)OCc1cccc(n1)F 66c7ba85f751d82ea4db171d51618702 [0,2,0,0,0,0|2,0,0]=4 14128 B13R1.15 CCC(=O)CNc1cc(ccn1)Br e13029ac5b41dbca2f3cffd1dbc65ee6 [0,2,0,0,0,0|1,0,1]=4 14129 B13R1.15 CCC(=O)CNc1cc(ccn1)C f545eab1bc121464572482343d4a5e30 [0,2,0,0,0,0|1,0,1]=4 14130 B13R1.15 CCC(=O)CNc1cc(ccn1)Cl e4e8771a8441d364b8fb2f129eec891c [0,2,0,0,0,0|1,0,1]=4 14131 B13R1.15 CCC(=O)CNc1cc(ccn1)F 169ee59e25e19231e0c71a9db3958577 [0,2,0,0,0,0|1,0,1]=4 14132 B13R1.15 CCC(=O)CNc1cc(ccn1)I 5f2b2cc97740f77c65268b11fa1d247f [0,2,0,0,0,0|1,0,1]=4 14133 B13R1.15 CCC(=O)CNc1cccc(n1)Br b29811c8d1af7c708a3abf9915cff847 [0,2,0,0,0,0|1,0,1]=4 14134 B13R1.15 CCC(=O)CNc1cccc(n1)C 6d6ad4b5a294df50123226ddd1eb363a [0,2,0,0,0,0|1,0,1]=4 14135 B13R1.15 CCC(=O)CNc1cccc(n1)Cl 8730dd55c4d5a5a4e313bc94310463cd [0,2,0,0,0,0|1,0,1]=4 14136 B13R1.15 CCC(=O)CNc1cccc(n1)F 022a0203f78becc27fc7382676eca60a [0,2,0,0,0,0|1,0,1]=4 14137 B13R1.15 CCC(=O)CNc1cccc(n1)I 40f61f286a9938308678d3b227e515af [0,2,0,0,0,0|1,0,1]=4 14138 B13R1.15 CCC(=O)COc1cc(ccn1)Br 1ac4ce97fcba6eff159c06dbd136dbaa [0,2,0,0,0,0|1,0,1]=4 14139 B13R1.15 CCC(=O)COc1cc(ccn1)C 0a4c1be2e97027e87f5375e871ee1f88 [0,2,0,0,0,0|1,0,1]=4 14140 B13R1.15 CCC(=O)COc1cc(ccn1)Cl 49ccc7b3ad14f9013c318f614f25ea1b [0,2,0,0,0,0|1,0,1]=4 14141 B13R1.15 CCC(=O)COc1cc(ccn1)F 8107b0018ccf456a02ec9fd95163a433 [0,2,0,0,0,0|1,0,1]=4 14142 B13R1.15 CCC(=O)COc1cccc(n1)Br 14e7c0446d8477ab713198ccb317dd10 [0,2,0,0,0,0|1,0,1]=4 14143 B13R1.15 CCC(=O)COc1cccc(n1)C 416b8bbbec018da3f77fddb98585bc3c [0,2,0,0,0,0|1,0,1]=4 14144 B13R1.15 CCC(=O)COc1cccc(n1)F 6d78f66fd64ac0ea8be66b951e8ea291 [0,2,0,0,0,0|1,0,1]=4 14145 B13R1.15 CCC(=O)NCc1cc(ccn1)Br f08bb7c262143979759bfeee0acb8c72 [0,2,0,0,0,0|1,0,1]=4 14146 B13R1.15 CCC(=O)NCc1cc(ccn1)C 7d8b966035943797db965a5ad36bcee2 [0,2,0,0,0,0|1,0,1]=4 14147 B13R1.15 CCC(=O)NCc1cc(ccn1)Cl a3046e1c2ac6f164b18d6b4fc8562741 [0,2,0,0,0,0|1,0,1]=4 14148 B13R1.15 CCC(=O)NCc1cccc(n1)Br fca46d35eed2845bf5184fe2572e73d0 [0,2,0,0,0,0|1,0,1]=4 14149 B13R1.15 CCC(=O)NCc1cccc(n1)C af17af9a54c3ee4cecd742f1ea92dc2b [0,2,0,0,0,0|1,0,1]=4 14150 B13R1.15 CCC(=O)NCc1cccc(n1)Cl c8ef111db08ee11e6a537dc575bf30fd [0,2,0,0,0,0|1,0,1]=4 14151 B13R1.15 CCC(=O)NCc1cccc(n1)F 7cdf0142ed7c27505268253beb866502 [0,2,0,0,0,0|1,0,1]=4 14152 B13R1.15 CCC(C)CNc1cc(ccn1)Br 810074bcbfd1df217a8372cc5306c717 [0,2,0,0,0,0|1,0,0]=3 14153 B13R1.15 CCC(C)CNc1cc(ccn1)C 2f9fb028cdd6b6173763903ccd043529 [0,2,0,0,0,0|1,0,0]=3 14154 B13R1.15 CCC(C)CNc1cc(ccn1)Cl aacd4ab1bc48cf04704d1986215210c6 [0,2,0,0,0,0|1,0,0]=3 14155 B13R1.15 CCC(C)CNc1cc(ccn1)F 1a9388e13a823c515094b99232459a35 [0,2,0,0,0,0|1,0,0]=3 14156 B13R1.15 CCC(C)CNc1cc(ccn1)I b9ea5b92635aff45a664d170cccb372e [0,2,0,0,0,0|1,0,0]=3 14157 B13R1.15 CCC(C)CNc1cc(cnn1)Br 96381b1dcde693205f49da40c21e742a [0,2,0,0,0,0|2,0,0]=4 14158 B13R1.15 CCC(C)CNc1cc(cnn1)C 3baf4604c75c343b8779ecf9b1b00fcf [0,2,0,0,0,0|2,0,0]=4 14159 B13R1.15 CCC(C)CNc1cc(cnn1)Cl eaa9002d889448bebf7bea375cf17cb1 [0,2,0,0,0,0|2,0,0]=4 14160 B13R1.15 CCC(C)CNc1cc(ncn1)Br e2352035f3539cd1f7c5e1540ebe4bb1 [0,2,0,0,0,0|2,0,0]=4 14161 B13R1.15 CCC(C)CNc1cc(ncn1)C a324cda37e957fafb4f321e223677640 [0,2,0,0,0,0|2,0,0]=4 14162 B13R1.15 CCC(C)CNc1cc(ncn1)Cl bcc5086d1af9ed071cd784f296deee61 [0,2,0,0,0,0|2,0,0]=4 14163 B13R1.15 CCC(C)CNc1cc(ncn1)F 1b4825ebd6da3d9bebae98b792208d76 [0,2,0,0,0,0|2,0,0]=4 14164 B13R1.15 CCC(C)CNc1cc(ncn1)I 449b47f0c0227f818419757eca6eb889 [0,2,0,0,0,0|2,0,0]=4 14165 B13R1.15 CCC(C)CNc1cc[nH]c(=O)n1 f44344737a9fc593dde5087cb26547c4 [0,2,0,0,0,0|2,0,0]=4 14166 B13R1.15 CCC(C)CNc1cccc(c1)Br c89e0b88334f41232b39525cb5d4a8aa [0,2,0,0,0,0|2,0,0]=4 14167 B13R1.15 CCC(C)CNc1cccc(c1)C da7301efe063882b034a27ce2a212575 [0,2,0,0,0,0|2,0,0]=4 14168 B13R1.15 CCC(C)CNc1cccc(c1)Cl 1d165577b7589833c52809cc52145205 [0,2,0,0,0,0|2,0,0]=4 14169 B13R1.15 CCC(C)CNc1cccc(c1)F cdc9539d3d260b8788e7ddaa69c3c386 [0,2,0,0,0,0|2,0,0]=4 14170 B13R1.15 CCC(C)CNc1cccc(c1)I 683fd95ffc1a673f51503a80dd90a008 [0,2,0,0,0,0|2,0,0]=4 14171 B13R1.15 CCC(C)CNc1cccc(c1)S b04f6d9862ae3f29024d332ee07bad53 [0,2,0,0,0,0|2,0,0]=4 14172 B13R1.15 CCC(C)CNc1cccc(n1)Br 78ae66876fd9f16a4b6e7fd69e2eac6f [0,2,0,0,0,0|1,0,0]=3 14173 B13R1.15 CCC(C)CNc1cccc(n1)C 71cd817ca12fc34e9f8bb37c496fb02a [0,2,0,0,0,0|1,0,0]=3 14174 B13R1.15 CCC(C)CNc1cccc(n1)Cl f08ab50ccc8818247f91972d49d278fe [0,2,0,0,0,0|1,0,0]=3 14175 B13R1.15 CCC(C)CNc1cccc(n1)F cb985b95d680879a6f9f48ee71a940d2 [0,2,0,0,0,0|1,0,0]=3 14176 B13R1.15 CCC(C)CNc1cccc(n1)I 777161d3c8f41adae1e37e05ed9f8e9f [0,2,0,0,0,0|1,0,0]=3 14177 B13R1.15 CCC(C)CNc1ccnc(n1)Br a1f1d1d51e92379a9fd6dc317aa25549 [0,2,0,0,0,0|2,0,0]=4 14178 B13R1.15 CCC(C)CNc1ccnc(n1)C 9a2f77aa1ed9c790073de2664465fd2e [0,2,0,0,0,0|2,0,0]=4 14179 B13R1.15 CCC(C)CNc1ccnc(n1)Cl ae6d7fb5774df197fcc8b922f6dc8cad [0,2,0,0,0,0|2,0,0]=4 14180 B13R1.15 CCC(C)CNc1ccnc(n1)F e6a47db91c9b63a7203cde860c7a332e [0,2,0,0,0,0|2,0,0]=4 14181 B13R1.15 CCC(C)CNc1ccnc(n1)S 90fec81e076c03c179d3a0611060f9f1 [0,2,0,0,0,0|2,0,0]=4 14182 B13R1.15 CCC(C)CNc1cncc(n1)Br 2de6b8f38de5f97c12555238978a56ae [0,2,0,0,0,0|2,0,0]=4 14183 B13R1.15 CCC(C)CNc1cncc(n1)C 3d95cbcee42bd6a8afd4ba2e549ae3c1 [0,2,0,0,0,0|2,0,0]=4 14184 B13R1.15 CCC(C)CNc1cncc(n1)Cl 20ece74dd9d97fdbdea2edeb67304895 [0,2,0,0,0,0|2,0,0]=4 14185 B13R1.15 CCC(C)CNc1cncc(n1)F 7891a2388ed5844d782de55edb6c4870 [0,2,0,0,0,0|2,0,0]=4 14186 B13R1.15 CCC(C)CNc1nccc(=O)[nH]1 b53594a172f132a38ae3f01154fb204d [0,2,0,0,0,0|2,0,0]=4 14187 B13R1.15 CCC(C)CNc1nccc(n1)Br 4553bbaf54cce5fa38831ffbce334bcb [0,2,0,0,0,0|2,0,0]=4 14188 B13R1.15 CCC(C)CNc1nccc(n1)C 34176b1c0935f9726a7c8ed0fec32b27 [0,2,0,0,0,0|2,0,0]=4 14189 B13R1.15 CCC(C)CNc1nccc(n1)Cl bbdd1b982ccfcb09540c53acf817b4d0 [0,2,0,0,0,0|2,0,0]=4 14190 B13R1.15 CCC(C)CNc1nccc(n1)F 1567c547092990cf2149a8dfc51686a7 [0,2,0,0,0,0|2,0,0]=4 14191 B13R1.15 CCC(C)CNc1nccc(n1)I c187d875f47d6d14e894f79ac680f00a [0,2,0,0,0,0|2,0,0]=4 14192 B13R1.15 CCC(C)COc1cc(ccn1)Br a442282c3f27212e3e714e891337b4d1 [0,2,0,0,0,0|1,0,0]=3 14193 B13R1.15 CCC(C)COc1cc(ccn1)C ee716ca779ee25c5a160c252813e27c8 [0,2,0,0,0,0|1,0,0]=3 14194 B13R1.15 CCC(C)COc1cc(ccn1)Cl bf54197367c862356b20544d46991181 [0,2,0,0,0,0|1,0,0]=3 14195 B13R1.15 CCC(C)COc1cc(ccn1)F c3d346ad7437c134cd329b3f97ba9137 [0,2,0,0,0,0|1,0,0]=3 14196 B13R1.15 CCC(C)COc1cc(ncn1)Br 9538739eabe3f4a25a0964bc533971e4 [0,2,0,0,0,0|2,0,0]=4 14197 B13R1.15 CCC(C)COc1cc(ncn1)C 27f431fb86575267d71f03c5b715f148 [0,2,0,0,0,0|2,0,0]=4 14198 B13R1.15 CCC(C)COc1cc(ncn1)Cl 7675a7992738d6052b0b9a2199cd2170 [0,2,0,0,0,0|2,0,0]=4 14199 B13R1.15 CCC(C)COc1cccc(=O)[nH]1 591c4dcb1c5621503227795330f1ae45 [0,2,0,0,0,0|1,0,1]=4 14200 B13R1.15 CCC(C)COc1cccc(c1)Br fd3a871c19f35786324bfad7bf56cebe [0,2,0,0,0,0|2,0,0]=4 14201 B13R1.15 CCC(C)COc1cccc(c1)C e5cd5bf811b2b5fd04ef186ebbf9c492 [0,2,0,0,0,0|2,0,0]=4 14202 B13R1.15 CCC(C)COc1cccc(c1)Cl dd09f3e6efa2bb1cbca666bd792b5577 [0,2,0,0,0,0|2,0,0]=4 14203 B13R1.15 CCC(C)COc1cccc(c1)F 9c8cd99bcd41c34e8fe433d27d8a3891 [0,2,0,0,0,0|2,0,0]=4 14204 B13R1.15 CCC(C)COc1cccc(c1)I b6d70c33f760e1e54dbf3a6ee6a2b28e [0,2,0,0,0,0|2,0,0]=4 14205 B13R1.15 CCC(C)COc1cccc(c1)S 4fc78cc3d67b7b228fb3835228ace3b9 [0,2,0,0,0,0|2,0,0]=4 14206 B13R1.15 CCC(C)COc1cccc(n1)Br 6b9ee00d2b30c752a14a9602182436ec [0,2,0,0,0,0|1,0,0]=3 14207 B13R1.15 CCC(C)COc1cccc(n1)C 804c9226e028618ff22a978c48b1f80b [0,2,0,0,0,0|1,0,0]=3 14208 B13R1.15 CCC(C)COc1cccc(n1)F cfb57b5a033c2704180cd41b9d97de29 [0,2,0,0,0,0|1,0,0]=3 14209 B13R1.15 CCC(C)COc1ccnc(n1)C 149e3d6cd4583ec4da8e779fbaa90fa0 [0,2,0,0,0,0|2,0,0]=4 14210 B13R1.15 CCC(C)COc1ccnc(n1)Cl fcbb4f35721aec8be652ee2c5a055cd2 [0,2,0,0,0,0|2,0,0]=4 14211 B13R1.15 CCC(C)COc1cncc(n1)Br a162e78d8abb459379cc2fb7080c57c1 [0,2,0,0,0,0|2,0,0]=4 14212 B13R1.15 CCC(C)COc1cncc(n1)C f474a20cb6f63d3f387e2ccb84ee4631 [0,2,0,0,0,0|2,0,0]=4 14213 B13R1.15 CCC(C)COc1cncc(n1)Cl bd7a85a60dc362c4167f0a36b7d3ca75 [0,2,0,0,0,0|2,0,0]=4 14214 B13R1.15 CCC(C)COc1nccc(n1)Cl c7b5adbea08d759b2ef3d6019744dafe [0,2,0,0,0,0|2,0,0]=4 14215 B13R1.15 CCC(C)COc1nccc(n1)S 493c86480efab7011b1fffdcd47be624 [0,2,0,0,0,0|2,0,0]=4 14216 B13R1.15 CCC(C)NCc1cc(ccn1)Br ad893fbfabae3e64b373c56900a4ef66 [0,2,0,0,0,0|1,0,0]=3 14217 B13R1.15 CCC(C)NCc1cc(ccn1)C a9267ef3a19ee85d33fe13fd7e154dfb [0,2,0,0,0,0|1,0,0]=3 14218 B13R1.15 CCC(C)NCc1cc(ccn1)Cl 876eee17d62f38ca68c04b69b42233a5 [0,2,0,0,0,0|1,0,0]=3 14219 B13R1.15 CCC(C)NCc1cc[nH]c(=O)n1 5804375ce937e3d627551be6db10eef5 [0,2,0,0,0,0|2,0,0]=4 14220 B13R1.15 CCC(C)NCc1cccc(c1)Br b7c461b55ca6b583505584280087d4b7 [0,2,0,0,0,0|2,0,0]=4 14221 B13R1.15 CCC(C)NCc1cccc(c1)C ca70dcadd5661a8b1827d668f5a52e30 [0,2,0,0,0,0|2,0,0]=4 14222 B13R1.15 CCC(C)NCc1cccc(c1)Cl a5434aeb7e9c49b4844731e8f0a95be7 [0,2,0,0,0,0|2,0,0]=4 14223 B13R1.15 CCC(C)NCc1cccc(c1)F 7b025b58be34b0656490f345b605ceb0 [0,2,0,0,0,0|2,0,0]=4 14224 B13R1.15 CCC(C)NCc1cccc(c1)I 3daff5ce7c61dfce5266b93a173021e6 [0,2,0,0,0,0|2,0,0]=4 14225 B13R1.15 CCC(C)NCc1cccc(n1)Br 34c2390dd83ccff33977854174ad6fac [0,2,0,0,0,0|1,0,0]=3 14226 B13R1.15 CCC(C)NCc1cccc(n1)C cb04670d1c38b71a39bbab6a3d8dc8f8 [0,2,0,0,0,0|1,0,0]=3 14227 B13R1.15 CCC(C)NCc1cccc(n1)Cl 486d3181239746c52088c518dfc71833 [0,2,0,0,0,0|1,0,0]=3 14228 B13R1.15 CCC(C)NCc1cccc(n1)F b5798f9dbb0430cecda8eeef243d05cd [0,2,0,0,0,0|1,0,0]=3 14229 B13R1.15 CCC(C)NCc1ccnc(n1)C f68a002ed94185202b57d200ea9742c5 [0,2,0,0,0,0|2,0,0]=4 14230 B13R1.15 CCC(C)NCc1ccnc(n1)Cl 4c63428032b3939dd1d1c2ea4ec93495 [0,2,0,0,0,0|2,0,0]=4 14231 B13R1.15 CCC(C)NCc1cncc(n1)Cl 16a63e1258e2e63abe9006c20803e8f7 [0,2,0,0,0,0|2,0,0]=4 14232 B13R1.15 CCC(C)NCc1nccc(n1)C 9dcfebb2b9563102450eb619258ab18a [0,2,0,0,0,0|2,0,0]=4 14233 B13R1.15 CCC(C)NCc1nccc(n1)Cl 4ba0cc771b6adfea8134605d4ff100c5 [0,2,0,0,0,0|2,0,0]=4 14234 B13R1.15 CCC(C)OCc1cc(ccn1)Br 2e3f598640976d0c4c1cec6eb466008c [0,2,0,0,0,0|1,0,0]=3 14235 B13R1.15 CCC(C)OCc1cc(ccn1)C 0bfb9306c2e2fdac038294fe709e36d0 [0,2,0,0,0,0|1,0,0]=3 14236 B13R1.15 CCC(C)OCc1cc(ccn1)Cl 638b00187b44b7299a104169822180e9 [0,2,0,0,0,0|1,0,0]=3 14237 B13R1.15 CCC(C)OCc1cc(ccn1)F ec77e6a2ca616d15ad2f7a059cee6740 [0,2,0,0,0,0|1,0,0]=3 14238 B13R1.15 CCC(C)OCc1cc(ccn1)I dd4936176f353b28786975b6cc868a79 [0,2,0,0,0,0|1,0,0]=3 14239 B13R1.15 CCC(C)OCc1cc(cnn1)C 02a45452ba2f8a41a3f5d8d37cecb7e5 [0,2,0,0,0,0|2,0,0]=4 14240 B13R1.15 CCC(C)OCc1cc(ncn1)C 61870c310fe03a0b193f2c1e9dbd53e0 [0,2,0,0,0,0|2,0,0]=4 14241 B13R1.15 CCC(C)OCc1cc(ncn1)Cl 032c212f37a9afb87ccf212dde9a519f [0,2,0,0,0,0|2,0,0]=4 14242 B13R1.15 CCC(C)OCc1cccc(c1)Br cbd5ed07998e8fd95653091cfb0c0257 [0,2,0,0,0,0|2,0,0]=4 14243 B13R1.15 CCC(C)OCc1cccc(c1)C 251174eb7c4f92c0a92bb1803dbbb77c [0,2,0,0,0,0|2,0,0]=4 14244 B13R1.15 CCC(C)OCc1cccc(c1)Cl 2fd7c987c77cebcb64c63a0ab783a72a [0,2,0,0,0,0|2,0,0]=4 14245 B13R1.15 CCC(C)OCc1cccc(c1)F 110d551a8a6dbe449e858b7fabab179f [0,2,0,0,0,0|2,0,0]=4 14246 B13R1.15 CCC(C)OCc1cccc(c1)I bacc020725e8248c3690baca4b231d8d [0,2,0,0,0,0|2,0,0]=4 14247 B13R1.15 CCC(C)OCc1cccc(n1)Br 50f966eaab338383514bb7b52339ee4b [0,2,0,0,0,0|1,0,0]=3 14248 B13R1.15 CCC(C)OCc1cccc(n1)C 9451bcca5d02c8164cbe70178579cc0c [0,2,0,0,0,0|1,0,0]=3 14249 B13R1.15 CCC(C)OCc1cccc(n1)Cl 1b097c077afa097d2f6350d154bdf80a [0,2,0,0,0,0|1,0,0]=3 14250 B13R1.15 CCC(C)OCc1cccc(n1)F 8273fca781cf6160b0dbeac17cbf85c4 [0,2,0,0,0,0|1,0,0]=3 14251 B13R1.15 CCC(C)OCc1cccc(n1)I 6b4d13eff8b2d6658be81722d728620e [0,2,0,0,0,0|1,0,0]=3 14252 B13R1.15 CCC(C)OCc1ccnc(n1)C 8994ccc9c262167ce8b3cee62de425ac [0,2,0,0,0,0|2,0,0]=4 14253 B13R1.15 CCC(C)OCc1ccnc(n1)Cl 01a549533d38b42926879cb806c33731 [0,2,0,0,0,0|2,0,0]=4 14254 B13R1.15 CCC(C)OCc1cncc(n1)Cl 7dc422af3f7e498f2a57d0e9d532ad85 [0,2,0,0,0,0|2,0,0]=4 14255 B13R1.15 CCC(C)OCc1nccc(n1)C 8571d0ce042bc0a9136a98af09a94624 [0,2,0,0,0,0|2,0,0]=4 14256 B13R1.15 CCC(C)OCc1nccc(n1)Cl 09d283db3d6c6900aea2a6b240676089 [0,2,0,0,0,0|2,0,0]=4 14257 B13R1.15 CCC(O)CNc1cc(ccn1)Br c080b41fa2b90b18869641938991a458 [0,2,0,0,0,0|1,0,0]=3 14258 B13R1.15 CCC(O)CNc1cc(ccn1)C 5cc3048103a7fd316e2b2201fc315966 [0,2,0,0,0,0|1,0,0]=3 14259 B13R1.15 CCC(O)CNc1cc(ccn1)Cl e3426153894a6af6fc8704def0364ce8 [0,2,0,0,0,0|1,0,0]=3 14260 B13R1.15 CCC(O)CNc1cc(ccn1)F 7ee6116a455ffa42300465a2b937c326 [0,2,0,0,0,0|1,0,0]=3 14261 B13R1.15 CCC(O)CNc1cc(ccn1)I 478993bf29d7dd15095f43257e590db4 [0,2,0,0,0,0|1,0,0]=3 14262 B13R1.15 CCC(O)CNc1cc(cnn1)Br e06d83a4adab381b8565f213d308ff63 [0,2,0,0,0,0|2,0,0]=4 14263 B13R1.15 CCC(O)CNc1cc(cnn1)C 42a357f7eaff956112eb7bd93e0bc767 [0,2,0,0,0,0|2,0,0]=4 14264 B13R1.15 CCC(O)CNc1cc(cnn1)Cl 7ff7ed95a9e2817dd7eafa6a375d3698 [0,2,0,0,0,0|2,0,0]=4 14265 B13R1.15 CCC(O)CNc1cc(ncn1)Br 17015973832334195a8c73bbf295bfb9 [0,2,0,0,0,0|2,0,0]=4 14266 B13R1.15 CCC(O)CNc1cc(ncn1)C 2ae79be8c294a7a2b93660bf212587f2 [0,2,0,0,0,0|2,0,0]=4 14267 B13R1.15 CCC(O)CNc1cc(ncn1)Cl 50e16af4d5ca4b7df3f8a4eaf63a8a2f [0,2,0,0,0,0|2,0,0]=4 14268 B13R1.15 CCC(O)CNc1cc(ncn1)F 6dd63db5a245378f554d01273f2cddb8 [0,2,0,0,0,0|2,0,0]=4 14269 B13R1.15 CCC(O)CNc1cc(ncn1)I f2f196d0cfde5b956a84aec369d469dc [0,2,0,0,0,0|2,0,0]=4 14270 B13R1.15 CCC(O)CNc1cc[nH]c(=O)n1 6b3be1adfd5cb929b95cbaa4ed2acb5c [0,2,0,0,0,0|2,0,0]=4 14271 B13R1.15 CCC(O)CNc1cccc(c1)Br 62f5e2ed660afee868a1fb3a455e3586 [0,2,0,0,0,0|2,0,0]=4 14272 B13R1.15 CCC(O)CNc1cccc(c1)C 24103e0914c9e1eede68e6c8962eb804 [0,2,0,0,0,0|2,0,0]=4 14273 B13R1.15 CCC(O)CNc1cccc(c1)Cl a28a2d0533c65f3add3e5ad3786f5bcf [0,2,0,0,0,0|2,0,0]=4 14274 B13R1.15 CCC(O)CNc1cccc(c1)F efd9f1d32112e700ddf5b5abb47d06d5 [0,2,0,0,0,0|2,0,0]=4 14275 B13R1.15 CCC(O)CNc1cccc(c1)I 808565da50f2b37374aeca3f44722d51 [0,2,0,0,0,0|2,0,0]=4 14276 B13R1.15 CCC(O)CNc1cccc(c1)S ba536dc4bf63bfffefe32225b3071338 [0,2,0,0,0,0|2,0,0]=4 14277 B13R1.15 CCC(O)CNc1cccc(n1)Br 8542185b7ac42f2736dba7bd87b15569 [0,2,0,0,0,0|1,0,0]=3 14278 B13R1.15 CCC(O)CNc1cccc(n1)C ed9c42ba9ce783c4c6132fcef7acf588 [0,2,0,0,0,0|1,0,0]=3 14279 B13R1.15 CCC(O)CNc1cccc(n1)Cl 1c5d8851ee57a92f624ea01d35013032 [0,2,0,0,0,0|1,0,0]=3 14280 B13R1.15 CCC(O)CNc1cccc(n1)F 29e161f5116ccb63404bca19f342d010 [0,2,0,0,0,0|1,0,0]=3 14281 B13R1.15 CCC(O)CNc1cccc(n1)I f71fdae7440a12adceffd820e7e49caf [0,2,0,0,0,0|1,0,0]=3 14282 B13R1.15 CCC(O)CNc1ccnc(n1)Br a381cfc44abdbc7bfef81e582d8da0bd [0,2,0,0,0,0|2,0,0]=4 14283 B13R1.15 CCC(O)CNc1ccnc(n1)C 5bb2a406ea650b12bbfab62ffb40c8d9 [0,2,0,0,0,0|2,0,0]=4 14284 B13R1.15 CCC(O)CNc1ccnc(n1)Cl bb2ff704ff192523f475775b631beb36 [0,2,0,0,0,0|2,0,0]=4 14285 B13R1.15 CCC(O)CNc1ccnc(n1)F 040d20d3d1917ac4877889ebe475f7c1 [0,2,0,0,0,0|2,0,0]=4 14286 B13R1.15 CCC(O)CNc1ccnc(n1)S e749900c672c918f3420465189170e8b [0,2,0,0,0,0|2,0,0]=4 14287 B13R1.15 CCC(O)CNc1cncc(n1)Br a2555085e3149a2be76673c467a360ee [0,2,0,0,0,0|2,0,0]=4 14288 B13R1.15 CCC(O)CNc1cncc(n1)C 240dea7a20a33c98a449b55aae9e9509 [0,2,0,0,0,0|2,0,0]=4 14289 B13R1.15 CCC(O)CNc1cncc(n1)Cl 560f7d39b00c5f6f5e267e529490121d [0,2,0,0,0,0|2,0,0]=4 14290 B13R1.15 CCC(O)CNc1cncc(n1)F 79cfe6ef334f5ac2c5a415737e391119 [0,2,0,0,0,0|2,0,0]=4 14291 B13R1.15 CCC(O)CNc1nccc(=O)[nH]1 0736b4b0af40ea51cd2510387fb275a8 [0,2,0,0,0,0|2,0,0]=4 14292 B13R1.15 CCC(O)CNc1nccc(n1)Br e26a88f4dcbd69ee7b691eec3fe79228 [0,2,0,0,0,0|2,0,0]=4 14293 B13R1.15 CCC(O)CNc1nccc(n1)C 45223556445b22d183c16aaba343e25c [0,2,0,0,0,0|2,0,0]=4 14294 B13R1.15 CCC(O)CNc1nccc(n1)Cl 633d02b811c0f0dc1397ae3b6f6d3102 [0,2,0,0,0,0|2,0,0]=4 14295 B13R1.15 CCC(O)CNc1nccc(n1)F 9a42beb0b300dfa74bcb60a1953719d7 [0,2,0,0,0,0|2,0,0]=4 14296 B13R1.15 CCC(O)CNc1nccc(n1)I ed36cae338269566ea21c2385a654c14 [0,2,0,0,0,0|2,0,0]=4 14297 B13R1.15 CCC(O)CNc1nccc(n1)S 4b395d25d6ce9ddc9fd713ffb9ce1310 [0,2,0,0,0,0|2,0,0]=4 14298 B13R1.15 CCN(C)CCc1cccc(c1)Br 306252103fd3f17e538aea4452e72c82 [0,2,0,0,0,0|2,0,0]=4 14299 B13R1.15 CCN(C)CCc1cccc(c1)C 7dbd9be2f700a394aa296b727c64fc12 [0,2,0,0,0,0|2,0,0]=4 14300 B13R1.15 CCN(C)CCc1cccc(c1)Cl 7cc8eba487c78db449fa325079add7d6 [0,2,0,0,0,0|2,0,0]=4 14301 B13R1.15 CCN(C)CCc1cccc(c1)F 094f05b40559d58f88ba074870b9f125 [0,2,0,0,0,0|2,0,0]=4 14302 B13R1.15 CCN(C)CCc1cncc(n1)Cl f37962348d3fca789d645414e4116b88 [0,2,0,0,0,0|2,0,0]=4 14303 B13R1.15 CC[C@@H](C)CNc1cc(ccn1)Br f2cc761fee173430a4c9f1971c581e9d [0,2,0,0,0,0|1,0,0]=3 14304 B13R1.15 CC[C@@H](C)CNc1cc(ccn1)C 3dfc0da754f4787623058e0dd813f87e [0,2,0,0,0,0|1,0,0]=3 14305 B13R1.15 CC[C@@H](C)CNc1cc(ccn1)Cl b1737e3950fb92250c123da9b417349d [0,2,0,0,0,0|1,0,0]=3 14306 B13R1.15 CC[C@@H](C)CNc1cc(ccn1)F 9499baab8f1a7d4f09d589ec165be2fa [0,2,0,0,0,0|1,0,0]=3 14307 B13R1.15 CC[C@@H](C)CNc1cc(ccn1)I 38c19201a40ff20b7328b571e560fd1f [0,2,0,0,0,0|1,0,0]=3 14308 B13R1.15 CC[C@@H](C)CNc1cc(cnn1)Br fae0bac7e11c2626cbee4ae0c299c671 [0,2,0,0,0,0|2,0,0]=4 14309 B13R1.15 CC[C@@H](C)CNc1cc(cnn1)C c8104bd42facc464ade5243c3ca4201a [0,2,0,0,0,0|2,0,0]=4 14310 B13R1.15 CC[C@@H](C)CNc1cc(cnn1)Cl 46fe1c1e981fa0a0197f69136f06a699 [0,2,0,0,0,0|2,0,0]=4 14311 B13R1.15 CC[C@@H](C)CNc1cc(ncn1)Br e458214aa150155b9e945fdc3f775892 [0,2,0,0,0,0|2,0,0]=4 14312 B13R1.15 CC[C@@H](C)CNc1cc(ncn1)C 7bf11a88fca45034cd250515bfc3037e [0,2,0,0,0,0|2,0,0]=4 14313 B13R1.15 CC[C@@H](C)CNc1cc(ncn1)Cl 06755135688e19c304c7521258937f0f [0,2,0,0,0,0|2,0,0]=4 14314 B13R1.15 CC[C@@H](C)CNc1cc(ncn1)F 6f25844f241d9f80a758836b16b8a7e2 [0,2,0,0,0,0|2,0,0]=4 14315 B13R1.15 CC[C@@H](C)CNc1cc(ncn1)I 6abab8f7eccd3362c39c46efe923c797 [0,2,0,0,0,0|2,0,0]=4 14316 B13R1.15 CC[C@@H](C)CNc1cc[nH]c(=O)n1 85a50611e291eb115351f6275658e1f5 [0,2,0,0,0,0|2,0,0]=4 14317 B13R1.15 CC[C@@H](C)CNc1cccc(c1)Br 228d3d0ccf312b07be9b3e21cef37f03 [0,2,0,0,0,0|2,0,0]=4 14318 B13R1.15 CC[C@@H](C)CNc1cccc(c1)C c0723b2e3985481e7d9b4c9b5c725550 [0,2,0,0,0,0|2,0,0]=4 14319 B13R1.15 CC[C@@H](C)CNc1cccc(c1)Cl 9088c2fba771afde59a62212a18a0397 [0,2,0,0,0,0|2,0,0]=4 14320 B13R1.15 CC[C@@H](C)CNc1cccc(c1)F 840b1f388f2d9fd3da459088c5aba8c5 [0,2,0,0,0,0|2,0,0]=4 14321 B13R1.15 CC[C@@H](C)CNc1cccc(c1)I 8d054f81697b272a1ac9539e6b00e408 [0,2,0,0,0,0|2,0,0]=4 14322 B13R1.15 CC[C@@H](C)CNc1cccc(c1)S 365e65ab685d9a923fa648185ebc2831 [0,2,0,0,0,0|2,0,0]=4 14323 B13R1.15 CC[C@@H](C)CNc1cccc(n1)Br 0dd96533c6835df9f22b5eae09f4e4c1 [0,2,0,0,0,0|1,0,0]=3 14324 B13R1.15 CC[C@@H](C)CNc1cccc(n1)C 8688433eab036be0b67bb74816877342 [0,2,0,0,0,0|1,0,0]=3 14325 B13R1.15 CC[C@@H](C)CNc1cccc(n1)Cl 5602639103cd3ab08f5ad05cfef88214 [0,2,0,0,0,0|1,0,0]=3 14326 B13R1.15 CC[C@@H](C)CNc1cccc(n1)F c7b3624e06de25c3b03239c7191a8cb6 [0,2,0,0,0,0|1,0,0]=3 14327 B13R1.15 CC[C@@H](C)CNc1cccc(n1)I 686b92030fd3d17b871061e4ea1c3392 [0,2,0,0,0,0|1,0,0]=3 14328 B13R1.15 CC[C@@H](C)CNc1ccnc(n1)Br 3c58a75a6f7c2493582a019c5bee8c20 [0,2,0,0,0,0|2,0,0]=4 14329 B13R1.15 CC[C@@H](C)CNc1ccnc(n1)C 9bf6b7bcf0bf8d481de688a08adcf7ab [0,2,0,0,0,0|2,0,0]=4 14330 B13R1.15 CC[C@@H](C)CNc1ccnc(n1)Cl a3865e8db28fa402d74498609f0defa1 [0,2,0,0,0,0|2,0,0]=4 14331 B13R1.15 CC[C@@H](C)CNc1ccnc(n1)F df3abc28b2d2705761a37c5e468591b3 [0,2,0,0,0,0|2,0,0]=4 14332 B13R1.15 CC[C@@H](C)CNc1ccnc(n1)S 235dcd0119bb07837e3c5e500373a22a [0,2,0,0,0,0|2,0,0]=4 14333 B13R1.15 CC[C@@H](C)CNc1cncc(n1)Br f589e6bf8942b917d3a77944ddbed7ea [0,2,0,0,0,0|2,0,0]=4 14334 B13R1.15 CC[C@@H](C)CNc1cncc(n1)C e58a762e2ea4555f79efe67c517d253b [0,2,0,0,0,0|2,0,0]=4 14335 B13R1.15 CC[C@@H](C)CNc1cncc(n1)Cl 26de73d755a1533558eae9b8fdf41864 [0,2,0,0,0,0|2,0,0]=4 14336 B13R1.15 CC[C@@H](C)CNc1cncc(n1)F af02767f67df3cdfa068fda80e9e138a [0,2,0,0,0,0|2,0,0]=4 14337 B13R1.15 CC[C@@H](C)CNc1nccc(=O)[nH]1 56ed919c8daa0462e81cc14c362d89a9 [0,2,0,0,0,0|2,0,0]=4 14338 B13R1.15 CC[C@@H](C)CNc1nccc(n1)Br bec5456754858429888468cd8b763ecd [0,2,0,0,0,0|2,0,0]=4 14339 B13R1.15 CC[C@@H](C)CNc1nccc(n1)C cf709544342a572452be69c46f0d84e1 [0,2,0,0,0,0|2,0,0]=4 14340 B13R1.15 CC[C@@H](C)CNc1nccc(n1)Cl d9c3e18e774710eb6f128ea2883aff8c [0,2,0,0,0,0|2,0,0]=4 14341 B13R1.15 CC[C@@H](C)CNc1nccc(n1)F 5d3d959367484c02611f0d4d22d8dda8 [0,2,0,0,0,0|2,0,0]=4 14342 B13R1.15 CC[C@@H](C)CNc1nccc(n1)I 9901641175a8627bd913537ba4034268 [0,2,0,0,0,0|2,0,0]=4 14343 B13R1.15 CC[C@@H](C)COc1cc(ccn1)Br faf2ad602cb752e8a93fb51cc4cd5fb7 [0,2,0,0,0,0|1,0,0]=3 14344 B13R1.15 CC[C@@H](C)COc1cc(ccn1)C ee7ecd817d7af17372a654a010c20453 [0,2,0,0,0,0|1,0,0]=3 14345 B13R1.15 CC[C@@H](C)COc1cc(ccn1)Cl 11487be91fee2eb9aa535931abb12336 [0,2,0,0,0,0|1,0,0]=3 14346 B13R1.15 CC[C@@H](C)COc1cc(ccn1)F 5f9af4a75c45e94519ac5cc9c039be6a [0,2,0,0,0,0|1,0,0]=3 14347 B13R1.15 CC[C@@H](C)COc1cc(ncn1)Br c6fd70c39b2533755d81443cf75d7259 [0,2,0,0,0,0|2,0,0]=4 14348 B13R1.15 CC[C@@H](C)COc1cc(ncn1)C 4e5a0731ed71cb6e523d00e3fcf68758 [0,2,0,0,0,0|2,0,0]=4 14349 B13R1.15 CC[C@@H](C)COc1cc(ncn1)Cl 55fe6a52743b554a073f7b5f73cb9077 [0,2,0,0,0,0|2,0,0]=4 14350 B13R1.15 CC[C@@H](C)COc1cccc(c1)Br a776385868998a7c426ee9a956dda7f0 [0,2,0,0,0,0|2,0,0]=4 14351 B13R1.15 CC[C@@H](C)COc1cccc(c1)C 1d6cfb88b7c54f15ef2f072862ea0bd1 [0,2,0,0,0,0|2,0,0]=4 14352 B13R1.15 CC[C@@H](C)COc1cccc(c1)Cl 7978dc01d6ff78af1c8aa5828af1f550 [0,2,0,0,0,0|2,0,0]=4 14353 B13R1.15 CC[C@@H](C)COc1cccc(c1)F adbddbeed9c184906e9737379d5c6dd9 [0,2,0,0,0,0|2,0,0]=4 14354 B13R1.15 CC[C@@H](C)COc1cccc(c1)I 9f532a32078671fd2f17802ad18baceb [0,2,0,0,0,0|2,0,0]=4 14355 B13R1.15 CC[C@@H](C)COc1cccc(c1)S 8a17a3189123b4b75a0fda568fc4afeb [0,2,0,0,0,0|2,0,0]=4 14356 B13R1.15 CC[C@@H](C)COc1cccc(n1)Br 9c77d1311af5460f8149b4b3c79ac716 [0,2,0,0,0,0|1,0,0]=3 14357 B13R1.15 CC[C@@H](C)COc1cccc(n1)C 4803346d86ec097e9373d8f820a916ad [0,2,0,0,0,0|1,0,0]=3 14358 B13R1.15 CC[C@@H](C)COc1cccc(n1)F 9dbdec3005f5c8aa5f3343223235bf7a [0,2,0,0,0,0|1,0,0]=3 14359 B13R1.15 CC[C@@H](C)COc1ccnc(n1)C b19960fb26ed2230ac8e9b404bd00424 [0,2,0,0,0,0|2,0,0]=4 14360 B13R1.15 CC[C@@H](C)COc1ccnc(n1)Cl de8068dcfcb99ffbd37916551ebbacdf [0,2,0,0,0,0|2,0,0]=4 14361 B13R1.15 CC[C@@H](C)COc1cncc(n1)Br 08380c3c562fd0b32cb0be212c8c79fe [0,2,0,0,0,0|2,0,0]=4 14362 B13R1.15 CC[C@@H](C)COc1cncc(n1)Cl a7f2f67fd1b0a59fe951f0fa77dae22f [0,2,0,0,0,0|2,0,0]=4 14363 B13R1.15 CC[C@@H](C)COc1nccc(n1)Cl f65f670d64ed63d0b8c32edbe99e0e23 [0,2,0,0,0,0|2,0,0]=4 14364 B13R1.15 CC[C@@H](C)NCc1cc(ccn1)Br 25e937f66c9ea0c2be609c59c803e182 [0,2,0,0,0,0|1,0,0]=3 14365 B13R1.15 CC[C@@H](C)NCc1cc(ccn1)Cl e8cf26c90e6210fa1b68ccaf41b699ac [0,2,0,0,0,0|1,0,0]=3 14366 B13R1.15 CC[C@@H](C)NCc1cccc(c1)Br 8a4f7f5082da4a618683c517a00cd26d [0,2,0,0,0,0|2,0,0]=4 14367 B13R1.15 CC[C@@H](C)NCc1cccc(c1)C 39e297881f7f2803d8ae3320edd7b8c4 [0,2,0,0,0,0|2,0,0]=4 14368 B13R1.15 CC[C@@H](C)NCc1cccc(c1)Cl e95ec56d3c2bf5cd3af14c871ba12ccb [0,2,0,0,0,0|2,0,0]=4 14369 B13R1.15 CC[C@@H](C)NCc1cccc(c1)F 80630c0ae8814d6c1fcbe0ae8bf657d3 [0,2,0,0,0,0|2,0,0]=4 14370 B13R1.15 CC[C@@H](C)NCc1cccc(c1)I a0d83ac75368c1d471ef3d39276226fc [0,2,0,0,0,0|2,0,0]=4 14371 B13R1.15 CC[C@@H](C)NCc1cccc(n1)Br a350015713bd86e0c06533c10a6f5cea [0,2,0,0,0,0|1,0,0]=3 14372 B13R1.15 CC[C@@H](C)NCc1cccc(n1)C a95c0b804e641da8d87a2fa52bfff331 [0,2,0,0,0,0|1,0,0]=3 14373 B13R1.15 CC[C@@H](C)NCc1cccc(n1)Cl cba9561379d15deb227584a5a41d7514 [0,2,0,0,0,0|1,0,0]=3 14374 B13R1.15 CC[C@@H](C)NCc1cccc(n1)F 509a064b5bb01a2d7d99531f2a416899 [0,2,0,0,0,0|1,0,0]=3 14375 B13R1.15 CC[C@@H](C)NCc1ccnc(n1)Cl a83e23adcf07687a611a6afd1ea15a86 [0,2,0,0,0,0|2,0,0]=4 14376 B13R1.15 CC[C@@H](C)NCc1nccc(n1)C 3a808a43e612275475bde51d60316aa1 [0,2,0,0,0,0|2,0,0]=4 14377 B13R1.15 CC[C@@H](C)NCc1nccc(n1)Cl 6fc665ec6be78605a61c33db6d7f7fc6 [0,2,0,0,0,0|2,0,0]=4 14378 B13R1.15 CC[C@@H](C)OCc1cc(ccn1)Br 3baad78fa7af0828140f5c137dfe028a [0,2,0,0,0,0|1,0,0]=3 14379 B13R1.15 CC[C@@H](C)OCc1cc(ccn1)Cl 0f44550298f905d6ad43196e3b3de9e2 [0,2,0,0,0,0|1,0,0]=3 14380 B13R1.15 CC[C@@H](C)OCc1cccc(c1)Br 53ed52da0a416746b98b97e75865ee7b [0,2,0,0,0,0|2,0,0]=4 14381 B13R1.15 CC[C@@H](C)OCc1cccc(c1)C 00f1b53ba23510fc236a810eb1b30f36 [0,2,0,0,0,0|2,0,0]=4 14382 B13R1.15 CC[C@@H](C)OCc1cccc(c1)Cl d82fd3e2127a9696ea0ff3e171c52d76 [0,2,0,0,0,0|2,0,0]=4 14383 B13R1.15 CC[C@@H](C)OCc1cccc(c1)F d52ee6f4ed2fe56a86fbcf83e1c71875 [0,2,0,0,0,0|2,0,0]=4 14384 B13R1.15 CC[C@@H](C)OCc1cccc(c1)I 1db6b2fd6befa3c9acb56ef1268a8084 [0,2,0,0,0,0|2,0,0]=4 14385 B13R1.15 CC[C@@H](C)OCc1cccc(n1)Br ce52bbd88a49fd18455e260ffa189d00 [0,2,0,0,0,0|1,0,0]=3 14386 B13R1.15 CC[C@@H](C)OCc1cccc(n1)C 0be69b20279cd60b5e1cab8af65ed5cb [0,2,0,0,0,0|1,0,0]=3 14387 B13R1.15 CC[C@@H](C)OCc1cccc(n1)Cl 6cbd6e26bb3e60c2e616e455b2eee3c6 [0,2,0,0,0,0|1,0,0]=3 14388 B13R1.15 CC[C@@H](C)OCc1cccc(n1)F c8a3dd57e59f3df6320b2ff04d78eae6 [0,2,0,0,0,0|1,0,0]=3 14389 B13R1.15 CC[C@@H](C)OCc1ccnc(n1)Cl 4dce3a3b600696b412d5eaea00fbe591 [0,2,0,0,0,0|2,0,0]=4 14390 B13R1.15 CC[C@@H](C)OCc1nccc(n1)C 215c215cdccba9ef24a41c6a41640967 [0,2,0,0,0,0|2,0,0]=4 14391 B13R1.15 CC[C@@H](C)OCc1nccc(n1)Cl a791b8c303ac53043b2aac466b91baeb [0,2,0,0,0,0|2,0,0]=4 14392 B13R1.15 CC[C@@H](O)CNc1cccc(c1)C 721e834cf76f597dedf65d1ecb40e006 [0,2,0,0,0,0|2,0,0]=4 14393 B13R1.15 CC[C@H](C)CNc1cc(ccn1)Br fdf640cb4fb272a15b53bc3227869ca3 [0,2,0,0,0,0|1,0,0]=3 14394 B13R1.15 CC[C@H](C)CNc1cc(ccn1)C ef74adcffc3e2d12f153c8bb61ef6417 [0,2,0,0,0,0|1,0,0]=3 14395 B13R1.15 CC[C@H](C)CNc1cc(ccn1)Cl 9634275d466b476bba0323c2e7ea532f [0,2,0,0,0,0|1,0,0]=3 14396 B13R1.15 CC[C@H](C)CNc1cc(ccn1)F b1aa481f2a17a4751c5bc9d0c5b31bf5 [0,2,0,0,0,0|1,0,0]=3 14397 B13R1.15 CC[C@H](C)CNc1cc(ccn1)I 3e42d518507d654782ec22937647f346 [0,2,0,0,0,0|1,0,0]=3 14398 B13R1.15 CC[C@H](C)CNc1cc(cnn1)Br 2486b6405416816629328feb25d62a11 [0,2,0,0,0,0|2,0,0]=4 14399 B13R1.15 CC[C@H](C)CNc1cc(cnn1)C 6ce5489d1838920e54d04536d40f8598 [0,2,0,0,0,0|2,0,0]=4 14400 B13R1.15 CC[C@H](C)CNc1cc(cnn1)Cl 0a5aa78d04bd3afdcf44ffe1f8114bd3 [0,2,0,0,0,0|2,0,0]=4 14401 B13R1.15 CC[C@H](C)CNc1cc(ncn1)Br 48b0f148ae7d4d7ce4de3ec7468439d8 [0,2,0,0,0,0|2,0,0]=4 14402 B13R1.15 CC[C@H](C)CNc1cc(ncn1)C b2c0a06aa008cd9ab6f4f137856c2ec5 [0,2,0,0,0,0|2,0,0]=4 14403 B13R1.15 CC[C@H](C)CNc1cc(ncn1)Cl 4bf1be92f5419a428674a7793066c1c5 [0,2,0,0,0,0|2,0,0]=4 14404 B13R1.15 CC[C@H](C)CNc1cc(ncn1)F 1521f878511d72fbf5a14937b1f921bb [0,2,0,0,0,0|2,0,0]=4 14405 B13R1.15 CC[C@H](C)CNc1cc(ncn1)I 12841d67975b3c66ff8f4a6dc8e14298 [0,2,0,0,0,0|2,0,0]=4 14406 B13R1.15 CC[C@H](C)CNc1cc[nH]c(=O)n1 ba7191a5c265631ab9e7e89d716d12df [0,2,0,0,0,0|2,0,0]=4 14407 B13R1.15 CC[C@H](C)CNc1cccc(c1)Br 0a6b0a1a51057f1f1632387b0d67a455 [0,2,0,0,0,0|2,0,0]=4 14408 B13R1.15 CC[C@H](C)CNc1cccc(c1)C ec4dcdb3518a21259525f6410c3fb345 [0,2,0,0,0,0|2,0,0]=4 14409 B13R1.15 CC[C@H](C)CNc1cccc(c1)Cl 3d0d2bb7febd2b750a461ddcce25d9de [0,2,0,0,0,0|2,0,0]=4 14410 B13R1.15 CC[C@H](C)CNc1cccc(c1)F feb61a19fd5ea57be567b443c12307f2 [0,2,0,0,0,0|2,0,0]=4 14411 B13R1.15 CC[C@H](C)CNc1cccc(c1)I ce9569ba4b3e90b6c978e424676337df [0,2,0,0,0,0|2,0,0]=4 14412 B13R1.15 CC[C@H](C)CNc1cccc(c1)S a6b0f9ff54ac06a28c51b53023abe074 [0,2,0,0,0,0|2,0,0]=4 14413 B13R1.15 CC[C@H](C)CNc1cccc(n1)Br 8410cb7b16b67dd2336fd8017e58fe4d [0,2,0,0,0,0|1,0,0]=3 14414 B13R1.15 CC[C@H](C)CNc1cccc(n1)C 0ef8adde9083307235dc8a69f5ea6647 [0,2,0,0,0,0|1,0,0]=3 14415 B13R1.15 CC[C@H](C)CNc1cccc(n1)Cl ab6c6e51cd608ee8eb1d7b5bc426c960 [0,2,0,0,0,0|1,0,0]=3 14416 B13R1.15 CC[C@H](C)CNc1cccc(n1)F 62c43efbe3d0316d4a6529c48448c655 [0,2,0,0,0,0|1,0,0]=3 14417 B13R1.15 CC[C@H](C)CNc1cccc(n1)I d87e1711efd987b34bb722eccca58865 [0,2,0,0,0,0|1,0,0]=3 14418 B13R1.15 CC[C@H](C)CNc1ccnc(n1)Br 79893441a9b6a4048be8fd438037c0d9 [0,2,0,0,0,0|2,0,0]=4 14419 B13R1.15 CC[C@H](C)CNc1ccnc(n1)C c89908cd61bb70d5807355d51f32991b [0,2,0,0,0,0|2,0,0]=4 14420 B13R1.15 CC[C@H](C)CNc1ccnc(n1)Cl c6f7c9b34bc2be5e518579f44fcee2d3 [0,2,0,0,0,0|2,0,0]=4 14421 B13R1.15 CC[C@H](C)CNc1ccnc(n1)F 6ac18fca025a09bc697e591c11f6b6b6 [0,2,0,0,0,0|2,0,0]=4 14422 B13R1.15 CC[C@H](C)CNc1ccnc(n1)S 63d4ecf806f513d64bb4ce4a48675514 [0,2,0,0,0,0|2,0,0]=4 14423 B13R1.15 CC[C@H](C)CNc1cncc(n1)Br 0f53bdd08b4284e5a3a52a56d16a4f5d [0,2,0,0,0,0|2,0,0]=4 14424 B13R1.15 CC[C@H](C)CNc1cncc(n1)C 608567bbe1665c0dc06d747e3330979d [0,2,0,0,0,0|2,0,0]=4 14425 B13R1.15 CC[C@H](C)CNc1cncc(n1)Cl 738b2140cf02119accf882d9df4ea08a [0,2,0,0,0,0|2,0,0]=4 14426 B13R1.15 CC[C@H](C)CNc1cncc(n1)F e10dff04282371584f79933fe392ffe3 [0,2,0,0,0,0|2,0,0]=4 14427 B13R1.15 CC[C@H](C)CNc1nccc(=O)[nH]1 557dcb3f29713d2f56a7c11a51b5f381 [0,2,0,0,0,0|2,0,0]=4 14428 B13R1.15 CC[C@H](C)CNc1nccc(n1)Br be8240f047f7da9227ad0875c739b142 [0,2,0,0,0,0|2,0,0]=4 14429 B13R1.15 CC[C@H](C)CNc1nccc(n1)C 4ac8f8f282cd35ca721653e9e159cbc7 [0,2,0,0,0,0|2,0,0]=4 14430 B13R1.15 CC[C@H](C)CNc1nccc(n1)Cl 94b6e64c5564cd8e9b14f9fe41e981cf [0,2,0,0,0,0|2,0,0]=4 14431 B13R1.15 CC[C@H](C)CNc1nccc(n1)F ad804b6a73873cb2c208e6da6e4db46a [0,2,0,0,0,0|2,0,0]=4 14432 B13R1.15 CC[C@H](C)CNc1nccc(n1)I 64d2e49ddc020c5d74a2b4667af45023 [0,2,0,0,0,0|2,0,0]=4 14433 B13R1.15 CC[C@H](C)COc1cc(ccn1)Br bfa4e7a07e72a0421f49e543a7aaea09 [0,2,0,0,0,0|1,0,0]=3 14434 B13R1.15 CC[C@H](C)COc1cc(ccn1)C 6c7985af2f4a551e9a63324de72fcc5e [0,2,0,0,0,0|1,0,0]=3 14435 B13R1.15 CC[C@H](C)COc1cc(ccn1)Cl ff82ab1fce3649d329a205b811862b4c [0,2,0,0,0,0|1,0,0]=3 14436 B13R1.15 CC[C@H](C)COc1cc(ccn1)F c00a9bffde3e79cdb3a316dab7fc01e7 [0,2,0,0,0,0|1,0,0]=3 14437 B13R1.15 CC[C@H](C)COc1cc(ncn1)Br 4fce98deb23389fbf1555b6175cc089a [0,2,0,0,0,0|2,0,0]=4 14438 B13R1.15 CC[C@H](C)COc1cc(ncn1)C 9c1d5a639906686141e68342db7200b6 [0,2,0,0,0,0|2,0,0]=4 14439 B13R1.15 CC[C@H](C)COc1cc(ncn1)Cl ec917607b153105be8c53319aaf40e56 [0,2,0,0,0,0|2,0,0]=4 14440 B13R1.15 CC[C@H](C)COc1cccc(=O)[nH]1 1471fd989284e5515655a156afc895c5 [0,2,0,0,0,0|1,0,1]=4 14441 B13R1.15 CC[C@H](C)COc1cccc(c1)Br 39acec316a367569aca56f9c01b02e34 [0,2,0,0,0,0|2,0,0]=4 14442 B13R1.15 CC[C@H](C)COc1cccc(c1)C ed9f860f7343b4b924a31b9584adb579 [0,2,0,0,0,0|2,0,0]=4 14443 B13R1.15 CC[C@H](C)COc1cccc(c1)Cl a67e48dbd503647967108b7a53c3dd2a [0,2,0,0,0,0|2,0,0]=4 14444 B13R1.15 CC[C@H](C)COc1cccc(c1)F 3033ccdc843b261b1461f1be9eb75c2d [0,2,0,0,0,0|2,0,0]=4 14445 B13R1.15 CC[C@H](C)COc1cccc(c1)I 54f654b053c6cfc7af66aefad23150c1 [0,2,0,0,0,0|2,0,0]=4 14446 B13R1.15 CC[C@H](C)COc1cccc(c1)S 0b5929681c188cb2b121633b5cd65742 [0,2,0,0,0,0|2,0,0]=4 14447 B13R1.15 CC[C@H](C)COc1cccc(n1)Br 25fc85889e664963e940dd74eabdb1fc [0,2,0,0,0,0|1,0,0]=3 14448 B13R1.15 CC[C@H](C)COc1cccc(n1)C 6d12b2fa07d2cf753081acd4f0db70ef [0,2,0,0,0,0|1,0,0]=3 14449 B13R1.15 CC[C@H](C)COc1cccc(n1)F cb55cea6add44cd5c480b875bf0dffeb [0,2,0,0,0,0|1,0,0]=3 14450 B13R1.15 CC[C@H](C)COc1ccnc(n1)C a475ad9790ad59cdf278c2e308c28452 [0,2,0,0,0,0|2,0,0]=4 14451 B13R1.15 CC[C@H](C)COc1ccnc(n1)Cl 216f5711411d5300eec72b930b2a28f0 [0,2,0,0,0,0|2,0,0]=4 14452 B13R1.15 CC[C@H](C)COc1cncc(n1)Br 7c2f0b9f323a70afb97311f1587ecf9b [0,2,0,0,0,0|2,0,0]=4 14453 B13R1.15 CC[C@H](C)COc1cncc(n1)C d41fa85b8b61558993511daff7b38226 [0,2,0,0,0,0|2,0,0]=4 14454 B13R1.15 CC[C@H](C)COc1cncc(n1)Cl 1945df800f7464ece7b32a32269cd925 [0,2,0,0,0,0|2,0,0]=4 14455 B13R1.15 CC[C@H](C)COc1nccc(n1)Cl f0f63008cf99dcdbcdb209f6f6ff325a [0,2,0,0,0,0|2,0,0]=4 14456 B13R1.15 CC[C@H](C)COc1nccc(n1)S 09653405881b2025f995860e0c0f5908 [0,2,0,0,0,0|2,0,0]=4 14457 B13R1.15 CC[C@H](C)NCc1cc(ccn1)Br f060c2beeb28b12dc76d42aa438679ef [0,2,0,0,0,0|1,0,0]=3 14458 B13R1.15 CC[C@H](C)NCc1cc(ccn1)Cl b29692690c227c3f547f9ec4d13a9369 [0,2,0,0,0,0|1,0,0]=3 14459 B13R1.15 CC[C@H](C)NCc1cccc(c1)Br f2280d80e856e6a8199a8994c3655741 [0,2,0,0,0,0|2,0,0]=4 14460 B13R1.15 CC[C@H](C)NCc1cccc(c1)C 4cd9319e5f3aa8dfc02c0b7cf451a158 [0,2,0,0,0,0|2,0,0]=4 14461 B13R1.15 CC[C@H](C)NCc1cccc(c1)Cl 930ff022cb73989af46c37b9c7ab522c [0,2,0,0,0,0|2,0,0]=4 14462 B13R1.15 CC[C@H](C)NCc1cccc(c1)F 7aef4ba1e8a89b4a1fa4c910a6b47493 [0,2,0,0,0,0|2,0,0]=4 14463 B13R1.15 CC[C@H](C)NCc1cccc(c1)I 58093b818a4e2db261733ed1b4033aca [0,2,0,0,0,0|2,0,0]=4 14464 B13R1.15 CC[C@H](C)NCc1cccc(n1)Br 9286abb82c8cb1c05c52653031b1c347 [0,2,0,0,0,0|1,0,0]=3 14465 B13R1.15 CC[C@H](C)NCc1cccc(n1)C a49c55705e08c1547aeecf3293918d31 [0,2,0,0,0,0|1,0,0]=3 14466 B13R1.15 CC[C@H](C)NCc1cccc(n1)Cl 12ed63ef480658ef63b79b2100329ce3 [0,2,0,0,0,0|1,0,0]=3 14467 B13R1.15 CC[C@H](C)NCc1cccc(n1)F 18b8ce6936b10b9a0f3ff9e3ddb5241b [0,2,0,0,0,0|1,0,0]=3 14468 B13R1.15 CC[C@H](C)NCc1ccnc(n1)Cl b68d4c6b8dfe3d2fedbe33827df0d769 [0,2,0,0,0,0|2,0,0]=4 14469 B13R1.15 CC[C@H](C)NCc1nccc(n1)C 8dcf1eb792d8f271a8a201cb06c35685 [0,2,0,0,0,0|2,0,0]=4 14470 B13R1.15 CC[C@H](C)NCc1nccc(n1)Cl b6791c4e709a2d2665d4100e0f5b7869 [0,2,0,0,0,0|2,0,0]=4 14471 B13R1.15 CC[C@H](C)OCc1cc(ccn1)Br 40e59aaa366e396d2f87dafcb4ea7e48 [0,2,0,0,0,0|1,0,0]=3 14472 B13R1.15 CC[C@H](C)OCc1cc(ccn1)Cl f4e14ec81bce5a239f1ed72a385bcb0a [0,2,0,0,0,0|1,0,0]=3 14473 B13R1.15 CC[C@H](C)OCc1cccc(c1)Br d1adcee1429236c12967737354767f20 [0,2,0,0,0,0|2,0,0]=4 14474 B13R1.15 CC[C@H](C)OCc1cccc(c1)C f451c8bd1726bc1caa20a6708db1d21c [0,2,0,0,0,0|2,0,0]=4 14475 B13R1.15 CC[C@H](C)OCc1cccc(c1)Cl 2ea65e74282d3c5ddc9482904970a558 [0,2,0,0,0,0|2,0,0]=4 14476 B13R1.15 CC[C@H](C)OCc1cccc(c1)F b3710a4d2576129320dd17941d73c286 [0,2,0,0,0,0|2,0,0]=4 14477 B13R1.15 CC[C@H](C)OCc1cccc(c1)I d4c36aa82a2f081c00cc6aa8fd4e3841 [0,2,0,0,0,0|2,0,0]=4 14478 B13R1.15 CC[C@H](C)OCc1cccc(n1)Br 05c9d7d3b497f4462c13c546eb92e0c3 [0,2,0,0,0,0|1,0,0]=3 14479 B13R1.15 CC[C@H](C)OCc1cccc(n1)C 218cbaa4728f8b7045e37efbcbab3e98 [0,2,0,0,0,0|1,0,0]=3 14480 B13R1.15 CC[C@H](C)OCc1cccc(n1)Cl 6008d1c2c566ccf9a45c891a86f39fd5 [0,2,0,0,0,0|1,0,0]=3 14481 B13R1.15 CC[C@H](C)OCc1cccc(n1)F 3fbbf8449ecface3f09c004cb552af53 [0,2,0,0,0,0|1,0,0]=3 14482 B13R1.15 CC[C@H](C)OCc1ccnc(n1)Cl 1a2e1b8121cae0b19239d0491e07a8f2 [0,2,0,0,0,0|2,0,0]=4 14483 B13R1.15 CC[C@H](C)OCc1nccc(n1)C 53d879db828f4a62b54a0d7fceafccb2 [0,2,0,0,0,0|2,0,0]=4 14484 B13R1.15 CC[C@H](C)OCc1nccc(n1)Cl 7436ab0136e12ba16eb2779c4d8b83db [0,2,0,0,0,0|2,0,0]=4 14485 B13R1.15 COC(C)CNc1cc(ccn1)Br 127d0b489858bc6c1d18ac7129f54783 [0,2,0,0,0,0|2,0,0]=4 14486 B13R1.15 COC(C)CNc1cc(ccn1)C 5678109fe8a24eee44948dac3c91e479 [0,2,0,0,0,0|2,0,0]=4 14487 B13R1.15 COC(C)CNc1cc(ccn1)Cl 764dc415550e6d900d5d5745be45641d [0,2,0,0,0,0|2,0,0]=4 14488 B13R1.15 COC(C)CNc1cc(ccn1)F b5490bca58cadc70059900aa7b0def76 [0,2,0,0,0,0|2,0,0]=4 14489 B13R1.15 COC(C)CNc1cc(ccn1)I ae2d44f7c13f167460b2a1bca0a717f1 [0,2,0,0,0,0|2,0,0]=4 14490 B13R1.15 COC(C)CNc1cccc(n1)Br 48e2046adf37fe232b84a6a2db535e98 [0,2,0,0,0,0|2,0,0]=4 14491 B13R1.15 COC(C)CNc1cccc(n1)C 2b78d71d8d868fee94ec6c492ea6a6be [0,2,0,0,0,0|2,0,0]=4 14492 B13R1.15 COC(C)CNc1cccc(n1)Cl c8caf9aadff8e2604ce797887d8aa596 [0,2,0,0,0,0|2,0,0]=4 14493 B13R1.15 COC(C)CNc1cccc(n1)F 8b86775bcd89d6b698ebc3ef00e8a881 [0,2,0,0,0,0|2,0,0]=4 14494 B13R1.15 COC(C)CNc1cccc(n1)I 068d91b15a6f1a2ee0b5eacd53de9f76 [0,2,0,0,0,0|2,0,0]=4 14495 B13R1.15 COC(C)COc1cc(ccn1)Br f2bc5a7c651081bf2ed3cce03b86f673 [0,2,0,0,0,0|2,0,0]=4 14496 B13R1.15 COC(C)COc1cc(ccn1)C 4c3a39d86cc3af5ee70c67f10a2c9e8f [0,2,0,0,0,0|2,0,0]=4 14497 B13R1.15 COC(C)COc1cc(ccn1)Cl a9b15f3e271c0fa897e456169502915b [0,2,0,0,0,0|2,0,0]=4 14498 B13R1.15 COC(C)COc1cc(ccn1)F 194e813f3d740a8a03131aa7c0554c45 [0,2,0,0,0,0|2,0,0]=4 14499 B13R1.15 COC(C)COc1cccc(n1)Br 2b8feecb213982716608256baff73842 [0,2,0,0,0,0|2,0,0]=4 14500 B13R1.15 COC(C)COc1cccc(n1)C 89347b6a1ad0abbd88fe97bf926c69f1 [0,2,0,0,0,0|2,0,0]=4 14501 B13R1.15 COC(C)COc1cccc(n1)F fe11595c750cb25f27506ed741c6f430 [0,2,0,0,0,0|2,0,0]=4 14502 B13R1.15 CO[C@@H](C)CNc1cc(ccn1)Br b0118105a53f386633e668cfb374549f [0,2,0,0,0,0|2,0,0]=4 14503 B13R1.15 CO[C@@H](C)CNc1cc(ccn1)C 8b66e4e95a2ab0a295d56faaac9edeb3 [0,2,0,0,0,0|2,0,0]=4 14504 B13R1.15 CO[C@@H](C)CNc1cc(ccn1)Cl 7ae55d62d629d37733ccd273aea9c4ea [0,2,0,0,0,0|2,0,0]=4 14505 B13R1.15 CO[C@@H](C)CNc1cc(ccn1)F 9aa287c17d4783fd20a9878f05732f87 [0,2,0,0,0,0|2,0,0]=4 14506 B13R1.15 CO[C@@H](C)CNc1cc(ccn1)I 6d84a6660d725dda6a63e00958183f75 [0,2,0,0,0,0|2,0,0]=4 14507 B13R1.15 CO[C@@H](C)CNc1cccc(n1)Br 2f36cf72025405312055a449078d98c4 [0,2,0,0,0,0|2,0,0]=4 14508 B13R1.15 CO[C@@H](C)CNc1cccc(n1)C fdbdcb727b8bb9e11cdd452e5ccb8454 [0,2,0,0,0,0|2,0,0]=4 14509 B13R1.15 CO[C@@H](C)CNc1cccc(n1)Cl b3afc61c8f4afecc11df6e0f89867379 [0,2,0,0,0,0|2,0,0]=4 14510 B13R1.15 CO[C@@H](C)CNc1cccc(n1)F 0d866c8589b85a7dcdf38f7a61b2136c [0,2,0,0,0,0|2,0,0]=4 14511 B13R1.15 CO[C@@H](C)CNc1cccc(n1)I 8712f840c81cf443367366d1bf3c75cb [0,2,0,0,0,0|2,0,0]=4 14512 B13R1.15 CO[C@@H](C)COc1cc(ccn1)Br d1540a01040e6bec071f3a512a08ed74 [0,2,0,0,0,0|2,0,0]=4 14513 B13R1.15 CO[C@@H](C)COc1cc(ccn1)C 3277d6596e35aaf69c1829acf38b5c65 [0,2,0,0,0,0|2,0,0]=4 14514 B13R1.15 CO[C@@H](C)COc1cc(ccn1)Cl b4f3241096dccbdb12539e0aa00a5caa [0,2,0,0,0,0|2,0,0]=4 14515 B13R1.15 CO[C@@H](C)COc1cc(ccn1)F 8133915d3c1fff064ca404aa7b30f7fc [0,2,0,0,0,0|2,0,0]=4 14516 B13R1.15 CO[C@@H](C)COc1cccc(n1)Br 783dfd1d8351f39253de196af7f8c473 [0,2,0,0,0,0|2,0,0]=4 14517 B13R1.15 CO[C@@H](C)COc1cccc(n1)C 70b03945d3efa2ebca26b247ac09ce6b [0,2,0,0,0,0|2,0,0]=4 14518 B13R1.15 CO[C@@H](C)COc1cccc(n1)F 665f3ca6e94984858ea2dc3532d85e8d [0,2,0,0,0,0|2,0,0]=4 14519 B13R1.15 CO[C@H](C)CNc1cc(ccn1)Br 099f3fc858bc6b4513670c8fdb61a6a5 [0,2,0,0,0,0|2,0,0]=4 14520 B13R1.15 CO[C@H](C)CNc1cc(ccn1)C 5fd130adc2b27b1ee27c1bf1f3f26a49 [0,2,0,0,0,0|2,0,0]=4 14521 B13R1.15 CO[C@H](C)CNc1cc(ccn1)Cl 17646736fc38956050d08b01e70d8703 [0,2,0,0,0,0|2,0,0]=4 14522 B13R1.15 CO[C@H](C)CNc1cc(ccn1)F da6e32238398035ae6e31545bd204229 [0,2,0,0,0,0|2,0,0]=4 14523 B13R1.15 CO[C@H](C)CNc1cc(ccn1)I a2a67e43dcfc32bed529f4fd6a7bea61 [0,2,0,0,0,0|2,0,0]=4 14524 B13R1.15 CO[C@H](C)CNc1cccc(n1)Br ded1009006482eaf0dda61d46610d560 [0,2,0,0,0,0|2,0,0]=4 14525 B13R1.15 CO[C@H](C)CNc1cccc(n1)C 3aa397c34f8a2537134c4830297687a9 [0,2,0,0,0,0|2,0,0]=4 14526 B13R1.15 CO[C@H](C)CNc1cccc(n1)Cl 0d683b6210860738a2b5b9ee32920338 [0,2,0,0,0,0|2,0,0]=4 14527 B13R1.15 CO[C@H](C)CNc1cccc(n1)F a51e8599d2843ab026e1d3f682330804 [0,2,0,0,0,0|2,0,0]=4 14528 B13R1.15 CO[C@H](C)CNc1cccc(n1)I 14ea4db675c53cf89966cb0eb31702fd [0,2,0,0,0,0|2,0,0]=4 14529 B13R1.15 CO[C@H](C)COc1cc(ccn1)Br 02368be50416046f9a7e01dc8512adfc [0,2,0,0,0,0|2,0,0]=4 14530 B13R1.15 CO[C@H](C)COc1cc(ccn1)C 6b38d4ffd030958d69eb92d812bac41d [0,2,0,0,0,0|2,0,0]=4 14531 B13R1.15 CO[C@H](C)COc1cc(ccn1)Cl 373a0a17fcb9381604cb87aa058ba4e9 [0,2,0,0,0,0|2,0,0]=4 14532 B13R1.15 CO[C@H](C)COc1cc(ccn1)F adadb6a65d12478a80a59a2bbb491cb2 [0,2,0,0,0,0|2,0,0]=4 14533 B13R1.15 CO[C@H](C)COc1cccc(n1)Br 92acfad4ff318cce85a720d851e6ff60 [0,2,0,0,0,0|2,0,0]=4 14534 B13R1.15 CO[C@H](C)COc1cccc(n1)C e0aced9974574acc21eab734bfaa8450 [0,2,0,0,0,0|2,0,0]=4 14535 B13R1.15 CO[C@H](C)COc1cccc(n1)F e3425d0e8ae88c6539eced026fc5db13 [0,2,0,0,0,0|2,0,0]=4 14536 B13R1.15 C[C@@H](CO)CNc1cc(ccn1)Br 438a242a97a887767bbd9600a0083fc9 [0,2,0,0,0,0|2,0,0]=4 14537 B13R1.15 C[C@@H](CO)CNc1cc(ccn1)Cl 313ae34e80c2d405242eab7185de1f2a [0,2,0,0,0,0|2,0,0]=4 14538 B13R1.15 C[C@@H](CO)CNc1cc(ccn1)F 74b61af8a6b4a7964e7fce3a47d85c40 [0,2,0,0,0,0|2,0,0]=4 14539 B13R1.15 C[C@@H](CO)CNc1cc(ccn1)I 6e9c4a913efd5c94338de3af92b2df7d [0,2,0,0,0,0|2,0,0]=4 14540 B13R1.15 C[C@@H](CO)CNc1cccc(n1)Br e2b783d51e139bd7d6b52cd1e954323d [0,2,0,0,0,0|2,0,0]=4 14541 B13R1.15 C[C@@H](CO)CNc1cccc(n1)Cl 7440b1597d4b88e18371bf61004850a1 [0,2,0,0,0,0|2,0,0]=4 14542 B13R1.15 C[C@@H](CO)CNc1cccc(n1)F 0115c7a0590dc1f5aa6f362a370802ca [0,2,0,0,0,0|2,0,0]=4 14543 B13R1.15 C[C@@H](CO)CNc1cccc(n1)I 85cd5bdab7a0e2c29cc0464bd51f818c [0,2,0,0,0,0|2,0,0]=4 14544 B13R1.15 C[C@@H](CO)NCc1cc(ccn1)Br 551bb86205eb77fd686cdd4d9cfc9005 [0,2,0,0,0,0|2,0,0]=4 14545 B13R1.15 C[C@@H](CO)NCc1cc(ccn1)Cl d00b855be4d1c4f37f85ff5be24f4ba1 [0,2,0,0,0,0|2,0,0]=4 14546 B13R1.15 C[C@@H](CO)NCc1cccc(n1)Br d65862400aa73eb730168b9894d9696b [0,2,0,0,0,0|2,0,0]=4 14547 B13R1.15 C[C@@H](CO)NCc1cccc(n1)Cl 9a9b059710b5557e71c4ff1125f236ab [0,2,0,0,0,0|2,0,0]=4 14548 B13R1.15 C[C@@H](CO)NCc1cccc(n1)F 961fcd640397a5e7d8ce55c21f185fad [0,2,0,0,0,0|2,0,0]=4 14549 B13R1.15 C[C@H](CO)CNc1cc(ccn1)Br e32dd75b404f310c38c6c668924d80cb [0,2,0,0,0,0|2,0,0]=4 14550 B13R1.15 C[C@H](CO)CNc1cc(ccn1)Cl 21b4cec97fc541a8fc43b604db9e4dd1 [0,2,0,0,0,0|2,0,0]=4 14551 B13R1.15 C[C@H](CO)CNc1cc(ccn1)F b689fdbda47e5a436725f86f04352d64 [0,2,0,0,0,0|2,0,0]=4 14552 B13R1.15 C[C@H](CO)CNc1cc(ccn1)I 2a8061d71a9fed11439cfa791bfeccf6 [0,2,0,0,0,0|2,0,0]=4 14553 B13R1.15 C[C@H](CO)CNc1cccc(n1)Br cef8b49463c8bfa6bcb0182d07f7c1d7 [0,2,0,0,0,0|2,0,0]=4 14554 B13R1.15 C[C@H](CO)CNc1cccc(n1)Cl 1f315d84be5b7ecac54574fcaeaa257b [0,2,0,0,0,0|2,0,0]=4 14555 B13R1.15 C[C@H](CO)CNc1cccc(n1)F 91e6a9e677fa4e3a58d66adb5d4240e4 [0,2,0,0,0,0|2,0,0]=4 14556 B13R1.15 C[C@H](CO)CNc1cccc(n1)I ace3df2013b50abfb4252f79e6f3b29d [0,2,0,0,0,0|2,0,0]=4 14557 B13R1.15 C[C@H](CO)NCc1cc(ccn1)Br 8061d66437caf0fefbb04034f312fa5e [0,2,0,0,0,0|2,0,0]=4 14558 B13R1.15 C[C@H](CO)NCc1cc(ccn1)Cl 923b466d93e23dc5cee0c216442366ed [0,2,0,0,0,0|2,0,0]=4 14559 B13R1.15 C[C@H](CO)NCc1cccc(n1)Br 4555dca02f62b7da7dd54bae01150cee [0,2,0,0,0,0|2,0,0]=4 14560 B13R1.15 C[C@H](CO)NCc1cccc(n1)Cl 9e25d7ee2bf9d78d7604ed798075ddc4 [0,2,0,0,0,0|2,0,0]=4 14561 B13R1.15 C[C@H](CO)NCc1cccc(n1)F 9b1c4193a3a7c9c0a54de6d2efa6b70d [0,2,0,0,0,0|2,0,0]=4 14562 B13R1.15 C[C@H](CS)OCc1cc(ccn1)Br 588c42671e7277c1e6b0c6e18e5bfbe7 [0,2,0,0,0,0|2,0,0]=4 14563 B13R1.15 C[C@H](CS)OCc1cc(ccn1)Cl 2047ee9124a864c54a0810ea3376ba24 [0,2,0,0,0,0|2,0,0]=4 14564 B13R1.15 C[C@H](CS)OCc1cccc(n1)Br 3868effd344ec9cc6861275c27281af0 [0,2,0,0,0,0|2,0,0]=4 14565 B13R1.15 C[C@H](CS)OCc1cccc(n1)Cl 1a5cef1fd56e76fca51d2ebf2f23ce73 [0,2,0,0,0,0|2,0,0]=4 14566 B13R1.15 C[C@H](CS)OCc1cccc(n1)F 8f8339121fcb202c730d3e76b30e0d4d [0,2,0,0,0,0|2,0,0]=4 14567 B13R1.15 Cc1cccc(n1)CNC(C)CO e75aed75e46f211aca8e9dc0e61888a0 [0,2,0,0,0,0|2,0,0]=4 14568 B13R1.15 Cc1cccc(n1)CN[C@@H](C)CO 1a860dc7a53a5d1caffc241b41b7e7e7 [0,2,0,0,0,0|2,0,0]=4 14569 B13R1.15 Cc1cccc(n1)CN[C@H](C)CO 76ab132346132e1b7ffe981049c2bfb5 [0,2,0,0,0,0|2,0,0]=4 14570 B13R1.15 Cc1cccc(n1)COC(C)CF a4fd11115a90bf828e0d06bb938edc5e [0,2,0,0,0,0|2,0,0]=4 14571 B13R1.15 Cc1cccc(n1)COC(C)CS 0000ea357988b311f38208a21ad9621f [0,2,0,0,0,0|2,0,0]=4 14572 B13R1.15 Cc1cccc(n1)CO[C@H](C)CS 1f2c2cff62b34d21637c45133ae41f9a [0,2,0,0,0,0|2,0,0]=4 14573 B13R1.15 Cc1cccc(n1)NCC(Br)CBr 93c9956b1781345a585880080cfbdfc4 [0,2,0,0,0,0|2,0,0]=4 14574 B13R1.15 Cc1cccc(n1)NCC(C)CO 7694912547753e4b13909b80b99aaedb [0,2,0,0,0,0|2,0,0]=4 14575 B13R1.15 Cc1cccc(n1)NCC(F)CO 308f5dd645c04a4f39c318ffcc74f365 [0,2,0,0,0,0|2,0,0]=4 14576 B13R1.15 Cc1cccc(n1)NCC(O)CF b928050b9b9f7d6b1fcde157c7db76ed [0,2,0,0,0,0|2,0,0]=4 14577 B13R1.15 Cc1cccc(n1)NCC(O)CO 2e60a24fa3831a10a1a9cd26bad1fe89 [0,2,0,0,0,0|2,0,0]=4 14578 B13R1.15 Cc1cccc(n1)NC[C@@H](C)CO 02e87fedabc4219693b8ddee6bf9a05a [0,2,0,0,0,0|2,0,0]=4 14579 B13R1.15 Cc1cccc(n1)NC[C@@H](F)CO f34b590e66e74ac3255629f7f795f389 [0,2,0,0,0,0|2,0,0]=4 14580 B13R1.15 Cc1cccc(n1)NC[C@@H](O)CO 614d207676fe85113a760aa13260eda6 [0,2,0,0,0,0|2,0,0]=4 14581 B13R1.15 Cc1cccc(n1)NC[C@H](C)CO f557712994c0c34997aded1c43073e9f [0,2,0,0,0,0|2,0,0]=4 14582 B13R1.15 Cc1cccc(n1)NC[C@H](F)CO 2adfa8a1347949142c7b357a1435c47e [0,2,0,0,0,0|2,0,0]=4 14583 B13R1.15 Cc1cccc(n1)NC[C@H](O)CO 0a994b535314e51b08e98670d3c33cfc [0,2,0,0,0,0|2,0,0]=4 14584 B13R1.15 Cc1cccc(n1)OCC(O)CO ff8004340083dbb962d115d586f6de26 [0,2,0,0,0,0|2,0,0]=4 14585 B13R1.15 Cc1cccc(n1)OC[C@@H](O)CO 956a5542a7e60a733ff51edebdcfaa77 [0,2,0,0,0,0|2,0,0]=4 14586 B13R1.15 Cc1cccc(n1)OC[C@H](O)CO f300df76a0ee08a7212552f243bccccd [0,2,0,0,0,0|2,0,0]=4 14587 B13R1.15 Cc1ccnc(c1)CNC(C)CO 4c8bcf161e69784e8df3e7573450c0d8 [0,2,0,0,0,0|2,0,0]=4 14588 B13R1.15 Cc1ccnc(c1)CN[C@@H](C)CO 89147416a9fe600da5142533533624b3 [0,2,0,0,0,0|2,0,0]=4 14589 B13R1.15 Cc1ccnc(c1)CN[C@H](C)CO a2a437551f1162b25a8a2ac1fa23a498 [0,2,0,0,0,0|2,0,0]=4 14590 B13R1.15 Cc1ccnc(c1)NCC(C)CO d824fda0203ae061dd491baabc27853f [0,2,0,0,0,0|2,0,0]=4 14591 B13R1.15 Cc1ccnc(c1)NCC(F)CO 2511b918a5b19360e5b96229275f3316 [0,2,0,0,0,0|2,0,0]=4 14592 B13R1.15 Cc1ccnc(c1)NCC(O)CF 5c857ac22f68bda967793040e032c475 [0,2,0,0,0,0|2,0,0]=4 14593 B13R1.15 Cc1ccnc(c1)NCC(O)CO 3cdea546f941a55e7eea6519c121322d [0,2,0,0,0,0|2,0,0]=4 14594 B13R1.15 Cc1ccnc(c1)NC[C@@H](C)CO 4ce383dfc6f9eda68cb29397324bf727 [0,2,0,0,0,0|2,0,0]=4 14595 B13R1.15 Cc1ccnc(c1)NC[C@@H](F)CO 65a681cfb19488708340841d3eadf2c7 [0,2,0,0,0,0|2,0,0]=4 14596 B13R1.15 Cc1ccnc(c1)NC[C@@H](O)CO 30f705773a9c227c4783dd5931387b63 [0,2,0,0,0,0|2,0,0]=4 14597 B13R1.15 Cc1ccnc(c1)NC[C@H](C)CO 8a834ebeed00b8b4ff43285069b63cc4 [0,2,0,0,0,0|2,0,0]=4 14598 B13R1.15 Cc1ccnc(c1)NC[C@H](F)CO e92ad2a29297263cde1a4e9c6a86563e [0,2,0,0,0,0|2,0,0]=4 14599 B13R1.15 Cc1ccnc(c1)NC[C@H](O)CO 4b95a85050262a76bf9784665c906ca3 [0,2,0,0,0,0|2,0,0]=4 14600 B13R1.15 Cc1ccnc(c1)OCC(O)CO 5120bb1f24e1bd5431fa8f29a155b838 [0,2,0,0,0,0|2,0,0]=4 14601 B13R1.15 Cc1ccnc(c1)OC[C@@H](O)CO 7db89bc5d9fdb7e66e19d4d5589130e7 [0,2,0,0,0,0|2,0,0]=4 14602 B13R1.15 Cc1ccnc(c1)OC[C@H](O)CO 0832d1c4fb740824424d912912eca1e8 [0,2,0,0,0,0|2,0,0]=4 14603 B13R1.15 OC(CF)CNc1cc(ccn1)Br 4c1ab4b602b37ca1669c14ffde492a2e [0,2,0,0,0,0|2,0,0]=4 14604 B13R1.15 OC(CF)CNc1cc(ccn1)Cl 2c585f687153e77ed7eae6fb6ec51e92 [0,2,0,0,0,0|2,0,0]=4 14605 B13R1.15 OC(CF)CNc1cc(ccn1)F 4d485f178b44ce5c2c8d23110ce7fa35 [0,2,0,0,0,0|2,0,0]=4 14606 B13R1.15 OC(CF)CNc1cc(ccn1)I d0e5a7e5beb6cb94dd9830d9f7bf6524 [0,2,0,0,0,0|2,0,0]=4 14607 B13R1.15 OC(CF)CNc1cccc(n1)Br 0c74f8232c6cf700848aee4d13e5a7df [0,2,0,0,0,0|2,0,0]=4 14608 B13R1.15 OC(CF)CNc1cccc(n1)Cl 17b88a661774defbb44aeceeaa465a30 [0,2,0,0,0,0|2,0,0]=4 14609 B13R1.15 OC(CF)CNc1cccc(n1)F 3534c544af97525953407f86d7b99ae2 [0,2,0,0,0,0|2,0,0]=4 14610 B13R1.15 OC(CF)CNc1cccc(n1)I 209636ba11f4875eae5611e1ddcab77b [0,2,0,0,0,0|2,0,0]=4 14611 B13R1.15 OCC(F)CNc1cc(ccn1)F 92468b05ccb5080f51a69608d5e77a4c [0,2,0,0,0,0|2,0,0]=4 14612 B13R1.15 OCC(F)CNc1cc(ccn1)O a3b93b45fcb60457d2f284be3188bace [0,2,0,0,0,0|2,0,0]=4 14613 B13R1.15 OCC(F)CNc1cccc(n1)F de18c8676452bb45d8b4b492f1b5b5e0 [0,2,0,0,0,0|2,0,0]=4 14614 B13R1.15 OCC(O)CNc1cc(ccn1)Br 660e41f2401c80d1a09f4244488b05f3 [0,2,0,0,0,0|2,0,0]=4 14615 B13R1.15 OCC(O)CNc1cc(ccn1)Cl f63c0ae3af69ca3630f933a851083513 [0,2,0,0,0,0|2,0,0]=4 14616 B13R1.15 OCC(O)CNc1cc(ccn1)F 3a9de3b95503a882d0f3af9a7acc6a8c [0,2,0,0,0,0|2,0,0]=4 14617 B13R1.15 OCC(O)CNc1cc(ccn1)I d2195caaa96a3b5ad3ab62168468f300 [0,2,0,0,0,0|2,0,0]=4 14618 B13R1.15 OCC(O)CNc1cccc(n1)Br cfa18695b5a11a8c0bebe5a786a837c1 [0,2,0,0,0,0|2,0,0]=4 14619 B13R1.15 OCC(O)CNc1cccc(n1)Cl 99f51946d9008c2445891c086309b983 [0,2,0,0,0,0|2,0,0]=4 14620 B13R1.15 OCC(O)CNc1cccc(n1)F efd90d93a8b302e1eb5d6eccd6f52457 [0,2,0,0,0,0|2,0,0]=4 14621 B13R1.15 OCC(O)CNc1cccc(n1)I 89c795967a5e35af5083070cb40abbaa [0,2,0,0,0,0|2,0,0]=4 14622 B13R1.15 OCC(O)COc1cc(ccn1)Br 8ada5a4dff96eaae94592c209ca09596 [0,2,0,0,0,0|2,0,0]=4 14623 B13R1.15 OCC(O)COc1cc(ccn1)Cl d658613620544fd4844dab7571fcb5b3 [0,2,0,0,0,0|2,0,0]=4 14624 B13R1.15 OCC(O)COc1cc(ccn1)F aeccd9a69e2e5bf196f06375a848ae3e [0,2,0,0,0,0|2,0,0]=4 14625 B13R1.15 OCC(O)COc1cccc(n1)Br 2f866c0260269e8071834cc28bf13517 [0,2,0,0,0,0|2,0,0]=4 14626 B13R1.15 OCC(O)COc1cccc(n1)F 5d6b8ffe8452c1461f17c9ed35521540 [0,2,0,0,0,0|2,0,0]=4 14627 B13R1.15 OC[C@@H](F)CNc1cc(ccn1)F 9fd9e9e7d2d5276686aa87b381c12b41 [0,2,0,0,0,0|2,0,0]=4 14628 B13R1.15 OC[C@@H](F)CNc1cc(ccn1)O 2197c9eea7becc9f4901efdc6a448bd5 [0,2,0,0,0,0|2,0,0]=4 14629 B13R1.15 OC[C@@H](F)CNc1cccc(n1)F 6ab17279665a0ea0c6e70b9b7a2b9804 [0,2,0,0,0,0|2,0,0]=4 14630 B13R1.15 OC[C@@H](O)CNc1cc(ccn1)Br debee4031cb47464748550bcdc498e55 [0,2,0,0,0,0|2,0,0]=4 14631 B13R1.15 OC[C@@H](O)CNc1cc(ccn1)Cl 40a6443cfbbfa55fb38a218ad67f2ac8 [0,2,0,0,0,0|2,0,0]=4 14632 B13R1.15 OC[C@@H](O)CNc1cc(ccn1)F ab928eb8aed87f3f6103f40b4edae2d1 [0,2,0,0,0,0|2,0,0]=4 14633 B13R1.15 OC[C@@H](O)CNc1cc(ccn1)I 4d5c32d88ce7b88a5d4825263371d4ff [0,2,0,0,0,0|2,0,0]=4 14634 B13R1.15 OC[C@@H](O)CNc1cccc(n1)Br 8e40b2e3d2281391c098b46a918ccf4d [0,2,0,0,0,0|2,0,0]=4 14635 B13R1.15 OC[C@@H](O)CNc1cccc(n1)Cl 22548fcf83c9f8734c1979514710b99d [0,2,0,0,0,0|2,0,0]=4 14636 B13R1.15 OC[C@@H](O)CNc1cccc(n1)F d01f6a7705a98255e34d5a172e4ba722 [0,2,0,0,0,0|2,0,0]=4 14637 B13R1.15 OC[C@@H](O)CNc1cccc(n1)I bc6a373b79be32ee1835c2b4a80fb345 [0,2,0,0,0,0|2,0,0]=4 14638 B13R1.15 OC[C@@H](O)COc1cc(ccn1)Br df6bd37581ffd0027c0356938dcf68e1 [0,2,0,0,0,0|2,0,0]=4 14639 B13R1.15 OC[C@@H](O)COc1cc(ccn1)Cl cce6ee6c156c7f01eb6994edff4e5fb5 [0,2,0,0,0,0|2,0,0]=4 14640 B13R1.15 OC[C@@H](O)COc1cc(ccn1)F 14b5dbdfe6c578ea7fc0490208ef96a7 [0,2,0,0,0,0|2,0,0]=4 14641 B13R1.15 OC[C@@H](O)COc1cccc(n1)Br 03a02a80a70b13cf81ae364fa2241e3f [0,2,0,0,0,0|2,0,0]=4 14642 B13R1.15 OC[C@@H](O)COc1cccc(n1)F dbea553f6746e870a406bfb92ddc772f [0,2,0,0,0,0|2,0,0]=4 14643 B13R1.15 OC[C@H](F)CNc1cc(ccn1)F 471a3800604034ac8ac89655592b8e8c [0,2,0,0,0,0|2,0,0]=4 14644 B13R1.15 OC[C@H](F)CNc1cc(ccn1)O e7f7e2eaaf6b4933fe4f067b984232f5 [0,2,0,0,0,0|2,0,0]=4 14645 B13R1.15 OC[C@H](F)CNc1cccc(n1)F 543f22d6c81da5558057ae9cf7e0ec1b [0,2,0,0,0,0|2,0,0]=4 14646 B13R1.15 OC[C@H](O)CNc1cc(ccn1)Br ccb44a6f2c5643580c49dccc223dff4c [0,2,0,0,0,0|2,0,0]=4 14647 B13R1.15 OC[C@H](O)CNc1cc(ccn1)Cl 6b7cab3da85a678d6d537a14fb485f09 [0,2,0,0,0,0|2,0,0]=4 14648 B13R1.15 OC[C@H](O)CNc1cc(ccn1)F 24d8bbc0088efef989d522c54a160ee6 [0,2,0,0,0,0|2,0,0]=4 14649 B13R1.15 OC[C@H](O)CNc1cc(ccn1)I 57930453a20fce01c70812eaf285ce39 [0,2,0,0,0,0|2,0,0]=4 14650 B13R1.15 OC[C@H](O)CNc1cccc(n1)Br 8b2e802c9d5c124a6dd8d7284e922c8d [0,2,0,0,0,0|2,0,0]=4 14651 B13R1.15 OC[C@H](O)CNc1cccc(n1)Cl 6876303cb78da9ce948c8ba84688f60f [0,2,0,0,0,0|2,0,0]=4 14652 B13R1.15 OC[C@H](O)CNc1cccc(n1)F 5711e20913e7c1d7c261f17082593447 [0,2,0,0,0,0|2,0,0]=4 14653 B13R1.15 OC[C@H](O)CNc1cccc(n1)I de58dc6df8546b53f2bbb178efe1ba95 [0,2,0,0,0,0|2,0,0]=4 14654 B13R1.15 OC[C@H](O)COc1cc(ccn1)Br 623891393fd0142afa089f8a32ef70b4 [0,2,0,0,0,0|2,0,0]=4 14655 B13R1.15 OC[C@H](O)COc1cc(ccn1)Cl 9f755c328b596014fdb35d0c6fa7fb4d [0,2,0,0,0,0|2,0,0]=4 14656 B13R1.15 OC[C@H](O)COc1cc(ccn1)F 0add908f36c857c70cb6fab8b6cfc160 [0,2,0,0,0,0|2,0,0]=4 14657 B13R1.15 OC[C@H](O)COc1cccc(n1)Br b7e2a59b1fc40ea9a9125ab7dea7f9b5 [0,2,0,0,0,0|2,0,0]=4 14658 B13R1.15 OC[C@H](O)COc1cccc(n1)F 65340798b39fef9a40cda4edeb7078da [0,2,0,0,0,0|2,0,0]=4 14659 B13R1.135 CC(CO)N(C)Cc1ccccn1 3c9fdef3b4a421e310540f6452a44290 [0,2,0,0,0,0|2,0,0]=4 14660 B13R1.135 CC(Cc1ccccn1)N(C)CF 5942b073e8bb2598e2e6c29504e0fb67 [0,2,0,0,0,0|2,0,0]=4 14661 B13R1.135 CC(Cc1ccccn1)N(C)CO 1bac6048c7537564e8f18bba48e0962a [0,2,0,0,0,0|2,0,0]=4 14662 B13R1.135 CCC(=O)C(C)Nc1ccccn1 a614279d28c6f034c77a02b691b48a52 [0,2,0,0,0,0|1,0,1]=4 14663 B13R1.135 CCC(=O)C(C)Oc1ccccn1 b0491e44a100dbc0629dfc1ed999a31d [0,2,0,0,0,0|1,0,1]=4 14664 B13R1.135 CCC(=O)N(C)Cc1ccccn1 e1c6dc1dcaad7c7592d1ed2c02fa4833 [0,2,0,0,0,0|1,0,1]=4 14665 B13R1.135 CCC(C)C(C)Nc1ccccc1 73b2cd226841b6348e2e0f4edcd68945 [0,2,0,0,0,0|2,0,0]=4 14666 B13R1.135 CCC(C)N(C)Cc1ccccc1 e234f9a3b43c51cdfa21362e0b953970 [0,2,0,0,0,0|2,0,0]=4 14667 B13R1.135 CCC(C)N(C)Cc1ccccn1 f14d4c212f8f906cb22d100e742cfb96 [0,2,0,0,0,0|1,0,0]=3 14668 B13R1.135 CCC(C)N(C)Cc1cccnn1 6a4559a2796f1e56ba50e9cd1a12c85f [0,2,0,0,0,0|2,0,0]=4 14669 B13R1.135 CCC(C)N(C)Cc1ccncn1 8893b11e8c27f30e03829d9e45a6d9a0 [0,2,0,0,0,0|2,0,0]=4 14670 B13R1.135 CCC(C)N(C)Cc1cnccn1 9508a9b41f526921d5efa2e7b3fbcbca [0,2,0,0,0,0|2,0,0]=4 14671 B13R1.135 CCC(C)N(C)Cc1ncccn1 5bcc2bc05b2f5144d5949f0ecb3358c6 [0,2,0,0,0,0|2,0,0]=4 14672 B13R1.135 CCC(O)C(=O)Nc1ccccn1 cf8f226c6d8f1852edaf52eb11d0aa5d [0,2,0,0,0,0|1,0,1]=4 14673 B13R1.135 CCN(C)C(=O)Cc1ccccn1 e837a3a0ac511702eae3cf89b715f154 [0,2,0,0,0,0|1,0,1]=4 14674 B13R1.135 CCN(C)C(C)Cc1ccccn1 29e1e980ad7deada42b016bfaf8b7698 [0,2,0,0,0,0|1,0,0]=3 14675 B13R1.135 CCN(C)C(C)Cc1cnccn1 ff8b861f062ae2227f14eaa30f5af1a0 [0,2,0,0,0,0|2,0,0]=4 14676 B13R1.135 CC[C@@H](O)C(=O)Nc1ccccn1 0f9f2006d58ff84d4a7bff76ab153033 [0,2,0,0,0,0|1,0,1]=4 14677 B13R1.135 CC[C@H](O)C(=O)Nc1ccccn1 ef07ead10343d38e89642384b5c9ad8b [0,2,0,0,0,0|1,0,1]=4 14678 B13R1.135 CC[C@H](S)C(=O)Nc1ccccn1 ea478c5aa6136d591dbba3a5724dccb6 [0,2,0,0,0,0|1,0,1]=4 14679 B13R1.135 C[C@@H](CO)N(C)Cc1ccccn1 4f46919fb1dc121d4c3f6db1ac4a4c0d [0,2,0,0,0,0|2,0,0]=4 14680 B13R1.135 C[C@H](CO)N(C)Cc1ccccn1 dedda2496208f8fc493dd027a35bd72d [0,2,0,0,0,0|2,0,0]=4 14681 B13R1.254 CC(C)(CF)NCc1ccccn1 7c0be4e1507c7dc70b45a6afdaab9259 [0,2,0,0,0,0|2,0,0]=4 14682 B13R1.254 CC(C)(CO)CNc1ccccn1 7fd2d9778ca68c2e4df0e5685dc71a97 [0,2,0,0,0,0|2,0,0]=4 14683 B13R1.254 CC(C)(CO)NCc1ccccn1 af01aceb25337d8503159bb791929e4a [0,2,0,0,0,0|2,0,0]=4 14684 B13R1.254 CCC(C)(C)CNc1ccccc1 57e0f7745801d3a9ef93112da52879cc [0,2,0,0,0,0|2,0,0]=4 14685 B13R1.254 CCC(C)(C)CNc1ccncn1 ff9e6edf39038ef5363b3a2df8a160e3 [0,2,0,0,0,0|2,0,0]=4 14686 B13R1.254 CCC(C)(C)NCc1ccccc1 c23d315dd1142156bcb929792b807c12 [0,2,0,0,0,0|2,0,0]=4 14687 B13R1.254 CCC(C)(C)NCc1ccccn1 b4cec9232b4d3f129eac85be2a03bb0a [0,2,0,0,0,0|1,0,0]=3 14688 B13R1.254 CCC(C)(C)NCc1cccnn1 d5e122713cacdded27b86a3589d65874 [0,2,0,0,0,0|2,0,0]=4 14689 B13R1.254 CCC(C)(C)NCc1ccncn1 d71e0c2687350da228c3b10197b6ecb0 [0,2,0,0,0,0|2,0,0]=4 14690 B13R1.254 CCC(C)(C)NCc1ncccn1 dddfb369435131f2bb0eefcb03ef5ad9 [0,2,0,0,0,0|2,0,0]=4 14691 B13R1.254 CCC(C)(O)CNc1ccccc1 eaddb3dcda08b71b2b3c74b7dd85d191 [0,2,0,0,0,0|2,0,0]=4 14692 B13R1.254 CCC(C)(O)CNc1ccncn1 08311a4e3eb54608c6ae1258584b18ae [0,2,0,0,0,0|2,0,0]=4 14693 B13R1.254 CCS(=O)(=O)COc1ccccn1 509a0ae19876f253bca64cb3b2e4a319 [0,2,0,0,0,0|2,0,0]=4 14694 B13R1.254 COC(C)(C)CNc1ccccn1 672a9d3657b832bdc11a2067ffee941d [0,2,0,0,0,0|2,0,0]=4 14695 B13R1.254 COC(C)(C)COc1ccccn1 2d19e2a010622e2d24586b08dc483a61 [0,2,0,0,0,0|2,0,0]=4 14696 B13R1.254 OCC(F)(F)CNc1ccccn1 58ffe81560f9b9296ff0463ee6f3df97 [0,2,0,0,0,0|2,0,0]=4 14697 B13R1.351 CC(=O)C(C)NCc1ccccn1 6bc3fd5f499b5525929cbce2ad7d8c55 [0,2,0,0,0,0|1,0,1]=4 14698 B13R1.351 CC(=O)C(C)OCc1ccccn1 9a14f9fcd97b117083768931c372e75f [0,2,0,0,0,0|1,0,1]=4 14699 B13R1.351 CC(=O)N(C)CCc1ccccn1 28bad44297d658a472891d82560dce93 [0,2,0,0,0,0|1,0,1]=4 14700 B13R1.351 CC(C)C(=O)CNc1ccccn1 abda9e79c1ac6866649bc2c67b297a26 [0,2,0,0,0,0|1,0,1]=4 14701 B13R1.351 CC(C)C(=O)COc1ccccn1 2c7c2f87002009d74cde35d056d7da59 [0,2,0,0,0,0|1,0,1]=4 14702 B13R1.351 CC(C)C(C)CNc1ccccc1 31084112f543bc6b5c60aa8d2c00c60c [0,2,0,0,0,0|2,0,0]=4 14703 B13R1.351 CC(C)C(C)CNc1ccccn1 efa854a93bf821b1d10238c6ffba9f3b [0,2,0,0,0,0|1,0,0]=3 14704 B13R1.351 CC(C)C(C)CNc1cccnn1 f96b4658399720ea2592aeaceb7ad8dd [0,2,0,0,0,0|2,0,0]=4 14705 B13R1.351 CC(C)C(C)CNc1ccncn1 8bfa312f1ca6c47d9bae224c8449fadb [0,2,0,0,0,0|2,0,0]=4 14706 B13R1.351 CC(C)C(C)CNc1cnccn1 e2d3ea6f5f54b20f2bbdec755859b7d1 [0,2,0,0,0,0|2,0,0]=4 14707 B13R1.351 CC(C)C(C)CNc1ncccn1 09ff442755cc07b524f9b456a670a852 [0,2,0,0,0,0|2,0,0]=4 14708 B13R1.351 CC(C)C(C)COc1ccccn1 dfe559465ccb390d996200762613ac46 [0,2,0,0,0,0|1,0,0]=3 14709 B13R1.351 CC(C)C(C)COc1cnccn1 7fd0a2a2ab3248417956ea67f19e5f98 [0,2,0,0,0,0|2,0,0]=4 14710 B13R1.351 CC(C)C(C)COc1ncccn1 b23cf55e320ce6b92559fe00ebd45f5e [0,2,0,0,0,0|2,0,0]=4 14711 B13R1.351 CC(C)C(C)NCc1ccccc1 142313a2f7d26d0887806c5be339fc3b [0,2,0,0,0,0|2,0,0]=4 14712 B13R1.351 CC(C)C(C)NCc1ccccn1 2c5e267415734e735cf63257d78e0a2e [0,2,0,0,0,0|1,0,0]=3 14713 B13R1.351 CC(C)C(C)NCc1cccnn1 fd178c5a704224648e11dabff844d03d [0,2,0,0,0,0|2,0,0]=4 14714 B13R1.351 CC(C)C(C)NCc1ccncn1 54ff162ef18cf42d97d71b3b35e963ff [0,2,0,0,0,0|2,0,0]=4 14715 B13R1.351 CC(C)C(C)NCc1cnccn1 ecb8a5e8c32edc4d4d9afa0385d5104e [0,2,0,0,0,0|2,0,0]=4 14716 B13R1.351 CC(C)C(C)NCc1ncccn1 3b0b85461d2ea956f6ec75a679f9fcfd [0,2,0,0,0,0|2,0,0]=4 14717 B13R1.351 CC(C)C(C)OCc1ccccc1 f6ac7c8424cc7462871a98251037e6a5 [0,2,0,0,0,0|2,0,0]=4 14718 B13R1.351 CC(C)C(C)OCc1ccccn1 2328514736ded14da187b787e74f6b1a [0,2,0,0,0,0|1,0,0]=3 14719 B13R1.351 CC(C)C(C)OCc1cccnn1 bd8d0eb275ac32077666246a88e12b97 [0,2,0,0,0,0|2,0,0]=4 14720 B13R1.351 CC(C)C(C)OCc1ccncn1 8799635cc56d8a8b9da02eb7b8259a41 [0,2,0,0,0,0|2,0,0]=4 14721 B13R1.351 CC(C)C(C)OCc1cnccn1 c6df70dc8004c7d359bffb958851face [0,2,0,0,0,0|2,0,0]=4 14722 B13R1.351 CC(C)C(C)OCc1ncccn1 de9729c1594c6fc0a1b43bc0f5e3373a [0,2,0,0,0,0|2,0,0]=4 14723 B13R1.351 CC(C)C(O)CNc1ccccc1 c43af41f2de0b57accb18f837361cce6 [0,2,0,0,0,0|2,0,0]=4 14724 B13R1.351 CC(C)C(O)CNc1ccncn1 5c68a33254a1457d69e8bb2aff843c45 [0,2,0,0,0,0|2,0,0]=4 14725 B13R1.351 CC(C)N(C)CCc1ccccc1 fa69ff864129d862cbd0a4d3e3ae6df7 [0,2,0,0,0,0|2,0,0]=4 14726 B13R1.351 CC(C)N(C)CCc1ccccn1 a4630f64c671805da5b3a53830b01a82 [0,2,0,0,0,0|1,0,0]=3 14727 B13R1.351 CC(C)[C@@H](C)NCc1ccccc1 a81814a7c9fae523e6253d4ea79b1a0d [0,2,0,0,0,0|2,0,0]=4 14728 B13R1.351 CC(C)[C@@H](C)NCc1ccccn1 e05fddea5eee42104086f6802a0d36f9 [0,2,0,0,0,0|1,0,0]=3 14729 B13R1.351 CC(C)[C@@H](C)NCc1cccnn1 4c53a1f1c8bd197f8eeeccbfec27f562 [0,2,0,0,0,0|2,0,0]=4 14730 B13R1.351 CC(C)[C@@H](C)NCc1ccncn1 a99db1f70712736eb16327a75114ad1c [0,2,0,0,0,0|2,0,0]=4 14731 B13R1.351 CC(C)[C@@H](C)NCc1ncccn1 af74420952c07c54f9bb12ce4f273af5 [0,2,0,0,0,0|2,0,0]=4 14732 B13R1.351 CC(C)[C@@H](C)OCc1ccccc1 cd9f97d96b89e6b31731f37cf8a6c831 [0,2,0,0,0,0|2,0,0]=4 14733 B13R1.351 CC(C)[C@@H](C)OCc1ccccn1 dfbd8c0d50cccda104d0df87d55806c9 [0,2,0,0,0,0|1,0,0]=3 14734 B13R1.351 CC(C)[C@@H](C)OCc1cccnn1 a313f32271571e6feb7aa00122242843 [0,2,0,0,0,0|2,0,0]=4 14735 B13R1.351 CC(C)[C@@H](C)OCc1ccncn1 7e90aede6ed2708ba2e325b90a3ad2bc [0,2,0,0,0,0|2,0,0]=4 14736 B13R1.351 CC(C)[C@@H](C)OCc1ncccn1 7ed941af8995168506eb8f176faadf5e [0,2,0,0,0,0|2,0,0]=4 14737 B13R1.351 CC(C)[C@H](C)NCc1ccccc1 339b2cc4ebde21423bffd826744994d1 [0,2,0,0,0,0|2,0,0]=4 14738 B13R1.351 CC(C)[C@H](C)NCc1ccccn1 7c8656b4f85b492b13ffe716913537b5 [0,2,0,0,0,0|1,0,0]=3 14739 B13R1.351 CC(C)[C@H](C)NCc1cccnn1 a113faa89867a611f935b6ae20727d1a [0,2,0,0,0,0|2,0,0]=4 14740 B13R1.351 CC(C)[C@H](C)NCc1ccncn1 4f65a889b774a3a9de2841abd8e8a5e0 [0,2,0,0,0,0|2,0,0]=4 14741 B13R1.351 CC(C)[C@H](C)NCc1ncccn1 8b194ce346620bb55de1707df0f9c286 [0,2,0,0,0,0|2,0,0]=4 14742 B13R1.351 CC(C)[C@H](C)OCc1ccccc1 fa6bc0160f4ea230b00145d0a31dab0f [0,2,0,0,0,0|2,0,0]=4 14743 B13R1.351 CC(C)[C@H](C)OCc1ccccn1 97349a930f22962dbd4cb0034278917b [0,2,0,0,0,0|1,0,0]=3 14744 B13R1.351 CC(C)[C@H](C)OCc1cccnn1 59b3b895025a8dbfc0e76d5bf62a5909 [0,2,0,0,0,0|2,0,0]=4 14745 B13R1.351 CC(C)[C@H](C)OCc1ccncn1 ab95a31baecea5dafb116f5e46aaccdd [0,2,0,0,0,0|2,0,0]=4 14746 B13R1.351 CC(C)[C@H](C)OCc1ncccn1 26bb2744a31c53b6dc337562a13cec54 [0,2,0,0,0,0|2,0,0]=4 14747 B13R1.351 CC(F)C(=O)NCc1ccccn1 f25fb01649da17c01803b1c4746ae7a7 [0,2,0,0,0,0|1,0,1]=4 14748 B13R1.351 CC(O)C(=O)NCc1ccccn1 6052f0122474eca18657b5c2b9c1e3ed [0,2,0,0,0,0|1,0,1]=4 14749 B13R1.351 CC(O)C(C)NCc1ccccc1 65d85a362199dbb80eda43c8fc3b6643 [0,2,0,0,0,0|2,0,0]=4 14750 B13R1.351 CC(O)C(C)NCc1ccccn1 aad50aa3ef04ecdead624b5c6d189a36 [0,2,0,0,0,0|1,0,0]=3 14751 B13R1.351 CC(O)C(C)NCc1cccnn1 50373d2ea7fe8e4e874b2acf71345a86 [0,2,0,0,0,0|2,0,0]=4 14752 B13R1.351 CC(O)C(C)NCc1ccncn1 c72e6f8fdcf0f90c6191f841b9634396 [0,2,0,0,0,0|2,0,0]=4 14753 B13R1.351 CC(O)C(C)NCc1ncccn1 0bd3b237fb4c6711cc532c412e211df7 [0,2,0,0,0,0|2,0,0]=4 14754 B13R1.351 CC(OCc1ccccn1)C(F)F 6fcf1c90d25ee9af102ddf5b0c4dd94b [0,2,0,0,0,0|2,0,0]=4 14755 B13R1.351 CC(S)C(=O)NCc1ccccn1 e0d229f60386aaa8aa94c42031c3597b [0,2,0,0,0,0|1,0,1]=4 14756 B13R1.351 CC(S)C(C)OCc1ccccc1 a2ab11d63ea9ce7d148b484fd9bfd36a [0,2,0,0,0,0|2,0,0]=4 14757 B13R1.351 CC(S)C(C)OCc1ccccn1 5a66941feba12ffd7eaf39598de8e66a [0,2,0,0,0,0|1,0,0]=3 14758 B13R1.351 CC(S)C(C)OCc1cccnn1 335c8040c8a51c994446b0f71043ffed [0,2,0,0,0,0|2,0,0]=4 14759 B13R1.351 CC(S)C(C)OCc1ccncn1 d73ad31203e1af00001275a4dca716ee [0,2,0,0,0,0|2,0,0]=4 14760 B13R1.351 CC(S)C(C)OCc1ncccn1 9345e1046b9b27e863016889e26d4711 [0,2,0,0,0,0|2,0,0]=4 14761 B13R1.351 C[C@@H](F)C(=O)NCc1ccccn1 95b18477aef812439ec462b2a783fc46 [0,2,0,0,0,0|1,0,1]=4 14762 B13R1.351 C[C@@H](NCc1ccccn1)C(F)F c997bd7fec91b7e73d5e25cfb36a6286 [0,2,0,0,0,0|2,0,0]=4 14763 B13R1.351 C[C@@H](O)C(=O)NCc1ccccn1 c73d45ffc365bdd35db63f9eebb1511c [0,2,0,0,0,0|1,0,1]=4 14764 B13R1.351 C[C@H](F)C(=O)NCc1ccccn1 4f1e2e6ff95ec5ebb1361c96c6b4bcf1 [0,2,0,0,0,0|1,0,1]=4 14765 B13R1.351 C[C@H](NCc1ccccn1)C(F)F 772b129a01a1ab2af132d84f3dbc1ef9 [0,2,0,0,0,0|2,0,0]=4 14766 B13R1.351 C[C@H](O)C(=O)NCc1ccccn1 dfd11142e71a438fe1cb7f50da7ac7c9 [0,2,0,0,0,0|1,0,1]=4 14767 B13R1.351 OC(CNc1ccccn1)C(F)F efdbf87ab3183f5d0d8f15817be32ca0 [0,2,0,0,0,0|2,0,0]=4 14768 B13R1.417 BrCC(CBr)OCc1ccccn1 059f98569eb3507bcb8a2076c491e3ac [0,2,0,0,0,0|2,0,0]=4 14769 B13R1.417 C#CC(CC)OCc1ccccc1 fe34c6cb1fd7685cae88a1aa1b127906 [0,2,0,0,0,0|2,0,0]=4 14770 B13R1.417 C#CC(CC)OCc1ccccn1 fb2e39307b63ad4c64da0b95ad957cca [0,2,0,0,0,0|1,0,0]=3 14771 B13R1.417 C#CC(CC)OCc1cccnn1 87ef43d574d5f879df552ee51ef6f839 [0,2,0,0,0,0|2,0,0]=4 14772 B13R1.417 C#CC(CC)OCc1ccncn1 75c7047b2473cf239759681109cb793c [0,2,0,0,0,0|2,0,0]=4 14773 B13R1.417 C#CC(CC)OCc1ncccn1 739582cf5bffadad500e2b3eb6b5ef0a [0,2,0,0,0,0|2,0,0]=4 14774 B13R1.417 C=CC(CC)OCc1ccccc1 fe5beb69f4e8eaca615527027702b7a0 [0,2,0,0,0,0|2,0,0]=4 14775 B13R1.417 C=CC(CC)OCc1ccccn1 57d50b2e5e3e5a99d7258dfb1f65a117 [0,2,0,0,0,0|1,0,0]=3 14776 B13R1.417 C=CC(CC)OCc1cccnn1 dcf868749eb25c1adcd7febc6d2688b2 [0,2,0,0,0,0|2,0,0]=4 14777 B13R1.417 C=CC(CC)OCc1ccncn1 fd72358a8921c52e977f933463efe097 [0,2,0,0,0,0|2,0,0]=4 14778 B13R1.417 C=CC(CC)OCc1ncccn1 924765dd8e320514a8f55ab9881ac2fc [0,2,0,0,0,0|2,0,0]=4 14779 B13R1.417 C=C[C@@H](CO)NCc1ccccn1 f3c2e78ea2082a444be87b09943c69de [0,2,0,0,0,0|2,0,0]=4 14780 B13R1.417 CCC(C#N)OCc1ccccc1 8ae92adfb29fdb17f15d645f3cb4e7b3 [0,2,0,0,0,0|2,0,0]=4 14781 B13R1.417 CCC(C#N)OCc1ccccn1 6558324cdaac2067b037648eb07327dd [0,2,0,0,0,0|1,0,0]=3 14782 B13R1.417 CCC(C#N)OCc1cccnn1 9e36dcc58b7d71a8a22bfbd840acb560 [0,2,0,0,0,0|2,0,0]=4 14783 B13R1.417 CCC(C#N)OCc1ccncn1 29e458ac23e0c253b771e354e85ac849 [0,2,0,0,0,0|2,0,0]=4 14784 B13R1.417 CCC(C#N)OCc1ncccn1 ed99ec9b7bbf861213912d60046022f0 [0,2,0,0,0,0|2,0,0]=4 14785 B13R1.417 CCC(C=O)NCc1ccccc1 f6845985d015a5d539738c58cc946136 [0,2,0,0,0,0|2,0,0]=4 14786 B13R1.417 CCC(C=O)NCc1ccccn1 07dd8f1c47b96ea32419b7b0cf7f1060 [0,2,0,0,0,0|1,0,0]=3 14787 B13R1.417 CCC(C=O)NCc1cccnn1 a4f980f3c40b807cafb62ef31d50e37e [0,2,0,0,0,0|2,0,0]=4 14788 B13R1.417 CCC(C=O)NCc1ccncn1 c2a94d6abe3588316e77fecbf57dde27 [0,2,0,0,0,0|2,0,0]=4 14789 B13R1.417 CCC(C=O)NCc1cnccn1 a70eaa38d76fba4b6ec62adb801a3ada [0,2,0,0,0,0|2,0,0]=4 14790 B13R1.417 CCC(C=O)NCc1ncccn1 930cc41b5162c8abe60aaaf64926db4a [0,2,0,0,0,0|2,0,0]=4 14791 B13R1.417 CCC(C=O)OCc1ccccc1 7e42f954680b0457c90fa3b9a0110dd2 [0,2,0,0,0,0|2,0,0]=4 14792 B13R1.417 CCC(C=O)OCc1ccccn1 1c8d53540b06d53f83a21d95d2e3e1d8 [0,2,0,0,0,0|1,0,0]=3 14793 B13R1.417 CCC(C=O)OCc1cccnn1 ca62cec5cc26f9e083062bc9ed36c2d3 [0,2,0,0,0,0|2,0,0]=4 14794 B13R1.417 CCC(C=O)OCc1ccncn1 aef8f5def8976271784eab3b5feb6de5 [0,2,0,0,0,0|2,0,0]=4 14795 B13R1.417 CCC(C=O)OCc1cnccn1 def0272a51d7449858547a020a16d7b3 [0,2,0,0,0,0|2,0,0]=4 14796 B13R1.417 CCC(C=O)OCc1ncccn1 bc10099ba235a12c417b71325b22abb4 [0,2,0,0,0,0|2,0,0]=4 14797 B13R1.417 CCC(CC)CNc1ccccc1 74bcf58314d6623796f9ccdf533641c4 [0,2,0,0,0,0|2,0,0]=4 14798 B13R1.417 CCC(CC)CNc1ccccn1 cf426508539a126b6fb633938e94468d [0,2,0,0,0,0|1,0,0]=3 14799 B13R1.417 CCC(CC)CNc1cccnn1 da8d570fe7fb44abe3cf752c645b53c8 [0,2,0,0,0,0|2,0,0]=4 14800 B13R1.417 CCC(CC)CNc1ccncn1 f25f941a56d27bd93029212ff5c61f09 [0,2,0,0,0,0|2,0,0]=4 14801 B13R1.417 CCC(CC)CNc1cnccn1 9bf961b7ff00b874fe9d5dcfd49dd3b1 [0,2,0,0,0,0|2,0,0]=4 14802 B13R1.417 CCC(CC)CNc1ncccn1 61d4447f586e3230625b1773b51d859c [0,2,0,0,0,0|2,0,0]=4 14803 B13R1.417 CCC(CC)COc1ccccn1 b2a840405145c19438a89224af1854f9 [0,2,0,0,0,0|1,0,0]=3 14804 B13R1.417 CCC(CC)COc1cnccn1 32156cf8660cf4dd9725a5b6b2b7f02e [0,2,0,0,0,0|2,0,0]=4 14805 B13R1.417 CCC(CC)COc1ncccn1 036fb8fca0ac73b6e7eed6a4b12bdd53 [0,2,0,0,0,0|2,0,0]=4 14806 B13R1.417 CCC(CC)NCc1ccccc1 d33e44be019531a76e706befeb4676ba [0,2,0,0,0,0|2,0,0]=4 14807 B13R1.417 CCC(CC)NCc1ccccn1 e55ddfe7a23db54cecf818320240a90e [0,2,0,0,0,0|1,0,0]=3 14808 B13R1.417 CCC(CC)NCc1cccnn1 a300b6c640391b8ea9759aecc0ba6299 [0,2,0,0,0,0|2,0,0]=4 14809 B13R1.417 CCC(CC)NCc1ccncn1 1482c3fa509cf0c02c97d5cd5a6cd9f6 [0,2,0,0,0,0|2,0,0]=4 14810 B13R1.417 CCC(CC)NCc1cnccn1 3fc9f931a5374f701b4ca51aaa631669 [0,2,0,0,0,0|2,0,0]=4 14811 B13R1.417 CCC(CC)NCc1ncccn1 0660421e5a642499a0026c9bfb69c479 [0,2,0,0,0,0|2,0,0]=4 14812 B13R1.417 CCC(CC)OCc1ccccc1 f6f2f0325d2e972c2d5203c22b72617f [0,2,0,0,0,0|2,0,0]=4 14813 B13R1.417 CCC(CC)OCc1ccccn1 7f10439b10e0f80d9554bd05fba53e99 [0,2,0,0,0,0|1,0,0]=3 14814 B13R1.417 CCC(CC)OCc1cccnn1 03bc2eaa924a892aaad619e2e3ea5628 [0,2,0,0,0,0|2,0,0]=4 14815 B13R1.417 CCC(CC)OCc1ccncn1 38445e0c359f81fd76ab30f016fce70e [0,2,0,0,0,0|2,0,0]=4 14816 B13R1.417 CCC(CC)OCc1cnccn1 d5d316bda7068b33e8dd47b11365e220 [0,2,0,0,0,0|2,0,0]=4 14817 B13R1.417 CCC(CC)OCc1ncccn1 2284f51bd170b9ad1a7f7a77166cf68c [0,2,0,0,0,0|2,0,0]=4 14818 B13R1.417 CCC(CO)CNc1ccccc1 8d3946142dcc7cb6f0ee8416f963ee9b [0,2,0,0,0,0|2,0,0]=4 14819 B13R1.417 CCC(CO)CNc1ccccn1 d0c7e69a15c07331eac1bf55862bc734 [0,2,0,0,0,0|1,0,0]=3 14820 B13R1.417 CCC(CO)CNc1cccnn1 1b4066476c343110cee978b0a92546cc [0,2,0,0,0,0|2,0,0]=4 14821 B13R1.417 CCC(CO)CNc1ccncn1 c37db27b50a84fbd827a4ef93b6316c4 [0,2,0,0,0,0|2,0,0]=4 14822 B13R1.417 CCC(CO)CNc1cnccn1 4bd87ff08fe81d45cac16cf4c34afed5 [0,2,0,0,0,0|2,0,0]=4 14823 B13R1.417 CCC(CO)CNc1ncccn1 3bdb87545b54dee55149173b49a4b043 [0,2,0,0,0,0|2,0,0]=4 14824 B13R1.417 CCC(CO)NCc1ccccc1 4118611d5798d6436f95bebc393d2001 [0,2,0,0,0,0|2,0,0]=4 14825 B13R1.417 CCC(CO)NCc1ccccn1 54e94bbc8817dd47610a121294f76d79 [0,2,0,0,0,0|1,0,0]=3 14826 B13R1.417 CCC(CO)NCc1cccnn1 0135750186005a0c9b36da1965e2a493 [0,2,0,0,0,0|2,0,0]=4 14827 B13R1.417 CCC(CO)NCc1ccncn1 0d2595436c7187a1dddef1608e290afd [0,2,0,0,0,0|2,0,0]=4 14828 B13R1.417 CCC(CO)NCc1cnccn1 61bfb846ab4b7a62c94c7c3b9bb6cf97 [0,2,0,0,0,0|2,0,0]=4 14829 B13R1.417 CCC(CO)NCc1ncccn1 3e92b3e251f2dfa2cf34c9b6bb7bfa67 [0,2,0,0,0,0|2,0,0]=4 14830 B13R1.417 CCN(C=O)CCc1ccccc1 4ec660b185cec5e17670f6a60b5e65af [0,2,0,0,0,0|2,0,0]=4 14831 B13R1.417 CCN(C=O)CCc1ccccn1 7b4d8bab6e203713ecc2bedce585abee [0,2,0,0,0,0|1,0,0]=3 14832 B13R1.417 CC[C@@H](CO)NCc1ccccc1 e086dd22d9e656a2441c3cffc093f266 [0,2,0,0,0,0|2,0,0]=4 14833 B13R1.417 CC[C@@H](CO)NCc1ccccn1 908d41bd3c16389196c38ee0329caadc [0,2,0,0,0,0|1,0,0]=3 14834 B13R1.417 CC[C@@H](CO)NCc1cccnn1 4346443e8fc89898160409d379db5853 [0,2,0,0,0,0|2,0,0]=4 14835 B13R1.417 CC[C@@H](CO)NCc1ccncn1 5c436c990bac78e7762e2823ad3d29ed [0,2,0,0,0,0|2,0,0]=4 14836 B13R1.417 CC[C@@H](CO)NCc1ncccn1 66c30b3154113a8590f4148224829ef7 [0,2,0,0,0,0|2,0,0]=4 14837 B13R1.417 CC[C@H](CO)NCc1ccccc1 43a5086c23ee0a5039b6e92e77253605 [0,2,0,0,0,0|2,0,0]=4 14838 B13R1.417 CC[C@H](CO)NCc1ccccn1 6ddc6bc17a0c1ca66d888b4adf2c31f0 [0,2,0,0,0,0|1,0,0]=3 14839 B13R1.417 CC[C@H](CO)NCc1cccnn1 e9ab2105da04a271e46f6cd84a83f1e2 [0,2,0,0,0,0|2,0,0]=4 14840 B13R1.417 CC[C@H](CO)NCc1ccncn1 4d5fbaa01b3585a493b435b07b7787b9 [0,2,0,0,0,0|2,0,0]=4 14841 B13R1.417 CC[C@H](CO)NCc1ncccn1 eebacdc167ae74663efa2efce5f65bf2 [0,2,0,0,0,0|2,0,0]=4 14842 B13R1.417 COC(CNc1ccccn1)OC 5f9249e6661326ac7147fa202df30911 [0,2,0,0,0,0|2,0,0]=4 14843 B13R1.417 COC(COc1ccccn1)OC b9bc763a9e580496a1ed3fd48d2cb940 [0,2,0,0,0,0|2,0,0]=4 14844 B13R1.417 CO[C@@H](CO)CNc1ccccn1 ca712f510d0f2accbf7223c410d5e426 [0,2,0,0,0,0|2,0,0]=4 14845 B13R1.417 ClCC(CBr)OCc1ccccn1 bdec501dfae5f898a351d0655235d026 [0,2,0,0,0,0|2,0,0]=4 14846 B13R1.417 ClCC(CCl)OCc1ccccn1 0e68cfecb887617438b48ff8fee91ead [0,2,0,0,0,0|2,0,0]=4 14847 B13R1.417 ClC[C@@H](CI)OCc1ccccn1 5a608eb60e0256c8dbfdfacfa445506d [0,2,0,0,0,0|2,0,0]=4 14848 B13R1.417 ClC[C@H](CI)OCc1ccccn1 73d710449d7cb0bbe7da5aa0faaad0eb [0,2,0,0,0,0|2,0,0]=4 14849 B13R1.417 FCC(CF)OCc1ccccn1 6913c8e3833a482f052e54d80f7d0eb5 [0,2,0,0,0,0|2,0,0]=4 14850 B13R1.417 OCC(CO)CNc1ccccn1 59f81bf24cb8ea87b0fb130e105d56f0 [0,2,0,0,0,0|2,0,0]=4 14851 B13R1.417 OCC(CO)NCc1ccccn1 362396a9c6ed1d3d88523122a0ae2ced [0,2,0,0,0,0|2,0,0]=4 14852 B13R1.417 OCC(CO)OCc1ccccn1 044e7987af0d6cab292564e1a45ef887 [0,2,0,0,0,0|2,0,0]=4 14853 B13R1.528 C=C(CC)CNc1ncccc1Br 8c74cb0ad6214224e1809b14abc687af [0,2,0,0,0,0|1,0,1]=4 14854 B13R1.528 C=C(CC)CNc1ncccc1C cfd1bc74748cece3f5c518f5168aec78 [0,2,0,0,0,0|1,0,1]=4 14855 B13R1.528 C=C(CC)CNc1ncccc1Cl 17cce5e7f6b25fd9d37070a76af11730 [0,2,0,0,0,0|1,0,1]=4 14856 B13R1.528 C=C(CC)CNc1ncccc1F b5372b7a53443b43be2d2bfb23a335ca [0,2,0,0,0,0|1,0,1]=4 14857 B13R1.528 C=C(CC)CNc1ncccc1I 2ca9934c47140eaf0137400b30b1358b [0,2,0,0,0,0|1,0,1]=4 14858 B13R1.528 C=C(CC)COc1ncccc1Br bb027837cff38d950ed71650da91337e [0,2,0,0,0,0|1,0,1]=4 14859 B13R1.528 C=C(CC)COc1ncccc1C 9f4012d2b6c9f4f1d58b62665b997fd0 [0,2,0,0,0,0|1,0,1]=4 14860 B13R1.528 C=C(CC)COc1ncccc1Cl 0a08aef69b3cd1c29d7bfac7758d8436 [0,2,0,0,0,0|1,0,1]=4 14861 B13R1.528 C=C(CC)COc1ncccc1F 0a48e5b1bc7f18f853c358cd6c0ed6a4 [0,2,0,0,0,0|1,0,1]=4 14862 B13R1.528 CC(CF)OCc1ncccc1Br 52b2faddc82bee1cbf837bad037de569 [0,2,0,0,0,0|2,0,0]=4 14863 B13R1.528 CC(CF)OCc1ncccc1Cl 4c6d3e39423fb245636e2b4ae1af9eca [0,2,0,0,0,0|2,0,0]=4 14864 B13R1.528 CC(CF)OCc1ncccc1F 2efcbea8c3a9480e6d30a75fa8b10011 [0,2,0,0,0,0|2,0,0]=4 14865 B13R1.528 CC(CO)CNc1ncccc1Br 95d4ce57ec04bc6ee3d5cd33955d8558 [0,2,0,0,0,0|2,0,0]=4 14866 B13R1.528 CC(CO)CNc1ncccc1Cl 7d94d6e8f12f01c8110c2157ccb46a96 [0,2,0,0,0,0|2,0,0]=4 14867 B13R1.528 CC(CO)CNc1ncccc1F 558d35e9a982bf80125bcb1bdca20098 [0,2,0,0,0,0|2,0,0]=4 14868 B13R1.528 CC(CO)CNc1ncccc1I 8617216c948902ab6d2acea20f07f66b [0,2,0,0,0,0|2,0,0]=4 14869 B13R1.528 CC(CO)NCc1ncccc1Br 3a6f0c45fe35abec1bf9ab78d20367c5 [0,2,0,0,0,0|2,0,0]=4 14870 B13R1.528 CC(CO)NCc1ncccc1Cl 726616abccf71af24475fcbcc753ee5a [0,2,0,0,0,0|2,0,0]=4 14871 B13R1.528 CC(CO)NCc1ncccc1F 6e922b41aaf3bd868f9718ecdcc2b65e [0,2,0,0,0,0|2,0,0]=4 14872 B13R1.528 CC(CS)OCc1ncccc1Br 3d01ae66d28895aec9e042af0bb93549 [0,2,0,0,0,0|2,0,0]=4 14873 B13R1.528 CC(CS)OCc1ncccc1Cl 60a1ea54d6211595f3051e97bea3aeb1 [0,2,0,0,0,0|2,0,0]=4 14874 B13R1.528 CC(CS)OCc1ncccc1F 568fd877550ea1c26c8a43116f128cd7 [0,2,0,0,0,0|2,0,0]=4 14875 B13R1.528 CCC(=O)CNc1ncccc1Br 8f95b3e4288c2b1fa52a6663a73c02ea [0,2,0,0,0,0|1,0,1]=4 14876 B13R1.528 CCC(=O)CNc1ncccc1C da09ae114693ced832359d862ce7a52d [0,2,0,0,0,0|1,0,1]=4 14877 B13R1.528 CCC(=O)CNc1ncccc1Cl c4cbdaddce2314dbe556444f5f9f9112 [0,2,0,0,0,0|1,0,1]=4 14878 B13R1.528 CCC(=O)CNc1ncccc1F e602300e471e9ee55def0ff713fc0d08 [0,2,0,0,0,0|1,0,1]=4 14879 B13R1.528 CCC(=O)CNc1ncccc1I 45044d7cd26ceca193e9ca33e4021f2e [0,2,0,0,0,0|1,0,1]=4 14880 B13R1.528 CCC(=O)COc1ncccc1Br 6ad539e4fd898ca78cf48d0f47aeaa50 [0,2,0,0,0,0|1,0,1]=4 14881 B13R1.528 CCC(=O)COc1ncccc1C fadbe6688fcbc1a3e090c4016e3e97fe [0,2,0,0,0,0|1,0,1]=4 14882 B13R1.528 CCC(=O)COc1ncccc1Cl f79c2affde995014122944f0aca7d18c [0,2,0,0,0,0|1,0,1]=4 14883 B13R1.528 CCC(=O)COc1ncccc1F 896d4b96a489559fa1ad8458e0769f6c [0,2,0,0,0,0|1,0,1]=4 14884 B13R1.528 CCC(=O)NCc1ncccc1Br 42143ae9bc99672df8ac254e0344cf2f [0,2,0,0,0,0|1,0,1]=4 14885 B13R1.528 CCC(=O)NCc1ncccc1C e67fdddc23311447d13be026d75a621a [0,2,0,0,0,0|1,0,1]=4 14886 B13R1.528 CCC(=O)NCc1ncccc1Cl dca4e7ec6659a0afcc09d6b809f1ccff [0,2,0,0,0,0|1,0,1]=4 14887 B13R1.528 CCC(=O)NCc1ncccc1F 04623e5a14ae4ac682dda5e3ac0865df [0,2,0,0,0,0|1,0,1]=4 14888 B13R1.528 CCC(=O)NCc1ncccc1O c15dc2ad7b548948bfdacd60b4d86ebc [0,2,0,0,0,0|1,0,1]=4 14889 B13R1.528 CCC(C)CNc1cccc[n+]1[O-] 670260d730749499f3a588bf4f40ec70 [0,2,0,0,0,0|1,0,1]=4 14890 B13R1.528 CCC(C)CNc1ccccc1I da2a4209be7935461952f9708185adce [0,2,0,0,0,0|2,0,0]=4 14891 B13R1.528 CCC(C)CNc1ncccc1Br 4a184ce421dd2e62d07874c9a1e9ece7 [0,2,0,0,0,0|1,0,0]=3 14892 B13R1.528 CCC(C)CNc1ncccc1C 68eb08d053c8898d53db6c6b3638cf3b [0,2,0,0,0,0|1,0,0]=3 14893 B13R1.528 CCC(C)CNc1ncccc1Cl 31b2e82e0894df6e8e112356521129c7 [0,2,0,0,0,0|1,0,0]=3 14894 B13R1.528 CCC(C)CNc1ncccc1F 6976f9125e43e710cc24e2000d838dbb [0,2,0,0,0,0|1,0,0]=3 14895 B13R1.528 CCC(C)CNc1ncccc1I 7a1918443616b22cf4c1f001670ad910 [0,2,0,0,0,0|1,0,0]=3 14896 B13R1.528 CCC(C)CNc1nccnc1Br d51c6b9035d689f706a29168950c5c38 [0,2,0,0,0,0|2,0,0]=4 14897 B13R1.528 CCC(C)CNc1nccnc1C 21fba82973abf4f92b98e67ebb8f703c [0,2,0,0,0,0|2,0,0]=4 14898 B13R1.528 CCC(C)CNc1nccnc1Cl d9a8dbaad1f87d1de4b6d8c56ff25c75 [0,2,0,0,0,0|2,0,0]=4 14899 B13R1.528 CCC(C)CNc1nccnc1I db9237b69639569453924f8c6f5178c7 [0,2,0,0,0,0|2,0,0]=4 14900 B13R1.528 CCC(C)CNc1ncncc1Br af3276c6407a6b627d29aab82ab95bb8 [0,2,0,0,0,0|2,0,0]=4 14901 B13R1.528 CCC(C)CNc1ncncc1Cl 5d9a69e46d1866253b1540dfd792e2c3 [0,2,0,0,0,0|2,0,0]=4 14902 B13R1.528 CCC(C)CNc1ncncc1F 561962af9185730eddb45a65555776cb [0,2,0,0,0,0|2,0,0]=4 14903 B13R1.528 CCC(C)CNc1ncncc1I 88316861f38fa14f3ebf8829fc28f83a [0,2,0,0,0,0|2,0,0]=4 14904 B13R1.528 CCC(C)CNc1nnccc1C 26ab6b475c8ac3c658b766ea6c4a9f89 [0,2,0,0,0,0|2,0,0]=4 14905 B13R1.528 CCC(C)COc1cccc[n+]1[O-] 9804777b803eb314d561097f4562251d [0,2,0,0,0,0|1,0,1]=4 14906 B13R1.528 CCC(C)COc1ccccc1Br be468c4688082aa97244291df48fc2f1 [0,2,0,0,0,0|2,0,0]=4 14907 B13R1.528 CCC(C)COc1ccccc1C 3ca4bbbb3e4d5c62b65bd3dd429d8a48 [0,2,0,0,0,0|2,0,0]=4 14908 B13R1.528 CCC(C)COc1ccccc1Cl 3970120847213f1e931d3bb33e3cd2de [0,2,0,0,0,0|2,0,0]=4 14909 B13R1.528 CCC(C)COc1ccccc1F 0b1325780fc5c677b7fcc35202197667 [0,2,0,0,0,0|2,0,0]=4 14910 B13R1.528 CCC(C)COc1ccccc1I 91cbe2e377454931e940eafcd88e00b1 [0,2,0,0,0,0|2,0,0]=4 14911 B13R1.528 CCC(C)COc1ccccc1S ba95b25a29668b34fdb8dcf9b7c74324 [0,2,0,0,0,0|2,0,0]=4 14912 B13R1.528 CCC(C)COc1ncccc1Br 7da9c82c2bcee2d61b83d6317463b771 [0,2,0,0,0,0|1,0,0]=3 14913 B13R1.528 CCC(C)COc1ncccc1C c47a97f8b5feebcc355f256995e49852 [0,2,0,0,0,0|1,0,0]=3 14914 B13R1.528 CCC(C)COc1ncccc1Cl 1fb1a5643562b3915a84494acda2269e [0,2,0,0,0,0|1,0,0]=3 14915 B13R1.528 CCC(C)COc1ncccc1F 4bee247da6c62ef2bb98a640dc74c9c2 [0,2,0,0,0,0|1,0,0]=3 14916 B13R1.528 CCC(C)COc1nccnc1Br 72b0b46e0914773caca0133f0686eff4 [0,2,0,0,0,0|2,0,0]=4 14917 B13R1.528 CCC(C)COc1nccnc1C 54a32059335780a7bd0fa7f6ebe0af4f [0,2,0,0,0,0|2,0,0]=4 14918 B13R1.528 CCC(C)COc1ncncc1C 22ee5d8a4447b20f65a20f8ab33bec79 [0,2,0,0,0,0|2,0,0]=4 14919 B13R1.528 CCC(C)COc1ncncc1Cl 5a8c7ca8b054be2b38e32f70a30efd40 [0,2,0,0,0,0|2,0,0]=4 14920 B13R1.528 CCC(C)COc1ncncc1F 686a8a64c76d59c90f5e896d73427212 [0,2,0,0,0,0|2,0,0]=4 14921 B13R1.528 CCC(C)COc1ncncc1I 144806128de79f9a31c12605e35ce715 [0,2,0,0,0,0|2,0,0]=4 14922 B13R1.528 CCC(C)COc1nnccc1C 3a8e9ff4fa98eff5eee0715f68611da0 [0,2,0,0,0,0|2,0,0]=4 14923 B13R1.528 CCC(C)COc1nnccc1Cl 0829a841ca4b89d517d361ebfc57e7de [0,2,0,0,0,0|2,0,0]=4 14924 B13R1.528 CCC(C)COc1nnccc1I 2a6b836cfe6189beec86bbc92a2e9dfa [0,2,0,0,0,0|2,0,0]=4 14925 B13R1.528 CCC(C)NCc1ccccc1Cl e9f35ce50377c5d8f6fb7804e87ec8c4 [0,2,0,0,0,0|2,0,0]=4 14926 B13R1.528 CCC(C)NCc1ccccc1F 930234aa3b6099e6be59aee1e440d196 [0,2,0,0,0,0|2,0,0]=4 14927 B13R1.528 CCC(C)NCc1ccccc1I 6201fa911018c083778b247086b8cc5f [0,2,0,0,0,0|2,0,0]=4 14928 B13R1.528 CCC(C)NCc1ncccc1Br 50b69a95121a8b54a63c908117bcdb97 [0,2,0,0,0,0|1,0,0]=3 14929 B13R1.528 CCC(C)NCc1ncccc1C 291ab88470fbd6793ac30cc5940348db [0,2,0,0,0,0|1,0,0]=3 14930 B13R1.528 CCC(C)NCc1ncccc1Cl bb42a75de4f58d935b0524e9ef3de457 [0,2,0,0,0,0|1,0,0]=3 14931 B13R1.528 CCC(C)NCc1ncccc1F cd4866b4c5bee59e4a4abc1713b3ef6e [0,2,0,0,0,0|1,0,0]=3 14932 B13R1.528 CCC(C)NCc1nccnc1C 8b0bdc2d7696a37e199b5ce54905671b [0,2,0,0,0,0|2,0,0]=4 14933 B13R1.528 CCC(C)NCc1nccnc1Cl 689b37054e3be08488ff2be6f12ad241 [0,2,0,0,0,0|2,0,0]=4 14934 B13R1.528 CCC(C)NCc1nnccc1C 36f1b39499923e840bed91b933b6a0bf [0,2,0,0,0,0|2,0,0]=4 14935 B13R1.528 CCC(C)OCc1ccccc1Cl 273213ea0efd020f897b42ae4be5bc56 [0,2,0,0,0,0|2,0,0]=4 14936 B13R1.528 CCC(C)OCc1ccccc1F 746aaa2e244d53eded998e467512094c [0,2,0,0,0,0|2,0,0]=4 14937 B13R1.528 CCC(C)OCc1ccccc1I 790eb01b9b2d503f78e3fe029b15e20b [0,2,0,0,0,0|2,0,0]=4 14938 B13R1.528 CCC(C)OCc1ncccc1Br cec1ec43a5b8850f0aecefd7ab9f572a [0,2,0,0,0,0|1,0,0]=3 14939 B13R1.528 CCC(C)OCc1ncccc1C 2238d06c4643fccc923396fb85afca27 [0,2,0,0,0,0|1,0,0]=3 14940 B13R1.528 CCC(C)OCc1ncccc1Cl 7b9d8da8c278df411427224ac52ef3b3 [0,2,0,0,0,0|1,0,0]=3 14941 B13R1.528 CCC(C)OCc1ncccc1F a4694e3e1084a8bb6c0b8863d089b280 [0,2,0,0,0,0|1,0,0]=3 14942 B13R1.528 CCC(C)OCc1nccnc1C 0820c81f595bb999c2722f6a780f6d72 [0,2,0,0,0,0|2,0,0]=4 14943 B13R1.528 CCC(C)OCc1nccnc1Cl 375a3b65c4a7f98749b09db1b64309dc [0,2,0,0,0,0|2,0,0]=4 14944 B13R1.528 CCC(C)OCc1nnccc1C d0fe12cf22a2f99f75c3ebd9be4917fe [0,2,0,0,0,0|2,0,0]=4 14945 B13R1.528 CCC(O)CNc1cccc[n+]1[O-] 7225304fefb02a02e5a1250c0bd741fc [0,2,0,0,0,0|1,0,1]=4 14946 B13R1.528 CCC(O)CNc1ncccc1Br d5d2e17e36aeec1ec69ce77d8eafc7e4 [0,2,0,0,0,0|1,0,0]=3 14947 B13R1.528 CCC(O)CNc1ncccc1C c6275e77fdfe52a43e609290d73e727c [0,2,0,0,0,0|1,0,0]=3 14948 B13R1.528 CCC(O)CNc1ncccc1Cl 972b235785b4c8a92102adfd0506f911 [0,2,0,0,0,0|1,0,0]=3 14949 B13R1.528 CCC(O)CNc1ncccc1F c3fa74cebf82eb2d960fed23e8381b78 [0,2,0,0,0,0|1,0,0]=3 14950 B13R1.528 CCC(O)CNc1ncccc1I faba2326cbd137bf458ef3b3953fe081 [0,2,0,0,0,0|1,0,0]=3 14951 B13R1.528 CCC(O)CNc1nccnc1Br 6047322f8fa9cc7cd7bc8249cc01bf01 [0,2,0,0,0,0|2,0,0]=4 14952 B13R1.528 CCC(O)CNc1nccnc1C 91ff1c3f5a5edcee4a64463054b11f20 [0,2,0,0,0,0|2,0,0]=4 14953 B13R1.528 CCC(O)CNc1nccnc1Cl 51ddd5e06d0ecef831952c4d861564de [0,2,0,0,0,0|2,0,0]=4 14954 B13R1.528 CCC(O)CNc1nccnc1I 03d4b3b0e3dcdba32a66c2736875281c [0,2,0,0,0,0|2,0,0]=4 14955 B13R1.528 CCC(O)CNc1ncncc1Br 9adac9a62ccbf933a16fe39d1576f4c7 [0,2,0,0,0,0|2,0,0]=4 14956 B13R1.528 CCC(O)CNc1ncncc1Cl 8ab0bb0d6f6f0a8f792afa28517398d7 [0,2,0,0,0,0|2,0,0]=4 14957 B13R1.528 CCC(O)CNc1ncncc1F 65e14daa543ecce0476b7531dcd370c9 [0,2,0,0,0,0|2,0,0]=4 14958 B13R1.528 CCC(O)CNc1ncncc1I f406daafd4b1140069ae82f39b953bed [0,2,0,0,0,0|2,0,0]=4 14959 B13R1.528 CCC(O)CNc1nnccc1C 7a1d68d44f7bfef2a5600a4456f5b71b [0,2,0,0,0,0|2,0,0]=4 14960 B13R1.528 CCN(C)CCc1ccccc1Cl 0b7b018dd99fadc94260acca4951f5ca [0,2,0,0,0,0|2,0,0]=4 14961 B13R1.528 CCN(C)CCc1ccccc1F 39511dfd45df33723f980b9eb3212e00 [0,2,0,0,0,0|2,0,0]=4 14962 B13R1.528 CCN(C)CCc1ccccc1I 9c0a1cb495618bdea05d12c51443ed8d [0,2,0,0,0,0|2,0,0]=4 14963 B13R1.528 CC[C@@H](C)CNc1cccc[n+]1[O-] bc103353ea111a4d7ab93b88b3ee0317 [0,2,0,0,0,0|1,0,1]=4 14964 B13R1.528 CC[C@@H](C)CNc1ccccc1I d5c8ed1bcd37723931163610c8647156 [0,2,0,0,0,0|2,0,0]=4 14965 B13R1.528 CC[C@@H](C)CNc1ncccc1Br e9854d2f9cdafedbc161487f7ffd9822 [0,2,0,0,0,0|1,0,0]=3 14966 B13R1.528 CC[C@@H](C)CNc1ncccc1C 4f1a372c64d832773dac1dc5614391c6 [0,2,0,0,0,0|1,0,0]=3 14967 B13R1.528 CC[C@@H](C)CNc1ncccc1Cl bd39c41f91344c5c673488f65818f9e3 [0,2,0,0,0,0|1,0,0]=3 14968 B13R1.528 CC[C@@H](C)CNc1ncccc1F 56b4758962ab0a101d0a5ff6f33864f4 [0,2,0,0,0,0|1,0,0]=3 14969 B13R1.528 CC[C@@H](C)CNc1ncccc1I f951d8c6921f7b0357e24bc02196ef61 [0,2,0,0,0,0|1,0,0]=3 14970 B13R1.528 CC[C@@H](C)CNc1nccnc1Br 865439a6963f4607233cacdc04cc9ed6 [0,2,0,0,0,0|2,0,0]=4 14971 B13R1.528 CC[C@@H](C)CNc1nccnc1C 8c1f96812e26f0f0a6c4a4edcb7d5aa9 [0,2,0,0,0,0|2,0,0]=4 14972 B13R1.528 CC[C@@H](C)CNc1nccnc1Cl 32629e801746306c710c22334c354781 [0,2,0,0,0,0|2,0,0]=4 14973 B13R1.528 CC[C@@H](C)CNc1nccnc1I d12ffe9d9e5c49ae7d12cce7b3b0d5a8 [0,2,0,0,0,0|2,0,0]=4 14974 B13R1.528 CC[C@@H](C)CNc1ncncc1Br 17fc22922549180037b5eaf07ec9a351 [0,2,0,0,0,0|2,0,0]=4 14975 B13R1.528 CC[C@@H](C)CNc1ncncc1Cl 56c42e3a0b098223c35f43fbef1744ea [0,2,0,0,0,0|2,0,0]=4 14976 B13R1.528 CC[C@@H](C)CNc1ncncc1F 6d47a44d23a42fe1eef82d1b912ad8e6 [0,2,0,0,0,0|2,0,0]=4 14977 B13R1.528 CC[C@@H](C)CNc1ncncc1I e65f1c0ca91615fafef01631a63fb926 [0,2,0,0,0,0|2,0,0]=4 14978 B13R1.528 CC[C@@H](C)CNc1nnccc1C fe511778ac4a4fd4a48fd07746f84aec [0,2,0,0,0,0|2,0,0]=4 14979 B13R1.528 CC[C@@H](C)COc1cccc[n+]1[O-] d08dcfbfb56a9042e705b0f058412548 [0,2,0,0,0,0|1,0,1]=4 14980 B13R1.528 CC[C@@H](C)COc1ccccc1Cl 9f5555c4fefa06059761378daa45251a [0,2,0,0,0,0|2,0,0]=4 14981 B13R1.528 CC[C@@H](C)COc1ncccc1Br 36999003c5a10c938d00b69bdb595afb [0,2,0,0,0,0|1,0,0]=3 14982 B13R1.528 CC[C@@H](C)COc1ncccc1C 6b094b74210c003386539da52b808769 [0,2,0,0,0,0|1,0,0]=3 14983 B13R1.528 CC[C@@H](C)COc1ncccc1Cl 64b757a2454713af1d0b8ffaf380b2bc [0,2,0,0,0,0|1,0,0]=3 14984 B13R1.528 CC[C@@H](C)COc1ncccc1F e14341cbfb1e6450fb96b6d7e64c8ccf [0,2,0,0,0,0|1,0,0]=3 14985 B13R1.528 CC[C@@H](C)COc1nccnc1Br 1179eadacff9515e0324fcdb3b39ea10 [0,2,0,0,0,0|2,0,0]=4 14986 B13R1.528 CC[C@@H](C)COc1nccnc1C e4a1edb717dec7ab2ae07120a1791e5b [0,2,0,0,0,0|2,0,0]=4 14987 B13R1.528 CC[C@@H](C)COc1ncncc1C 5b967b58edebcfac1d9c315c1b1d13c9 [0,2,0,0,0,0|2,0,0]=4 14988 B13R1.528 CC[C@@H](C)COc1ncncc1Cl 71f09c2d50dadd641679b1196cb4336d [0,2,0,0,0,0|2,0,0]=4 14989 B13R1.528 CC[C@@H](C)COc1ncncc1F 3f1cb5fbc2c116f0c3d41bec1d634ffb [0,2,0,0,0,0|2,0,0]=4 14990 B13R1.528 CC[C@@H](C)COc1ncncc1I e39e875c504fa3d47e4bd95c792efef3 [0,2,0,0,0,0|2,0,0]=4 14991 B13R1.528 CC[C@@H](C)COc1nnccc1C 6e7c75d26d28559ab112d433ea9e11d3 [0,2,0,0,0,0|2,0,0]=4 14992 B13R1.528 CC[C@@H](C)COc1nnccc1Cl 4644628aa5e2880ae036ab82ffb6d532 [0,2,0,0,0,0|2,0,0]=4 14993 B13R1.528 CC[C@@H](C)COc1nnccc1I d5347727099246ccded41cd1b60fbffe [0,2,0,0,0,0|2,0,0]=4 14994 B13R1.528 CC[C@@H](C)NCc1ccccc1Cl 0c017ba2bb15145809dccb9d2970b923 [0,2,0,0,0,0|2,0,0]=4 14995 B13R1.528 CC[C@@H](C)NCc1ccccc1F 8420fe95780578d950e2c44d89987299 [0,2,0,0,0,0|2,0,0]=4 14996 B13R1.528 CC[C@@H](C)NCc1ccccc1I f6dc7c4d85d6fe4d33d147c028ef9142 [0,2,0,0,0,0|2,0,0]=4 14997 B13R1.528 CC[C@@H](C)NCc1ncccc1Br 6b5da27f2ba8d9c902dd9e417645bd20 [0,2,0,0,0,0|1,0,0]=3 14998 B13R1.528 CC[C@@H](C)NCc1ncccc1C 48d7629c3dcd6bcc98f95b1e10cadf7f [0,2,0,0,0,0|1,0,0]=3 14999 B13R1.528 CC[C@@H](C)NCc1ncccc1Cl 51c8969c3f30a75600d3c368d16b69a3 [0,2,0,0,0,0|1,0,0]=3 15000 B13R1.528 CC[C@@H](C)NCc1ncccc1F 6eefa961c71de6fe74332c31a700cf35 [0,2,0,0,0,0|1,0,0]=3 15001 B13R1.528 CC[C@@H](C)NCc1nccnc1C feeed6d64ca7daea02e94d5ab11487f6 [0,2,0,0,0,0|2,0,0]=4 15002 B13R1.528 CC[C@@H](C)OCc1ccccc1Cl 5be53b86e01b2b097f1b2400c7677048 [0,2,0,0,0,0|2,0,0]=4 15003 B13R1.528 CC[C@@H](C)OCc1ccccc1F 2a58101c18e478e509b77ff748280dad [0,2,0,0,0,0|2,0,0]=4 15004 B13R1.528 CC[C@@H](C)OCc1ccccc1I cf64934f09fe791c3f79992d4c0a0b88 [0,2,0,0,0,0|2,0,0]=4 15005 B13R1.528 CC[C@@H](C)OCc1ncccc1Br ff41af346ca108611aa73b1f193a67f5 [0,2,0,0,0,0|1,0,0]=3 15006 B13R1.528 CC[C@@H](C)OCc1ncccc1C 4c74cb75a96444ffd8fae676178179c7 [0,2,0,0,0,0|1,0,0]=3 15007 B13R1.528 CC[C@@H](C)OCc1ncccc1Cl 850fa7992485df74ace9a7bc6c36c3ce [0,2,0,0,0,0|1,0,0]=3 15008 B13R1.528 CC[C@@H](C)OCc1ncccc1F c09c0b09b234ab6cb8a69af6358d050b [0,2,0,0,0,0|1,0,0]=3 15009 B13R1.528 CC[C@@H](C)OCc1nccnc1C 0230c94ae6c728eeedd3ad8a9f35b83b [0,2,0,0,0,0|2,0,0]=4 15010 B13R1.528 CC[C@@H](C)OCc1nccnc1Cl 7a5b69aed8985649242b2d853e25e650 [0,2,0,0,0,0|2,0,0]=4 15011 B13R1.528 CC[C@@H](O)CNc1cccc[n+]1[O-] 3449b63facb0163618ccf444d58b03f1 [0,2,0,0,0,0|1,0,1]=4 15012 B13R1.528 CC[C@H](C)CNc1cccc[n+]1[O-] de7b02bd021cde4e212ca8922feb374b [0,2,0,0,0,0|1,0,1]=4 15013 B13R1.528 CC[C@H](C)CNc1ccccc1I 646c3e3a07de10c38b24a9cd80346bfd [0,2,0,0,0,0|2,0,0]=4 15014 B13R1.528 CC[C@H](C)CNc1ncccc1Br d32f66f12619bdf05730097d4e7ecd2c [0,2,0,0,0,0|1,0,0]=3 15015 B13R1.528 CC[C@H](C)CNc1ncccc1C 9901d12d0a525e5999f218cd2b355b8f [0,2,0,0,0,0|1,0,0]=3 15016 B13R1.528 CC[C@H](C)CNc1ncccc1Cl 43129dce425af6606644da2fb90bd02e [0,2,0,0,0,0|1,0,0]=3 15017 B13R1.528 CC[C@H](C)CNc1ncccc1F 93428cd05c597c10b0f02d9265c76080 [0,2,0,0,0,0|1,0,0]=3 15018 B13R1.528 CC[C@H](C)CNc1ncccc1I 0622096ad172e7dfb796d7ef4b31e8e7 [0,2,0,0,0,0|1,0,0]=3 15019 B13R1.528 CC[C@H](C)CNc1nccnc1Br bd11bc4a8864b03b97a644c801d8f076 [0,2,0,0,0,0|2,0,0]=4 15020 B13R1.528 CC[C@H](C)CNc1nccnc1C d7c8f9c4ccb550c0d76540773aaa66c1 [0,2,0,0,0,0|2,0,0]=4 15021 B13R1.528 CC[C@H](C)CNc1nccnc1Cl 19ea2d62d2da312a4e6b420fbe7c2bdd [0,2,0,0,0,0|2,0,0]=4 15022 B13R1.528 CC[C@H](C)CNc1nccnc1I 69b2f6657a574bde151bb11bff804346 [0,2,0,0,0,0|2,0,0]=4 15023 B13R1.528 CC[C@H](C)CNc1ncncc1Br a08eb5c0f8792bde9737d02391c21ad6 [0,2,0,0,0,0|2,0,0]=4 15024 B13R1.528 CC[C@H](C)CNc1ncncc1Cl 55e83e7acf3bb1f066e95d26e74d9dbc [0,2,0,0,0,0|2,0,0]=4 15025 B13R1.528 CC[C@H](C)CNc1ncncc1F 832d60b6a09bcf11bbe0702cd1f3546a [0,2,0,0,0,0|2,0,0]=4 15026 B13R1.528 CC[C@H](C)CNc1ncncc1I 7d91d82e2f76f326d39d353537606bfe [0,2,0,0,0,0|2,0,0]=4 15027 B13R1.528 CC[C@H](C)CNc1nnccc1C a15b40a9a09f7eb157327b71530627c4 [0,2,0,0,0,0|2,0,0]=4 15028 B13R1.528 CC[C@H](C)COc1cccc[n+]1[O-] 5f22371418f581f18157220ac2bd116e [0,2,0,0,0,0|1,0,1]=4 15029 B13R1.528 CC[C@H](C)COc1ccccc1Br 012ef2ac47102873d9452a76da9fd0c4 [0,2,0,0,0,0|2,0,0]=4 15030 B13R1.528 CC[C@H](C)COc1ccccc1C edfa8f0687cd472303bfba84eaac57cf [0,2,0,0,0,0|2,0,0]=4 15031 B13R1.528 CC[C@H](C)COc1ccccc1Cl 7c1d96b827a646d50205661df131409c [0,2,0,0,0,0|2,0,0]=4 15032 B13R1.528 CC[C@H](C)COc1ccccc1F db9a7c8dc55b2ae247032e0f14958b44 [0,2,0,0,0,0|2,0,0]=4 15033 B13R1.528 CC[C@H](C)COc1ccccc1I 9f7228b34bd7e3238c85bd59ac323b08 [0,2,0,0,0,0|2,0,0]=4 15034 B13R1.528 CC[C@H](C)COc1ccccc1S 47201981302e4494b26c822b51a9a6c3 [0,2,0,0,0,0|2,0,0]=4 15035 B13R1.528 CC[C@H](C)COc1ncccc1Br df8d119c408cfd534a343fd781edbaa0 [0,2,0,0,0,0|1,0,0]=3 15036 B13R1.528 CC[C@H](C)COc1ncccc1C fe6936aa98a0a35627ac7f04ab487029 [0,2,0,0,0,0|1,0,0]=3 15037 B13R1.528 CC[C@H](C)COc1ncccc1Cl c87a732e674013c5144d4eead86c3990 [0,2,0,0,0,0|1,0,0]=3 15038 B13R1.528 CC[C@H](C)COc1ncccc1F 38664e73fef2190df6b5d331b4c064ee [0,2,0,0,0,0|1,0,0]=3 15039 B13R1.528 CC[C@H](C)COc1nccnc1Br e5d46f254b8d873597b39bebed55f16c [0,2,0,0,0,0|2,0,0]=4 15040 B13R1.528 CC[C@H](C)COc1nccnc1C 1cef5b215f968cc2e2240edd989545fa [0,2,0,0,0,0|2,0,0]=4 15041 B13R1.528 CC[C@H](C)COc1ncncc1C 142f73bb2307e02a85d70d7521d85e80 [0,2,0,0,0,0|2,0,0]=4 15042 B13R1.528 CC[C@H](C)COc1ncncc1Cl c9c7d8e3a8f1082e15fefaf0f24f0eac [0,2,0,0,0,0|2,0,0]=4 15043 B13R1.528 CC[C@H](C)COc1ncncc1F 4fa25ce9e9d6aa3d80410a657b16a8a2 [0,2,0,0,0,0|2,0,0]=4 15044 B13R1.528 CC[C@H](C)COc1ncncc1I 0c650847d959ac892889af8463356671 [0,2,0,0,0,0|2,0,0]=4 15045 B13R1.528 CC[C@H](C)COc1nnccc1C 0b0f33a3f436b779cfd01ef5abe98900 [0,2,0,0,0,0|2,0,0]=4 15046 B13R1.528 CC[C@H](C)COc1nnccc1Cl 43f3545b3039a024f2bcc5325ad8051b [0,2,0,0,0,0|2,0,0]=4 15047 B13R1.528 CC[C@H](C)COc1nnccc1I d680236e7b65c99f58e58d24ffb84326 [0,2,0,0,0,0|2,0,0]=4 15048 B13R1.528 CC[C@H](C)NCc1ccccc1Cl a4f80632964b44be81866a3bffd62d91 [0,2,0,0,0,0|2,0,0]=4 15049 B13R1.528 CC[C@H](C)NCc1ccccc1F 09de97e535d114110419f7d261aa912b [0,2,0,0,0,0|2,0,0]=4 15050 B13R1.528 CC[C@H](C)NCc1ccccc1I f6c24968358a14edd478c0751458d552 [0,2,0,0,0,0|2,0,0]=4 15051 B13R1.528 CC[C@H](C)NCc1ncccc1Br 1bbe8483e89f79483b9a5127260e54b7 [0,2,0,0,0,0|1,0,0]=3 15052 B13R1.528 CC[C@H](C)NCc1ncccc1C 18d8fef77701a4105882c94d0d1964da [0,2,0,0,0,0|1,0,0]=3 15053 B13R1.528 CC[C@H](C)NCc1ncccc1Cl babbb997da4728831521fe849a049be1 [0,2,0,0,0,0|1,0,0]=3 15054 B13R1.528 CC[C@H](C)NCc1ncccc1F 32c394d05b8afff4671f2f99bec6a0ba [0,2,0,0,0,0|1,0,0]=3 15055 B13R1.528 CC[C@H](C)NCc1nccnc1C 1ec0b9f4cd92847ac6927bc0eff442c7 [0,2,0,0,0,0|2,0,0]=4 15056 B13R1.528 CC[C@H](C)OCc1ccccc1Cl e1fd7513c32f75cac75294991d030676 [0,2,0,0,0,0|2,0,0]=4 15057 B13R1.528 CC[C@H](C)OCc1ccccc1F 92da9e3b11a2a4b8b75412a428d39a2f [0,2,0,0,0,0|2,0,0]=4 15058 B13R1.528 CC[C@H](C)OCc1ccccc1I 8b8c302321da51f37e6fba36b4220d15 [0,2,0,0,0,0|2,0,0]=4 15059 B13R1.528 CC[C@H](C)OCc1ncccc1Br 10624b29abccd3ee822b8fc695a681ca [0,2,0,0,0,0|1,0,0]=3 15060 B13R1.528 CC[C@H](C)OCc1ncccc1C c04670b1aa8a1673e057a3ed3753dd26 [0,2,0,0,0,0|1,0,0]=3 15061 B13R1.528 CC[C@H](C)OCc1ncccc1Cl b90a54846e6db5c993de7b31b8ae0dfd [0,2,0,0,0,0|1,0,0]=3 15062 B13R1.528 CC[C@H](C)OCc1ncccc1F db68c9e6fd73c5cb872c88b9a1fb09c7 [0,2,0,0,0,0|1,0,0]=3 15063 B13R1.528 CC[C@H](C)OCc1nccnc1C 9f8a7ea2032727263cebce7f906d45d0 [0,2,0,0,0,0|2,0,0]=4 15064 B13R1.528 CC[C@H](C)OCc1nccnc1Cl cad471e73517d324e2dd05b0033395a0 [0,2,0,0,0,0|2,0,0]=4 15065 B13R1.528 COC(C)CNc1ncccc1Br be58729593795edb35aa68d2c74681ae [0,2,0,0,0,0|2,0,0]=4 15066 B13R1.528 COC(C)CNc1ncccc1C 8dbe86699cdfa85d562e19aeeb6d97ba [0,2,0,0,0,0|2,0,0]=4 15067 B13R1.528 COC(C)CNc1ncccc1Cl 5447ba4c93be31177ef15c1cc7e18609 [0,2,0,0,0,0|2,0,0]=4 15068 B13R1.528 COC(C)CNc1ncccc1F 00dfeca57e5ac4976d65acca97fc1b15 [0,2,0,0,0,0|2,0,0]=4 15069 B13R1.528 COC(C)CNc1ncccc1I c41c9747f175e9630e9bff24e2fc5319 [0,2,0,0,0,0|2,0,0]=4 15070 B13R1.528 COC(C)COc1ncccc1Br 857a1e4af7c1c272b3094f5bf8c82aa8 [0,2,0,0,0,0|2,0,0]=4 15071 B13R1.528 COC(C)COc1ncccc1C 36cc91f8e0b5b8d1b9adefb9b722f7fb [0,2,0,0,0,0|2,0,0]=4 15072 B13R1.528 COC(C)COc1ncccc1Cl d6362cdb9388f7edccb255b5ef3ba20b [0,2,0,0,0,0|2,0,0]=4 15073 B13R1.528 COC(C)COc1ncccc1F c9c46a62c5e2a0e0f4b23b7ef14a3452 [0,2,0,0,0,0|2,0,0]=4 15074 B13R1.528 CO[C@@H](C)CNc1ncccc1Br c9ab6467b4aee544e40f1617dd2d389a [0,2,0,0,0,0|2,0,0]=4 15075 B13R1.528 CO[C@@H](C)CNc1ncccc1C b6c524b6a84099cb6cefe22631d87c8a [0,2,0,0,0,0|2,0,0]=4 15076 B13R1.528 CO[C@@H](C)CNc1ncccc1Cl d2c04a33965feaa66523f8b66b5847a3 [0,2,0,0,0,0|2,0,0]=4 15077 B13R1.528 CO[C@@H](C)CNc1ncccc1F 56bbb3b2fd50ffe943b1a80ebee51683 [0,2,0,0,0,0|2,0,0]=4 15078 B13R1.528 CO[C@@H](C)CNc1ncccc1I d0b2e3cd2a8e509bc4fbf6f8eaa54b1b [0,2,0,0,0,0|2,0,0]=4 15079 B13R1.528 CO[C@@H](C)COc1ncccc1Br 8d29f9079f0fb92e48cc6d23994c5331 [0,2,0,0,0,0|2,0,0]=4 15080 B13R1.528 CO[C@@H](C)COc1ncccc1C e2c111f847f18e09da03af73dbc00ec2 [0,2,0,0,0,0|2,0,0]=4 15081 B13R1.528 CO[C@@H](C)COc1ncccc1Cl fea4d660e068169658290289b8f70a97 [0,2,0,0,0,0|2,0,0]=4 15082 B13R1.528 CO[C@@H](C)COc1ncccc1F 2fd0554afd872c70a9e5e3c342317a2b [0,2,0,0,0,0|2,0,0]=4 15083 B13R1.528 CO[C@H](C)CNc1ncccc1Br 500121ad0e207d09a96f5217a63896dc [0,2,0,0,0,0|2,0,0]=4 15084 B13R1.528 CO[C@H](C)CNc1ncccc1C 99a0bf645eece2f615c64c02bbac427c [0,2,0,0,0,0|2,0,0]=4 15085 B13R1.528 CO[C@H](C)CNc1ncccc1Cl 2167299702d6af3da71faec19c012c8c [0,2,0,0,0,0|2,0,0]=4 15086 B13R1.528 CO[C@H](C)CNc1ncccc1F 93cd9b5af46368052f62d3adca702d07 [0,2,0,0,0,0|2,0,0]=4 15087 B13R1.528 CO[C@H](C)CNc1ncccc1I 51b593a56c4610a2e72ab0f1579b6bbb [0,2,0,0,0,0|2,0,0]=4 15088 B13R1.528 CO[C@H](C)COc1ncccc1Br 3883a2d3ca32927da77553ab5e5ae56d [0,2,0,0,0,0|2,0,0]=4 15089 B13R1.528 CO[C@H](C)COc1ncccc1C 5be11aaff374f7c1c4d11c5cb93e9738 [0,2,0,0,0,0|2,0,0]=4 15090 B13R1.528 CO[C@H](C)COc1ncccc1Cl b587041d4c4bbb96b86b4464d7eb4ec2 [0,2,0,0,0,0|2,0,0]=4 15091 B13R1.528 CO[C@H](C)COc1ncccc1F 3e43a42cc0155add2a0f2d0a40b71cbb [0,2,0,0,0,0|2,0,0]=4 15092 B13R1.528 C[C@@H](CO)CNc1ncccc1Br 9f8d3d96f3d9ca1bff82c0e932a4a83d [0,2,0,0,0,0|2,0,0]=4 15093 B13R1.528 C[C@@H](CO)CNc1ncccc1Cl 0f77c29d5270c7c2c3306253907ccc56 [0,2,0,0,0,0|2,0,0]=4 15094 B13R1.528 C[C@@H](CO)CNc1ncccc1F 191e6d14566cd83836a5d2717e5fdfef [0,2,0,0,0,0|2,0,0]=4 15095 B13R1.528 C[C@@H](CO)CNc1ncccc1I 724f75f2609d7f75e18d98273e740064 [0,2,0,0,0,0|2,0,0]=4 15096 B13R1.528 C[C@@H](CO)NCc1ncccc1Br 2cf2fc103f4790d3b2aa05aafcd10a71 [0,2,0,0,0,0|2,0,0]=4 15097 B13R1.528 C[C@@H](CO)NCc1ncccc1Cl f0f26c7d59aeafc8e5e7805a85970db4 [0,2,0,0,0,0|2,0,0]=4 15098 B13R1.528 C[C@@H](CO)NCc1ncccc1F 1b193dd8ea157cce620c22aa1a68b231 [0,2,0,0,0,0|2,0,0]=4 15099 B13R1.528 C[C@H](CO)CNc1ncccc1Br ccabcc0e1aab1499b260918767d5df00 [0,2,0,0,0,0|2,0,0]=4 15100 B13R1.528 C[C@H](CO)CNc1ncccc1Cl 167050899bb87b8aaf85e8468f5d630c [0,2,0,0,0,0|2,0,0]=4 15101 B13R1.528 C[C@H](CO)CNc1ncccc1F 693778e67fc480c0bdd48e0eb8b20627 [0,2,0,0,0,0|2,0,0]=4 15102 B13R1.528 C[C@H](CO)CNc1ncccc1I 11b6ddfa64c24d09f3787bb5d01c6703 [0,2,0,0,0,0|2,0,0]=4 15103 B13R1.528 C[C@H](CO)NCc1ncccc1Br d057f4ada48c0067f50e833729812575 [0,2,0,0,0,0|2,0,0]=4 15104 B13R1.528 C[C@H](CO)NCc1ncccc1Cl 833d3c681038b75e82f43bd653f68af5 [0,2,0,0,0,0|2,0,0]=4 15105 B13R1.528 C[C@H](CO)NCc1ncccc1F 146e005e18002c53571c9a93ae453c62 [0,2,0,0,0,0|2,0,0]=4 15106 B13R1.528 C[C@H](CS)OCc1ncccc1Br 3426b9066f16a921ba27056c70a0bc0d [0,2,0,0,0,0|2,0,0]=4 15107 B13R1.528 C[C@H](CS)OCc1ncccc1Cl 8073264e06f337bb0aabc68063142c05 [0,2,0,0,0,0|2,0,0]=4 15108 B13R1.528 C[C@H](CS)OCc1ncccc1F 0abd5cfbcd68bec247890878b40c04e8 [0,2,0,0,0,0|2,0,0]=4 15109 B13R1.528 Cc1cccnc1CNC(C)CO 1d46c95ac567300ad164cff63a588b05 [0,2,0,0,0,0|2,0,0]=4 15110 B13R1.528 Cc1cccnc1CN[C@@H](C)CO 24c9c8f875ec7823d48c3968183c028f [0,2,0,0,0,0|2,0,0]=4 15111 B13R1.528 Cc1cccnc1CN[C@H](C)CO 58dc286f5fae3db4658f4891bd38662b [0,2,0,0,0,0|2,0,0]=4 15112 B13R1.528 Cc1cccnc1COC(C)CF 1954ca16250915b2ae4eb75323a1623f [0,2,0,0,0,0|2,0,0]=4 15113 B13R1.528 Cc1cccnc1COC(C)CS f40d37bbb3f5e5a0c230888fe28f157c [0,2,0,0,0,0|2,0,0]=4 15114 B13R1.528 Cc1cccnc1CO[C@H](C)CS 6a10150669a919dbc81de7d79fc919d5 [0,2,0,0,0,0|2,0,0]=4 15115 B13R1.528 Cc1cccnc1NCC(C)CO 6371fa286ef02078c4ba1fe0ea529451 [0,2,0,0,0,0|2,0,0]=4 15116 B13R1.528 Cc1cccnc1NCC(F)CO e838fc9854f25117072355986b8df8e8 [0,2,0,0,0,0|2,0,0]=4 15117 B13R1.528 Cc1cccnc1NCC(O)CF ebce4fddb2625d972d7dd7fe0824c3a5 [0,2,0,0,0,0|2,0,0]=4 15118 B13R1.528 Cc1cccnc1NCC(O)CO 862c8cb3c9b9feea8001af6ad886625b [0,2,0,0,0,0|2,0,0]=4 15119 B13R1.528 Cc1cccnc1NC[C@@H](C)CO 46b980252c8a23b215ad4fc3b67eb94c [0,2,0,0,0,0|2,0,0]=4 15120 B13R1.528 Cc1cccnc1NC[C@@H](F)CO f9666e0d0f513d69050266c1072a9286 [0,2,0,0,0,0|2,0,0]=4 15121 B13R1.528 Cc1cccnc1NC[C@@H](O)CO 41bb84f1c69d7b50dcd4721c526e5635 [0,2,0,0,0,0|2,0,0]=4 15122 B13R1.528 Cc1cccnc1NC[C@H](C)CO 4f74fd02e16562014dab18755b84d723 [0,2,0,0,0,0|2,0,0]=4 15123 B13R1.528 Cc1cccnc1NC[C@H](F)CO 8c9f886a2f86f6489cdfb3ffec45db35 [0,2,0,0,0,0|2,0,0]=4 15124 B13R1.528 Cc1cccnc1NC[C@H](O)CO b1817467384d1ec63144376591ddb9b1 [0,2,0,0,0,0|2,0,0]=4 15125 B13R1.528 Cc1cccnc1OCC(O)CO ce3c7147befb801bdac172c2fe04ee76 [0,2,0,0,0,0|2,0,0]=4 15126 B13R1.528 Cc1cccnc1OC[C@@H](O)CO 95db5ba0aded032395f2a87bea4c249a [0,2,0,0,0,0|2,0,0]=4 15127 B13R1.528 Cc1cccnc1OC[C@H](O)CO 11ab74b09c14adcc43b99ec2689c0138 [0,2,0,0,0,0|2,0,0]=4 15128 B13R1.528 OC(CF)CNc1ncccc1Br 5155edee3bb99b42d949333e50667ded [0,2,0,0,0,0|2,0,0]=4 15129 B13R1.528 OC(CF)CNc1ncccc1Cl db2380f1c967e8e24fdc5e69fb85a482 [0,2,0,0,0,0|2,0,0]=4 15130 B13R1.528 OC(CF)CNc1ncccc1F 79ddedeb5d16ef1314d2fa0f06672280 [0,2,0,0,0,0|2,0,0]=4 15131 B13R1.528 OC(CF)CNc1ncccc1I 3e9aa85d4a24b9568f279091cca86294 [0,2,0,0,0,0|2,0,0]=4 15132 B13R1.528 OCC(F)CNc1ncccc1F 9671ad98ada34dffb9ea20e329b675ea [0,2,0,0,0,0|2,0,0]=4 15133 B13R1.528 OCC(F)CNc1ncccc1O c75d6fe6a4226cebe68ab6ac215e6635 [0,2,0,0,0,0|2,0,0]=4 15134 B13R1.528 OCC(O)CNc1ncccc1Br 4c4602edc11f1a38c65d48820a2427b8 [0,2,0,0,0,0|2,0,0]=4 15135 B13R1.528 OCC(O)CNc1ncccc1Cl 9bbf91a4b028b9585087f519df2ebe7b [0,2,0,0,0,0|2,0,0]=4 15136 B13R1.528 OCC(O)CNc1ncccc1F c3cc06a65b8213d5548a3786d148488a [0,2,0,0,0,0|2,0,0]=4 15137 B13R1.528 OCC(O)CNc1ncccc1I 514637d30df4240ea0a335c15c5c1d75 [0,2,0,0,0,0|2,0,0]=4 15138 B13R1.528 OCC(O)COc1ncccc1Br 2160a8db2b5cedaa8ca8153e23247dd0 [0,2,0,0,0,0|2,0,0]=4 15139 B13R1.528 OCC(O)COc1ncccc1Cl 315996cee090073ae9e42cfb701d7121 [0,2,0,0,0,0|2,0,0]=4 15140 B13R1.528 OCC(O)COc1ncccc1F 006814c9e495209e8fdce80425747c6c [0,2,0,0,0,0|2,0,0]=4 15141 B13R1.528 OC[C@@H](F)CNc1ncccc1F 2e4f095bd0f1c82ae04409d0ffe20b4e [0,2,0,0,0,0|2,0,0]=4 15142 B13R1.528 OC[C@@H](F)CNc1ncccc1O 8a107feaf48cbdd40786d88b80067ae4 [0,2,0,0,0,0|2,0,0]=4 15143 B13R1.528 OC[C@@H](O)CNc1ncccc1Br bf3684f6869f562a0dfcb349d976b3d9 [0,2,0,0,0,0|2,0,0]=4 15144 B13R1.528 OC[C@@H](O)CNc1ncccc1Cl dff5f8dfe5432591b560d1e3d42fed89 [0,2,0,0,0,0|2,0,0]=4 15145 B13R1.528 OC[C@@H](O)CNc1ncccc1F 996798d268e5cbc771cea60db03ffda9 [0,2,0,0,0,0|2,0,0]=4 15146 B13R1.528 OC[C@@H](O)CNc1ncccc1I 0bd28ecb4432543c27bbb93b19eeff39 [0,2,0,0,0,0|2,0,0]=4 15147 B13R1.528 OC[C@@H](O)COc1ncccc1Br 0c0ccc687052d8b07b0a7abc74f3729e [0,2,0,0,0,0|2,0,0]=4 15148 B13R1.528 OC[C@@H](O)COc1ncccc1Cl d4401387a4125d2d184da2ce7c602008 [0,2,0,0,0,0|2,0,0]=4 15149 B13R1.528 OC[C@@H](O)COc1ncccc1F 10e12dfccd118a1d09ee4ff137cfd551 [0,2,0,0,0,0|2,0,0]=4 15150 B13R1.528 OC[C@H](F)CNc1ncccc1F 3ffdfb64362daeb142ac3a464d22d7cc [0,2,0,0,0,0|2,0,0]=4 15151 B13R1.528 OC[C@H](F)CNc1ncccc1O 717d048432f7565db4778f206a691675 [0,2,0,0,0,0|2,0,0]=4 15152 B13R1.528 OC[C@H](O)CNc1ncccc1Br 9362c2dd574319aba1006d0f10b5197b [0,2,0,0,0,0|2,0,0]=4 15153 B13R1.528 OC[C@H](O)CNc1ncccc1Cl 6fcd653c32c9593e80239d6534002a4b [0,2,0,0,0,0|2,0,0]=4 15154 B13R1.528 OC[C@H](O)CNc1ncccc1F 331daff4447f5ab2a23eb01f2827889f [0,2,0,0,0,0|2,0,0]=4 15155 B13R1.528 OC[C@H](O)CNc1ncccc1I 91e953d2d8e23b7b26a1bf09fa287e4f [0,2,0,0,0,0|2,0,0]=4 15156 B13R1.528 OC[C@H](O)COc1ncccc1Br fb41c64b1295bb8c2f6400b8355ef014 [0,2,0,0,0,0|2,0,0]=4 15157 B13R1.528 OC[C@H](O)COc1ncccc1Cl ab1927155cf665bb750e74488c768c95 [0,2,0,0,0,0|2,0,0]=4 15158 B13R1.528 OC[C@H](O)COc1ncccc1F e25b9568921b0aa550a87349dc5245ef [0,2,0,0,0,0|2,0,0]=4 15159 B13R1.16 CCCCNc1cccc(=O)n1C 5129980bfa7bff27f88d7a19b9c563d4 [0,2,0,0,0,0|1,0,1]=4 15160 B13R1.16 CCCCNc1cccc([n+]1[O-])C e3d8978d7c330808cf17ac896e69ea7f [0,2,0,0,0,0|1,0,1]=4 15161 B13R1.16 CCCCNc1cccc(c1Br)C adec029d51234ea1d864f0d63145782a [0,2,0,0,0,0|2,0,0]=4 15162 B13R1.16 CCCCNc1cccc(c1Br)Cl e351606d7fd4c5aaf014f82a8745cb47 [0,2,0,0,0,0|2,0,0]=4 15163 B13R1.16 CCCCNc1cccc(c1Br)F af8d80c5f44cf6736a7b271d7e9368ca [0,2,0,0,0,0|2,0,0]=4 15164 B13R1.16 CCCCNc1cccc(c1Br)I 2982afc8fa105d65c3a33e51833ba6a6 [0,2,0,0,0,0|2,0,0]=4 15165 B13R1.16 CCCCNc1cccc(c1C)C 153a2250aa1fd35c78d1cf18921e6244 [0,2,0,0,0,0|2,0,0]=4 15166 B13R1.16 CCCCNc1cccc(c1C)Cl 53649a400ec374dcb032d6f5f0aebb9b [0,2,0,0,0,0|2,0,0]=4 15167 B13R1.16 CCCCNc1cccc(c1C)F 863612d3114b4134393c0b1f06ec832e [0,2,0,0,0,0|2,0,0]=4 15168 B13R1.16 CCCCNc1cccc(c1C)I 02a671ebb42bc4d8857ec57318bc1369 [0,2,0,0,0,0|2,0,0]=4 15169 B13R1.16 CCCCNc1cccc(c1Cl)C 239c067dbe3bb2d5550396023c14e123 [0,2,0,0,0,0|2,0,0]=4 15170 B13R1.16 CCCCNc1cccc(c1Cl)Cl ca368dd181cfeb8645719fb1373517b4 [0,2,0,0,0,0|2,0,0]=4 15171 B13R1.16 CCCCNc1cccc(c1Cl)F 30fda0467dc186fc3bfea276dfb075d6 [0,2,0,0,0,0|2,0,0]=4 15172 B13R1.16 CCCCNc1cccc(c1Cl)I 8605ee303dd8b0fcdbf9cc6dea865489 [0,2,0,0,0,0|2,0,0]=4 15173 B13R1.16 CCCCNc1cccc(c1F)C 8e5fd0af73d8afb062ac51e6ba8c0f13 [0,2,0,0,0,0|2,0,0]=4 15174 B13R1.16 CCCCNc1cccc(c1F)Cl 93b1f601515de61ccae5e5f62f84c3d0 [0,2,0,0,0,0|2,0,0]=4 15175 B13R1.16 CCCCNc1cccc(c1F)F 6f4af8263ee98bc7393c2a66f6bfc2dd [0,2,0,0,0,0|2,0,0]=4 15176 B13R1.16 CCCCNc1cccc(c1F)I 6e4ba32e8cb51e701c280f12352fe986 [0,2,0,0,0,0|2,0,0]=4 15177 B13R1.16 CCCCNc1cccc(c1I)C f4837082dae85bcda4a39bf9aaf87f34 [0,2,0,0,0,0|2,0,0]=4 15178 B13R1.16 CCCCNc1cccc(c1I)Cl 7ab44f220a564783742b83e855d43a90 [0,2,0,0,0,0|2,0,0]=4 15179 B13R1.16 CCCCNc1cccc(c1I)F 8c6c5d1dc205bb813d6b06eb55ab8067 [0,2,0,0,0,0|2,0,0]=4 15180 B13R1.16 CCCCNc1cccc(c1N)N 8529a09e6ddc194e9c9cd198dff7a9ca [0,2,0,0,0,0|2,0,0]=4 15181 B13R1.16 CCCCNc1nc[nH]c(=O)c1Br d2ae8ea920d6112d48e40c65503b3b30 [0,2,0,0,0,0|2,0,0]=4 15182 B13R1.16 CCCCNc1nccc(c1Br)Br b54abae34475fd826e63a98c158a304d [0,2,0,0,0,0|1,0,0]=3 15183 B13R1.16 CCCCNc1nccc(c1Br)C 280f46775dc5a2e6ae356c45d72c4c1f [0,2,0,0,0,0|1,0,0]=3 15184 B13R1.16 CCCCNc1nccc(c1Br)Cl 8e5d3dacb6322eb37efb83b42683a8c0 [0,2,0,0,0,0|1,0,0]=3 15185 B13R1.16 CCCCNc1nccc(c1Br)F 4bed6100edaf9438799b4d25158f7d69 [0,2,0,0,0,0|1,0,0]=3 15186 B13R1.16 CCCCNc1nccc(c1C)Br 2bb49b33daa5e7a24c2ca9fbbb553c49 [0,2,0,0,0,0|1,0,0]=3 15187 B13R1.16 CCCCNc1nccc(c1C)C 88eca5b037a0288f664b2bfe5eddf0af [0,2,0,0,0,0|1,0,0]=3 15188 B13R1.16 CCCCNc1nccc(c1C)Cl d9fcb376c70e3ffa99ebf29b19e08593 [0,2,0,0,0,0|1,0,0]=3 15189 B13R1.16 CCCCNc1nccc(c1C)F 9e1a5e6af515af745d7f39452e1743f3 [0,2,0,0,0,0|1,0,0]=3 15190 B13R1.16 CCCCNc1nccc(c1C)I d63416b844e95b711e38f0a6ba22f1d1 [0,2,0,0,0,0|1,0,0]=3 15191 B13R1.16 CCCCNc1nccc(c1Cl)Br 94bbc515cf89108ee3407cbb0d40e850 [0,2,0,0,0,0|1,0,0]=3 15192 B13R1.16 CCCCNc1nccc(c1Cl)C 1d45f4e4bcee0f32682a00c250a27d72 [0,2,0,0,0,0|1,0,0]=3 15193 B13R1.16 CCCCNc1nccc(c1Cl)Cl 843a4e0a893a894cbaba95fa92623253 [0,2,0,0,0,0|1,0,0]=3 15194 B13R1.16 CCCCNc1nccc(c1Cl)I 06221dd8c18efe1adb4e1955b0175381 [0,2,0,0,0,0|1,0,0]=3 15195 B13R1.16 CCCCNc1nccc(c1Cl)S 97608efb2268bd7e5404d7b672490f91 [0,2,0,0,0,0|1,0,0]=3 15196 B13R1.16 CCCCNc1nccc(c1F)Br 3b4b0d733b7b89488c15ac8fcca86fd3 [0,2,0,0,0,0|1,0,0]=3 15197 B13R1.16 CCCCNc1nccc(c1F)C b594177c45cf15540f517118a4812875 [0,2,0,0,0,0|1,0,0]=3 15198 B13R1.16 CCCCNc1nccc(c1F)Cl 7f3529a578793b23e14d5a76b6902776 [0,2,0,0,0,0|1,0,0]=3 15199 B13R1.16 CCCCNc1nccc(c1F)F 598e01478ee02701853764013c8589e4 [0,2,0,0,0,0|1,0,0]=3 15200 B13R1.16 CCCCNc1nccc(c1F)I 639a9c27e895b45d602980076c0c8195 [0,2,0,0,0,0|1,0,0]=3 15201 B13R1.16 CCCCNc1nccc(c1I)Br 5ecf0b5cf9c02737cfccb67e10220ee4 [0,2,0,0,0,0|1,0,0]=3 15202 B13R1.16 CCCCNc1nccc(c1I)C f46ce0a49ab4f077bfbb5d3ceb0a71b5 [0,2,0,0,0,0|1,0,0]=3 15203 B13R1.16 CCCCNc1nccc(c1I)Cl 1972f030232f259d3f8cfc719dfe7315 [0,2,0,0,0,0|1,0,0]=3 15204 B13R1.16 CCCCNc1nccc(c1N)N b8c343f246104778a8f7f2b0a97605be [0,2,0,0,0,0|1,0,0]=3 15205 B13R1.16 CCCCNc1nccc(c1O)F 658dda02e86c11d8d3e3250867498f05 [0,2,0,0,0,0|1,0,0]=3 15206 B13R1.16 CCCCNc1nccn(c1=O)C b0d36120c114025ab2ec69e303e05e7e [0,2,0,0,0,0|2,0,0]=4 15207 B13R1.16 CCCCNc1ncnc(c1Br)C d386cea02d9096045a4c6ffc0ce1fb28 [0,2,0,0,0,0|2,0,0]=4 15208 B13R1.16 CCCCNc1ncnc(c1Br)Cl f738d56b65b7a70bc1aae52015aa0092 [0,2,0,0,0,0|2,0,0]=4 15209 B13R1.16 CCCCNc1ncnc(c1C)C fb82f2b72c2b498126fe730bd7bb6cfd [0,2,0,0,0,0|2,0,0]=4 15210 B13R1.16 CCCCNc1ncnc(c1C)Cl 973c592da6851ebb9fecff70bdcd6888 [0,2,0,0,0,0|2,0,0]=4 15211 B13R1.16 CCCCNc1ncnc(c1C)F dfa5a209c6cc53bfe36c9e13e0fc9c23 [0,2,0,0,0,0|2,0,0]=4 15212 B13R1.16 CCCCNc1ncnc(c1Cl)C f17fee620235241da4208e1260affc9b [0,2,0,0,0,0|2,0,0]=4 15213 B13R1.16 CCCCNc1ncnc(c1Cl)Cl eb6c26fb830e19a959fc9407279acc3c [0,2,0,0,0,0|2,0,0]=4 15214 B13R1.16 CCCCNc1ncnc(c1F)Cl 342a882fd7ebfe1a8cfe8c463bf10b24 [0,2,0,0,0,0|2,0,0]=4 15215 B13R1.16 CCCCNc1ncnc(c1I)C 8c8641962880e95f0f2e7cdee14362be [0,2,0,0,0,0|2,0,0]=4 15216 B13R1.16 CCCCNc1ncnc(c1I)Cl 37136b198c59170437356d74c395cd49 [0,2,0,0,0,0|2,0,0]=4 15217 B13R1.16 CCCCNc1ncnc(c1N)N 674b923837a9e7ce2d044d3d328cf2b3 [0,2,0,0,0,0|2,0,0]=4 15218 B13R1.16 CCCCOc1cccc(c1Br)Br 137b2d37f17023ef8628de7872a79933 [0,2,0,0,0,0|2,0,0]=4 15219 B13R1.16 CCCCOc1cccc(c1Br)C dec9702f516528a2beb313d82de53ac3 [0,2,0,0,0,0|2,0,0]=4 15220 B13R1.16 CCCCOc1cccc(c1Br)Cl fc1a8d5a8a8e61ce37adbf9f8efa4f29 [0,2,0,0,0,0|2,0,0]=4 15221 B13R1.16 CCCCOc1cccc(c1Br)F bcd47adf7372434ff94e464026e618f8 [0,2,0,0,0,0|2,0,0]=4 15222 B13R1.16 CCCCOc1cccc(c1Br)I 8101fb1b02bdaee21eb9897a3944ce3a [0,2,0,0,0,0|2,0,0]=4 15223 B13R1.16 CCCCOc1cccc(c1C)Br f6e132aa16b4ae166baf47f99b6e0307 [0,2,0,0,0,0|2,0,0]=4 15224 B13R1.16 CCCCOc1cccc(c1C)C 6891ac1d0f59ac3c4c941240302dbb5b [0,2,0,0,0,0|2,0,0]=4 15225 B13R1.16 CCCCOc1cccc(c1C)Cl 1835afa9aa253586ccbe39bbcb3471ea [0,2,0,0,0,0|2,0,0]=4 15226 B13R1.16 CCCCOc1cccc(c1C)F 458c662bccb724eed48652340c323e9f [0,2,0,0,0,0|2,0,0]=4 15227 B13R1.16 CCCCOc1cccc(c1C)I c997dc46feefed758b1a959523b7df28 [0,2,0,0,0,0|2,0,0]=4 15228 B13R1.16 CCCCOc1cccc(c1Cl)Br ebbae902ac064c733a930ab551454a08 [0,2,0,0,0,0|2,0,0]=4 15229 B13R1.16 CCCCOc1cccc(c1Cl)C b7f3b4792c71d1a55f8b57f1e82ad2c7 [0,2,0,0,0,0|2,0,0]=4 15230 B13R1.16 CCCCOc1cccc(c1Cl)Cl d57b8b086d94bc351eedc9f212b52714 [0,2,0,0,0,0|2,0,0]=4 15231 B13R1.16 CCCCOc1cccc(c1Cl)F 210201e0f00d1fce1804739eb9829608 [0,2,0,0,0,0|2,0,0]=4 15232 B13R1.16 CCCCOc1cccc(c1Cl)I 751279883c9404ce11a0397b9473173a [0,2,0,0,0,0|2,0,0]=4 15233 B13R1.16 CCCCOc1cccc(c1F)C 32bf80bd2187003e862c5aace2b24e61 [0,2,0,0,0,0|2,0,0]=4 15234 B13R1.16 CCCCOc1cccc(c1F)Cl 18863bf7c967cd9bd6bd9b72effa3e4b [0,2,0,0,0,0|2,0,0]=4 15235 B13R1.16 CCCCOc1cccc(c1F)F 25e44936a10a1ced96b945fad593ac4c [0,2,0,0,0,0|2,0,0]=4 15236 B13R1.16 CCCCOc1cccc(c1F)I f12a79b724cfe2b1de06a12c3a74ae8d [0,2,0,0,0,0|2,0,0]=4 15237 B13R1.16 CCCCOc1cccc(c1I)Br 104fabbe22c7b27bbc3ec9e84c771b3c [0,2,0,0,0,0|2,0,0]=4 15238 B13R1.16 CCCCOc1cccc(c1I)C f7af76dee92945ddf88615d1688352b2 [0,2,0,0,0,0|2,0,0]=4 15239 B13R1.16 CCCCOc1cccc(c1I)Cl 546587a555c925c24e68adb1b04934a2 [0,2,0,0,0,0|2,0,0]=4 15240 B13R1.16 CCCCOc1cccc(c1I)F 0f084d97c1b07d0eebe4457dca7c92a1 [0,2,0,0,0,0|2,0,0]=4 15241 B13R1.16 CCCCOc1nc[nH]c(=O)c1I 188cb3a57451a841416d183d437ba673 [0,2,0,0,0,0|2,0,0]=4 15242 B13R1.16 CCCCOc1nccc(c1Br)C e3c370bc5bfc4f9ad94e716680b95fbb [0,2,0,0,0,0|1,0,0]=3 15243 B13R1.16 CCCCOc1nccc(c1C)Br 780e27a402385bceb6161b13616a64c2 [0,2,0,0,0,0|1,0,0]=3 15244 B13R1.16 CCCCOc1nccc(c1C)C 398df1ed74110db504672c7fb6a24679 [0,2,0,0,0,0|1,0,0]=3 15245 B13R1.16 CCCCOc1nccc(c1C)Cl 699809dd92f11a5fdbdd938f72e861c2 [0,2,0,0,0,0|1,0,0]=3 15246 B13R1.16 CCCCOc1nccc(c1C)I adb62b829e7e8b316710d0035d48bded [0,2,0,0,0,0|1,0,0]=3 15247 B13R1.16 CCCCOc1nccc(c1Cl)Br 7961f8fab706db7f9226b08356528864 [0,2,0,0,0,0|1,0,0]=3 15248 B13R1.16 CCCCOc1nccc(c1F)I 63a4e320b9ebe66cb1dec8909a825656 [0,2,0,0,0,0|1,0,0]=3 15249 B13R1.16 CCCCOc1nccc(c1I)Cl 9283bcd85532dbc1e196a5e3a73dd0a5 [0,2,0,0,0,0|1,0,0]=3 15250 B13R1.16 CCCCOc1ncnc(c1Br)C e5a3bb627af196403a60b9e4b8f11222 [0,2,0,0,0,0|2,0,0]=4 15251 B13R1.16 CCCCOc1ncnc(c1C)C 8c2af1070e5f77d11cbcc206854aa71b [0,2,0,0,0,0|2,0,0]=4 15252 B13R1.16 CCCCOc1ncnc(c1C)Cl e23a79ff7f01c3fb525706f8384e9dc2 [0,2,0,0,0,0|2,0,0]=4 15253 B13R1.16 CCCCOc1ncnc(c1Cl)C be5f55a5d50c44c8b6258c23aa89f30c [0,2,0,0,0,0|2,0,0]=4 15254 B13R1.16 CCCCOc1ncnc(c1Cl)Cl 31c7e86264fcc5c1d2d8453837d54082 [0,2,0,0,0,0|2,0,0]=4 15255 B13R1.16 CCCCOc1ncnc(c1F)C 76893d2d310c77fa6ad23ab837925a7c [0,2,0,0,0,0|2,0,0]=4 15256 B13R1.16 CCCCOc1ncnc(c1I)C efdb4279eca18062680481dde1583369 [0,2,0,0,0,0|2,0,0]=4 15257 B13R1.16 CCCNCc1cccc(c1Br)Br 3e5f70255e501d408e5b6ccaf5486738 [0,2,0,0,0,0|2,0,0]=4 15258 B13R1.16 CCCNCc1cccc(c1Br)C 7b94a927955fba0c5749026f9879757b [0,2,0,0,0,0|2,0,0]=4 15259 B13R1.16 CCCNCc1cccc(c1Br)Cl 57769c7aac06218934411c39293a4898 [0,2,0,0,0,0|2,0,0]=4 15260 B13R1.16 CCCNCc1cccc(c1Br)F aa7297cbf586cef4668a61545a04bc5d [0,2,0,0,0,0|2,0,0]=4 15261 B13R1.16 CCCNCc1cccc(c1Br)I 2e544c137d182f50881ecf0924c820be [0,2,0,0,0,0|2,0,0]=4 15262 B13R1.16 CCCNCc1cccc(c1C)Br 172c01ca04840b304ecf4f61f82ff59c [0,2,0,0,0,0|2,0,0]=4 15263 B13R1.16 CCCNCc1cccc(c1C)C 684d667f262289b80c7458504e13ee5d [0,2,0,0,0,0|2,0,0]=4 15264 B13R1.16 CCCNCc1cccc(c1C)Cl 67c5f59ccd5ce6c0718d60461979e810 [0,2,0,0,0,0|2,0,0]=4 15265 B13R1.16 CCCNCc1cccc(c1C)F 1389a10b990db903e66e652d19da3763 [0,2,0,0,0,0|2,0,0]=4 15266 B13R1.16 CCCNCc1cccc(c1C)I 3f250131dd3cded0dfc1155ba8b1a0be [0,2,0,0,0,0|2,0,0]=4 15267 B13R1.16 CCCNCc1cccc(c1Cl)Br 6be4cbfc12ad26f6fe06c916ef3e11c4 [0,2,0,0,0,0|2,0,0]=4 15268 B13R1.16 CCCNCc1cccc(c1Cl)C 561aac70fe6ec73bc0c71925f3b66aac [0,2,0,0,0,0|2,0,0]=4 15269 B13R1.16 CCCNCc1cccc(c1Cl)Cl c36ecb15a46108966d0a9f1c1caae4d9 [0,2,0,0,0,0|2,0,0]=4 15270 B13R1.16 CCCNCc1cccc(c1Cl)F 6cfcd3e5b088244195382fc66819fad3 [0,2,0,0,0,0|2,0,0]=4 15271 B13R1.16 CCCNCc1cccc(c1Cl)I 59a7f00b8a2c3e8cb34d28fe9ae228bf [0,2,0,0,0,0|2,0,0]=4 15272 B13R1.16 CCCNCc1cccc(c1F)Br a1db7c2fff26460ab85cb7c0eef806c5 [0,2,0,0,0,0|2,0,0]=4 15273 B13R1.16 CCCNCc1cccc(c1F)C bd44cb856d4e3514d5727035c0b31026 [0,2,0,0,0,0|2,0,0]=4 15274 B13R1.16 CCCNCc1cccc(c1F)Cl dfcb1ec566ad7c5d32e70cec7799cea0 [0,2,0,0,0,0|2,0,0]=4 15275 B13R1.16 CCCNCc1cccc(c1F)F 64308c5472dce59a7119da293843cf3e [0,2,0,0,0,0|2,0,0]=4 15276 B13R1.16 CCCNCc1cccc(c1F)I cedd2188a8c17edaa990019f9aff3dca [0,2,0,0,0,0|2,0,0]=4 15277 B13R1.16 CCCNCc1cccc(c1I)Br 1b7520c34ed9e17fb15c5b2173e2cd26 [0,2,0,0,0,0|2,0,0]=4 15278 B13R1.16 CCCNCc1cccc(c1I)F b3997a07ff19ff45858430e70f576f2b [0,2,0,0,0,0|2,0,0]=4 15279 B13R1.16 CCCNCc1nccc(=O)n1C d576b7963594eb539e170e0940a11589 [0,2,0,0,0,0|2,0,0]=4 15280 B13R1.16 CCCNCc1nccc(c1F)C a76e092329706ac1eafbe956d31923f7 [0,2,0,0,0,0|1,0,0]=3 15281 B13R1.16 CCCNCc1nccc(c1F)Cl d92cc51ecda32d89a56c1b3382ee6b7d [0,2,0,0,0,0|1,0,0]=3 15282 B13R1.16 CCCOCc1cccc(=O)n1C e66cf0b38279f46d9d19a68d4d2d9887 [0,2,0,0,0,0|1,0,1]=4 15283 B13R1.16 CCCOCc1cccc(c1Br)Br 17d7e94782d7d8ad0362d7c519bcfc70 [0,2,0,0,0,0|2,0,0]=4 15284 B13R1.16 CCCOCc1cccc(c1Br)C 4d5efaec03486af637e4f1a3cde38338 [0,2,0,0,0,0|2,0,0]=4 15285 B13R1.16 CCCOCc1cccc(c1Br)Cl 750f4686592ed56b6a472a15165d7fb7 [0,2,0,0,0,0|2,0,0]=4 15286 B13R1.16 CCCOCc1cccc(c1Br)F ef35ccd5004abc03c7e3e5ac68f66879 [0,2,0,0,0,0|2,0,0]=4 15287 B13R1.16 CCCOCc1cccc(c1Br)I db5e49863ab08871656df9a432630d5a [0,2,0,0,0,0|2,0,0]=4 15288 B13R1.16 CCCOCc1cccc(c1C)Br f53941e7d89f226f7a02b59cd8d6d85e [0,2,0,0,0,0|2,0,0]=4 15289 B13R1.16 CCCOCc1cccc(c1C)C 206db1bc551282295d7d6b54b95980ab [0,2,0,0,0,0|2,0,0]=4 15290 B13R1.16 CCCOCc1cccc(c1C)Cl 5dcfc29f1abc3cd863cd3e82243d3aa3 [0,2,0,0,0,0|2,0,0]=4 15291 B13R1.16 CCCOCc1cccc(c1C)F 82f156ac7209b0c2ef7a4e000c6101ae [0,2,0,0,0,0|2,0,0]=4 15292 B13R1.16 CCCOCc1cccc(c1C)I b575121a8eb5f0c13e28d9010a8bc907 [0,2,0,0,0,0|2,0,0]=4 15293 B13R1.16 CCCOCc1cccc(c1Cl)Br 7ea74e13cbf55d542167f25784814090 [0,2,0,0,0,0|2,0,0]=4 15294 B13R1.16 CCCOCc1cccc(c1Cl)C a73960d5f84808bec6076c0962d2489f [0,2,0,0,0,0|2,0,0]=4 15295 B13R1.16 CCCOCc1cccc(c1Cl)Cl c5d5f9403a36bd831f8d9330d3e94032 [0,2,0,0,0,0|2,0,0]=4 15296 B13R1.16 CCCOCc1cccc(c1Cl)F 293d2c2ff390a3f559aa7134e744d43c [0,2,0,0,0,0|2,0,0]=4 15297 B13R1.16 CCCOCc1cccc(c1Cl)I 39b790762d63ccb6ddbe823a94e9185c [0,2,0,0,0,0|2,0,0]=4 15298 B13R1.16 CCCOCc1cccc(c1F)Br 89fbac18d21ea6f27e6882d9dbe55ced [0,2,0,0,0,0|2,0,0]=4 15299 B13R1.16 CCCOCc1cccc(c1F)C fb383238f794a29c66bac7ea3f6b1d3b [0,2,0,0,0,0|2,0,0]=4 15300 B13R1.16 CCCOCc1cccc(c1F)Cl 7cb08f0c314d4aa0941ccf8c57bb06d9 [0,2,0,0,0,0|2,0,0]=4 15301 B13R1.16 CCCOCc1cccc(c1F)F e46938a88cea7ce890c459f97f24e586 [0,2,0,0,0,0|2,0,0]=4 15302 B13R1.16 CCCOCc1cccc(c1F)I 9bf75cb4b28493b369e97c8992f41e92 [0,2,0,0,0,0|2,0,0]=4 15303 B13R1.16 CCCOCc1cccc(c1I)Br b1abbdced52f4e00382f00ecadddcddd [0,2,0,0,0,0|2,0,0]=4 15304 B13R1.16 CCCOCc1cccc(c1I)C 0e2359c71f652f82febd53a3a0c455d4 [0,2,0,0,0,0|2,0,0]=4 15305 B13R1.16 CCCOCc1cccc(c1I)F d01919f430744a752f408c6360d35914 [0,2,0,0,0,0|2,0,0]=4 15306 B13R1.16 CCCOCc1nccc(c1Br)C db7fea24eee5242381671b6081b69f6c [0,2,0,0,0,0|1,0,0]=3 15307 B13R1.16 CCCOCc1nccc(c1C)Br d5a865f81270c4b8a72faf59a48e5826 [0,2,0,0,0,0|1,0,0]=3 15308 B13R1.16 CCCOCc1nccc(c1C)Cl 6aa0f5442bdb6ce1568fea8ed72200c4 [0,2,0,0,0,0|1,0,0]=3 15309 B13R1.16 CCCOCc1nccc(c1Cl)Cl 933231f6e9ef4165943bebada0fc1c03 [0,2,0,0,0,0|1,0,0]=3 15310 B13R1.16 CCNCCc1cccc(c1Cl)Cl fbb315cec8da86b4c362f7544ccd6e89 [0,2,0,0,0,0|2,0,0]=4 15311 B13R1.16 CCOCCc1cccc(c1Br)C 22578a2699150d441a9f9b79916d454f [0,2,0,0,0,0|2,0,0]=4 15312 B13R1.16 CCOCCc1cccc(c1Cl)Cl f9c83daba8ed1789c3cb14497eedfa53 [0,2,0,0,0,0|2,0,0]=4 15313 B13R1.16 CCOCCc1cccc(c1F)Cl 8a45ca6cae97dc463ae3bddf9f754814 [0,2,0,0,0,0|2,0,0]=4 15314 B13R1.16 CCOCCc1cccc(c1F)F a901d94cc8db6ce7a66b001295df835e [0,2,0,0,0,0|2,0,0]=4 15315 B13R1.16 CCOCNc1nccc(c1Br)C 32835fc5b7ab5ddf1f8c858531b852b8 [0,2,0,0,0,0|2,0,0]=4 15316 B13R1.16 CCOCNc1nccc(c1Br)Cl d47185413a31ec6e43514306a121d8d4 [0,2,0,0,0,0|2,0,0]=4 15317 B13R1.16 CCOCNc1nccc(c1Br)F 85e765ce2486f35f981014ae0f349c83 [0,2,0,0,0,0|2,0,0]=4 15318 B13R1.16 CCOCNc1nccc(c1C)C db012eaab6828a66d7332695e362b1e5 [0,2,0,0,0,0|2,0,0]=4 15319 B13R1.16 CCOCNc1nccc(c1C)Cl 3c41ba0c039622fa34ac328cb9b42f3c [0,2,0,0,0,0|2,0,0]=4 15320 B13R1.16 CCOCNc1nccc(c1C)F 57926f3cae934dbc53f594817106ffc7 [0,2,0,0,0,0|2,0,0]=4 15321 B13R1.16 CCOCNc1nccc(c1C)I c65e9ea21c750f514a9201b637eeb67e [0,2,0,0,0,0|2,0,0]=4 15322 B13R1.16 CCOCNc1nccc(c1Cl)C 3f084afdd1f8546d75af7cebd83c2626 [0,2,0,0,0,0|2,0,0]=4 15323 B13R1.16 CCOCNc1nccc(c1Cl)Cl 89614ef438d5c31404148581e38a2d4e [0,2,0,0,0,0|2,0,0]=4 15324 B13R1.16 CCOCNc1nccc(c1F)C 52233052449f8d8d39c627d14f700fa3 [0,2,0,0,0,0|2,0,0]=4 15325 B13R1.16 CCOCNc1nccc(c1F)Cl acb4e567e8c4eecb02461ec2b8f8863c [0,2,0,0,0,0|2,0,0]=4 15326 B13R1.16 CCOCNc1nccc(c1F)F b12703ff47540845997652215aeb2746 [0,2,0,0,0,0|2,0,0]=4 15327 B13R1.16 CCOCNc1nccc(c1F)I ee994604769d388e48dbca768d964838 [0,2,0,0,0,0|2,0,0]=4 15328 B13R1.16 CCOCNc1nccc(c1I)Br 3d939c8bfbb59c5a398247f76d5174d6 [0,2,0,0,0,0|2,0,0]=4 15329 B13R1.16 CCOCNc1nccc(c1I)C 5d2c5906192ad668d3bcaadda701cf21 [0,2,0,0,0,0|2,0,0]=4 15330 B13R1.16 CCOCNc1nccc(c1I)Cl c0d3d682454371edfd8d0ad7274ef32f [0,2,0,0,0,0|2,0,0]=4 15331 B13R1.16 CCOCOc1nccc(c1Br)C bde8f16d5f54ad4eea7b68888fb1ffce [0,2,0,0,0,0|2,0,0]=4 15332 B13R1.16 CCOCOc1nccc(c1C)Br 5d150b2f17fa637d29416d11f7fc9b51 [0,2,0,0,0,0|2,0,0]=4 15333 B13R1.16 CCOCOc1nccc(c1C)C ff8e4bc251e26331e575876cb08eb4e2 [0,2,0,0,0,0|2,0,0]=4 15334 B13R1.16 CCOCOc1nccc(c1C)Cl 2d8d733d4c5afef9f0540d3c5dc5d598 [0,2,0,0,0,0|2,0,0]=4 15335 B13R1.16 CCOCOc1nccc(c1C)I 661ae1c88d016e94d2ae32acaa08e4a6 [0,2,0,0,0,0|2,0,0]=4 15336 B13R1.16 CCOCOc1nccc(c1F)I 625f1736aef96433e4abd2ae19f5301d [0,2,0,0,0,0|2,0,0]=4 15337 B13R1.16 CCOCOc1nccc(c1I)Cl f3560c6c573b1dc7f3a03b1bd8825391 [0,2,0,0,0,0|2,0,0]=4 15338 B13R1.16 COCCNc1nccc(c1Br)Br ff475fe21360c8dc7236b5aa78ff69fb [0,2,0,0,0,0|2,0,0]=4 15339 B13R1.16 COCCNc1nccc(c1Br)C 55cfa3dccbe0d44203253821bab7db68 [0,2,0,0,0,0|2,0,0]=4 15340 B13R1.16 COCCNc1nccc(c1Br)Cl 6e2cea1f0d2edb64b808ffe5ac841ec8 [0,2,0,0,0,0|2,0,0]=4 15341 B13R1.16 COCCNc1nccc(c1Br)F 001942370567bd26af8c79dbcf922264 [0,2,0,0,0,0|2,0,0]=4 15342 B13R1.16 COCCNc1nccc(c1C)Br c040d34f83023a7b9bb2e836db8fbe41 [0,2,0,0,0,0|2,0,0]=4 15343 B13R1.16 COCCNc1nccc(c1C)C 844ed3dd6bf4534aaf68440d0f97c002 [0,2,0,0,0,0|2,0,0]=4 15344 B13R1.16 COCCNc1nccc(c1C)Cl e53eccef15d36d87bcaf8e71f0f4efc5 [0,2,0,0,0,0|2,0,0]=4 15345 B13R1.16 COCCNc1nccc(c1C)F 2b07ad0b40b19323a97b9ba1f271cd70 [0,2,0,0,0,0|2,0,0]=4 15346 B13R1.16 COCCNc1nccc(c1C)I 4eb0ba361f6029bbbd9c2a70c1a5f902 [0,2,0,0,0,0|2,0,0]=4 15347 B13R1.16 COCCNc1nccc(c1Cl)Br c2e7fc38e124886814a9936e1d0f778f [0,2,0,0,0,0|2,0,0]=4 15348 B13R1.16 COCCNc1nccc(c1Cl)C 613a91e5c6675dc419657f4a275527c4 [0,2,0,0,0,0|2,0,0]=4 15349 B13R1.16 COCCNc1nccc(c1Cl)Cl e6be0fd67afb8d7e98cfbd5d717766bf [0,2,0,0,0,0|2,0,0]=4 15350 B13R1.16 COCCNc1nccc(c1Cl)I 800e7e4f3a2fead6bd9dbbd04cfc9b0e [0,2,0,0,0,0|2,0,0]=4 15351 B13R1.16 COCCNc1nccc(c1Cl)S 1dba9acafd1d704e1cab3b653dc343f2 [0,2,0,0,0,0|2,0,0]=4 15352 B13R1.16 COCCNc1nccc(c1F)Br 0505aebf099ce9c0e52a76a9d8c02fd0 [0,2,0,0,0,0|2,0,0]=4 15353 B13R1.16 COCCNc1nccc(c1F)C d53152f1e1b3bc232a0c0837af67f02b [0,2,0,0,0,0|2,0,0]=4 15354 B13R1.16 COCCNc1nccc(c1F)Cl 6254580dd28511b5f357e02f802bffb7 [0,2,0,0,0,0|2,0,0]=4 15355 B13R1.16 COCCNc1nccc(c1F)F 76dcafae4d7ad2da31cfb53f86034107 [0,2,0,0,0,0|2,0,0]=4 15356 B13R1.16 COCCNc1nccc(c1F)I dc77aa3b9e7fac11c41b9817ed123fa2 [0,2,0,0,0,0|2,0,0]=4 15357 B13R1.16 COCCNc1nccc(c1F)O 5dc6a7b88abc7c5ee23a67eac59d2194 [0,2,0,0,0,0|2,0,0]=4 15358 B13R1.16 COCCNc1nccc(c1I)Br 2e0fe451d7b631fe0377d9e8c218a438 [0,2,0,0,0,0|2,0,0]=4 15359 B13R1.16 COCCNc1nccc(c1I)C 9cab619c4372a470eca7b032e7737ba1 [0,2,0,0,0,0|2,0,0]=4 15360 B13R1.16 COCCNc1nccc(c1I)Cl 2a90bc4fbc862c6a98c1063af44be908 [0,2,0,0,0,0|2,0,0]=4 15361 B13R1.16 COCCNc1nccc(c1N)N 2481db196f375551be520046d2ff0f90 [0,2,0,0,0,0|2,0,0]=4 15362 B13R1.16 COCCNc1nccc(c1O)C 264f70339703ac9625fc8310805e6be7 [0,2,0,0,0,0|2,0,0]=4 15363 B13R1.16 COCCNc1nccc(c1O)F 534f250f0065f2e1aa298c2ff67a39b9 [0,2,0,0,0,0|2,0,0]=4 15364 B13R1.16 COCCOc1nccc(c1Br)C 4ffd2b5cee6ec8b31e00379a80fec32e [0,2,0,0,0,0|2,0,0]=4 15365 B13R1.16 COCCOc1nccc(c1C)Br 52d56ec3328bd8626c5e74b1e5942db8 [0,2,0,0,0,0|2,0,0]=4 15366 B13R1.16 COCCOc1nccc(c1C)C d61adb9d95341fa6a1d6197bb5282844 [0,2,0,0,0,0|2,0,0]=4 15367 B13R1.16 COCCOc1nccc(c1C)Cl adc31c3a30c36a0b0950506e1f67b5e2 [0,2,0,0,0,0|2,0,0]=4 15368 B13R1.16 COCCOc1nccc(c1C)I 03c944baf788fa1100e6f0d5efda7955 [0,2,0,0,0,0|2,0,0]=4 15369 B13R1.16 COCCOc1nccc(c1Cl)Br d9c86b3bc17ca5475e34a5a54f70720b [0,2,0,0,0,0|2,0,0]=4 15370 B13R1.16 COCCOc1nccc(c1F)I 10915cca66cc51eb3568c939b8a7d668 [0,2,0,0,0,0|2,0,0]=4 15371 B13R1.16 COCCOc1nccc(c1I)Cl 423896e78b568fc530b3c2129045d310 [0,2,0,0,0,0|2,0,0]=4 15372 B13R1.16 COCNCc1nccc(c1F)C 0417f677d8bd0f34c4b08f359b325dab [0,2,0,0,0,0|2,0,0]=4 15373 B13R1.16 COCNCc1nccc(c1F)Cl bcaa36c1bad6506a3ea72c7331117b45 [0,2,0,0,0,0|2,0,0]=4 15374 B13R1.16 COCOCc1nccc(c1Br)C 950b85917b4614102ba4c064dad99d45 [0,2,0,0,0,0|2,0,0]=4 15375 B13R1.16 COCOCc1nccc(c1C)Br 36baadacdcf3b11390f0942819d46a58 [0,2,0,0,0,0|2,0,0]=4 15376 B13R1.16 COCOCc1nccc(c1C)Cl 60e2ad781490457a97bccdb4544072e1 [0,2,0,0,0,0|2,0,0]=4 15377 B13R1.16 COCOCc1nccc(c1Cl)Cl f6dda6dcc756c36b096d99b3e8b059fc [0,2,0,0,0,0|2,0,0]=4 15378 B13R1.16 CSCCNc1nccc(c1Br)Br 9e70ba6cafa45cb72374000be64c684c [0,2,0,0,0,0|2,0,0]=4 15379 B13R1.16 CSCCNc1nccc(c1Br)C fc8e22154aec9276c16008ff8147a521 [0,2,0,0,0,0|2,0,0]=4 15380 B13R1.16 CSCCNc1nccc(c1Br)Cl c523c2552003fbd3cc3245d548d1c6c5 [0,2,0,0,0,0|2,0,0]=4 15381 B13R1.16 CSCCNc1nccc(c1Br)F a25f9637f04f6a7d333ed956d977d09e [0,2,0,0,0,0|2,0,0]=4 15382 B13R1.16 CSCCNc1nccc(c1C)Br d8d06a18c832bf8eb613e55de3302fad [0,2,0,0,0,0|2,0,0]=4 15383 B13R1.16 CSCCNc1nccc(c1C)C 95a573e97a4fdd44aa89dd86fc971980 [0,2,0,0,0,0|2,0,0]=4 15384 B13R1.16 CSCCNc1nccc(c1C)Cl 19116e589a0599913d97761fb529b48b [0,2,0,0,0,0|2,0,0]=4 15385 B13R1.16 CSCCNc1nccc(c1C)F 787018cb8c08b33270a42a00c3e69d59 [0,2,0,0,0,0|2,0,0]=4 15386 B13R1.16 CSCCNc1nccc(c1C)I 0324517a9e90a88b9b47ca4bd3f2ac11 [0,2,0,0,0,0|2,0,0]=4 15387 B13R1.16 CSCCNc1nccc(c1Cl)Br abbd0f63de70b7eea9dd5d371b3ba652 [0,2,0,0,0,0|2,0,0]=4 15388 B13R1.16 CSCCNc1nccc(c1Cl)C a3cdc158ebda8761dcf8fbc4fb4835d4 [0,2,0,0,0,0|2,0,0]=4 15389 B13R1.16 CSCCNc1nccc(c1Cl)Cl 9dc53396364e313604b09e1ec3be81d4 [0,2,0,0,0,0|2,0,0]=4 15390 B13R1.16 CSCCNc1nccc(c1Cl)I 5dbf54bbf0f2806b559d690fd5b0aaa5 [0,2,0,0,0,0|2,0,0]=4 15391 B13R1.16 CSCCNc1nccc(c1Cl)S d48c20d2610453076a928893abbc1545 [0,2,0,0,0,0|2,0,0]=4 15392 B13R1.16 CSCCNc1nccc(c1F)Br d78cb41ee4703aeccb2101974070693a [0,2,0,0,0,0|2,0,0]=4 15393 B13R1.16 CSCCNc1nccc(c1F)C 31cad3eb28935e0e77413c5fb486fa93 [0,2,0,0,0,0|2,0,0]=4 15394 B13R1.16 CSCCNc1nccc(c1F)Cl cd88616b55acdc1c203ef786167e2d8d [0,2,0,0,0,0|2,0,0]=4 15395 B13R1.16 CSCCNc1nccc(c1F)F 0eb6a1d95fe4cb5ae2b8b0181af9339f [0,2,0,0,0,0|2,0,0]=4 15396 B13R1.16 CSCCNc1nccc(c1F)I 9cc6a7d9a1e3c09c85ce7945965027d7 [0,2,0,0,0,0|2,0,0]=4 15397 B13R1.16 CSCCNc1nccc(c1I)Br 62d889164af6fd3f650b6e7b9af2506e [0,2,0,0,0,0|2,0,0]=4 15398 B13R1.16 CSCCNc1nccc(c1I)C a0f4409c7168debb9e7bb0fdfc2de90d [0,2,0,0,0,0|2,0,0]=4 15399 B13R1.16 CSCCNc1nccc(c1I)Cl beb6cf68c89fa0e51b7ce8aef0de11f5 [0,2,0,0,0,0|2,0,0]=4 15400 B13R1.16 CSCCNc1nccc(c1N)N 5f28e19304994f9faad807c93478b0cc [0,2,0,0,0,0|2,0,0]=4 15401 B13R1.16 CSCCOc1nccc(c1Br)C 6dd0a02cd0382d0b7b28b9bb147f8c13 [0,2,0,0,0,0|2,0,0]=4 15402 B13R1.16 CSCCOc1nccc(c1C)Br d3461cffc2c233c796c38de5b5bde4f7 [0,2,0,0,0,0|2,0,0]=4 15403 B13R1.16 CSCCOc1nccc(c1C)C e3c40b4b3c75dae2dd08129f0bdb98cf [0,2,0,0,0,0|2,0,0]=4 15404 B13R1.16 CSCCOc1nccc(c1C)Cl d2b6dfff03d35515e460a73c7d6282e8 [0,2,0,0,0,0|2,0,0]=4 15405 B13R1.16 CSCCOc1nccc(c1C)I 54bb18e39c03ce895c0926a3fdcf6942 [0,2,0,0,0,0|2,0,0]=4 15406 B13R1.16 CSCCOc1nccc(c1Cl)Br 1d96aeaa2c31914199cea0f21d195d62 [0,2,0,0,0,0|2,0,0]=4 15407 B13R1.16 CSCCOc1nccc(c1F)I 5667d239efbd9296f70cfa68ee45a05d [0,2,0,0,0,0|2,0,0]=4 15408 B13R1.16 CSCCOc1nccc(c1I)Cl 749c66573d5fee9543b04f878ba4825a [0,2,0,0,0,0|2,0,0]=4 15409 B13R1.16 CSCNCc1nccc(c1F)C 1e423a025e1180f972e9e242eb2cbf1f [0,2,0,0,0,0|2,0,0]=4 15410 B13R1.16 CSCNCc1nccc(c1F)Cl e0d45bd4b7f88eee1e9bc39bfeb25737 [0,2,0,0,0,0|2,0,0]=4 15411 B13R1.16 CSCOCc1nccc(c1Br)C f6c065aa69788fabef2105c0ab434d9b [0,2,0,0,0,0|2,0,0]=4 15412 B13R1.16 CSCOCc1nccc(c1C)Br b457087fef7b38f86bd04bc21f060478 [0,2,0,0,0,0|2,0,0]=4 15413 B13R1.16 CSCOCc1nccc(c1C)Cl 341e8cc15f0b8bef95db44ee4057f839 [0,2,0,0,0,0|2,0,0]=4 15414 B13R1.16 CSCOCc1nccc(c1Cl)Cl c1e0865873074247ef17b44dba75e4e8 [0,2,0,0,0,0|2,0,0]=4 15415 B13R1.16 Cc1c(ccnc1COCCF)Br 34aef8a0d7c7fb477ab33f7c26cb8380 [0,2,0,0,0,0|2,0,0]=4 15416 B13R1.16 Cc1c(ccnc1COCCF)Cl 02e11df6c88a4be11e17c16d9a4b207b [0,2,0,0,0,0|2,0,0]=4 15417 B13R1.16 Cc1c(ccnc1COCCS)Br 0c78c4b750b95971bc5bea1a69db1b96 [0,2,0,0,0,0|2,0,0]=4 15418 B13R1.16 Cc1c(ccnc1COCCS)Cl aa7121a155f6fada325ea34e7adcaf59 [0,2,0,0,0,0|2,0,0]=4 15419 B13R1.16 Cc1c(ccnc1NCCCCl)F 3c75e4ed9829bbe64ca2632af5e161b0 [0,2,0,0,0,0|2,0,0]=4 15420 B13R1.16 Cc1c(ccnc1NCCCF)Br 909914ad63da93e1614e3c614980effe [0,2,0,0,0,0|2,0,0]=4 15421 B13R1.16 Cc1c(ccnc1NCCCF)Cl a700fe541e302c1a26703a27be9280e3 [0,2,0,0,0,0|2,0,0]=4 15422 B13R1.16 Cc1c(ccnc1NCCCF)F e8b87bd48b0f88cff7d48c6e6d8ec2cb [0,2,0,0,0,0|2,0,0]=4 15423 B13R1.16 Cc1c(ccnc1NCCCF)I 41cf7be0dbab40e84035a4d592eb291c [0,2,0,0,0,0|2,0,0]=4 15424 B13R1.16 Cc1c(ccnc1NCCCO)Br 6784ee940174e47f8ea0fd40783fa2de [0,2,0,0,0,0|2,0,0]=4 15425 B13R1.16 Cc1c(ccnc1NCCCO)Cl 659cdfe389bcafff2eb6ebbd1dc533ce [0,2,0,0,0,0|2,0,0]=4 15426 B13R1.16 Cc1c(ccnc1NCCCO)F d395ae7c0786e0c885854440f6c65db5 [0,2,0,0,0,0|2,0,0]=4 15427 B13R1.16 Cc1c(ccnc1NCCCO)I 4c7da54cab44767e8fcbccab999fbad9 [0,2,0,0,0,0|2,0,0]=4 15428 B13R1.16 Cc1c(ccnc1NCCCS)Br 630c178e7a878ea2a93befa832f2062e [0,2,0,0,0,0|2,0,0]=4 15429 B13R1.16 Cc1c(ccnc1NCCCS)Cl 5cf0468127157dc2efd281e711c35970 [0,2,0,0,0,0|2,0,0]=4 15430 B13R1.16 Cc1c(ccnc1NCCCS)F 84e18e7a32b0e3c3d4a1849cef7f5304 [0,2,0,0,0,0|2,0,0]=4 15431 B13R1.16 Cc1c(ccnc1NCCCS)I 9860112e489be2bc39c26e0b59765db9 [0,2,0,0,0,0|2,0,0]=4 15432 B13R1.16 Cc1c(ccnc1OCCCF)Br 996702ae6872b916317197c80dca2ac3 [0,2,0,0,0,0|2,0,0]=4 15433 B13R1.16 Cc1c(ccnc1OCCCF)Cl 0d21971868a3d2286be688fc85bad5c5 [0,2,0,0,0,0|2,0,0]=4 15434 B13R1.16 Cc1c(ccnc1OCCCF)I 8eab43aba073f82d1f4639bc6fc8fad8 [0,2,0,0,0,0|2,0,0]=4 15435 B13R1.16 Cc1c(ccnc1OCCCS)Br e81c9ae55b4b4618b3112466e9607e7f [0,2,0,0,0,0|2,0,0]=4 15436 B13R1.16 Cc1c(ccnc1OCCCS)Cl 1b29367974443e5ef6b373ebdcc94e85 [0,2,0,0,0,0|2,0,0]=4 15437 B13R1.16 Cc1c(ccnc1OCCCS)I 7b96eaa07f2780740753b7382da3eae5 [0,2,0,0,0,0|2,0,0]=4 15438 B13R1.16 Cc1ccnc(c1Br)COCCF a58b60fc4e5e23658f781411452c2ffe [0,2,0,0,0,0|2,0,0]=4 15439 B13R1.16 Cc1ccnc(c1Br)COCCS 12770a642b6cd6763bda3208c27109bd [0,2,0,0,0,0|2,0,0]=4 15440 B13R1.16 Cc1ccnc(c1Br)NCCCF 36ff7a9c01042115a07059550cfe7f1d [0,2,0,0,0,0|2,0,0]=4 15441 B13R1.16 Cc1ccnc(c1Br)NCCCO f57db3a0402b2df542c4377978ab1786 [0,2,0,0,0,0|2,0,0]=4 15442 B13R1.16 Cc1ccnc(c1Br)NCCCS a99620c56272da986c36784c7dccd452 [0,2,0,0,0,0|2,0,0]=4 15443 B13R1.16 Cc1ccnc(c1Br)OCCCF 3aac44d12f21db4805b8da25dd2974cd [0,2,0,0,0,0|2,0,0]=4 15444 B13R1.16 Cc1ccnc(c1Br)OCCCS 36165a5294c7700286ab8cf7b8f91ff8 [0,2,0,0,0,0|2,0,0]=4 15445 B13R1.16 Cc1ccnc(c1C)NCCCF 6fd9e316a15e5a1891431d47a02b9066 [0,2,0,0,0,0|2,0,0]=4 15446 B13R1.16 Cc1ccnc(c1C)NCCCO 1462a4ecaa7bf9029ae5b753343155fb [0,2,0,0,0,0|2,0,0]=4 15447 B13R1.16 Cc1ccnc(c1C)NCCCS a812f43c5fc403357824a532d5c299b9 [0,2,0,0,0,0|2,0,0]=4 15448 B13R1.16 Cc1ccnc(c1C)OCCCF 8d073c4fe94fb977d14160e2d7df3ea4 [0,2,0,0,0,0|2,0,0]=4 15449 B13R1.16 Cc1ccnc(c1C)OCCCS 84b9efefdc97a19013263c231eed7934 [0,2,0,0,0,0|2,0,0]=4 15450 B13R1.16 Cc1ccnc(c1Cl)NCCCF 97994b1dc3511aec561b1294e74002e6 [0,2,0,0,0,0|2,0,0]=4 15451 B13R1.16 Cc1ccnc(c1Cl)NCCCO 204c9fda50a60c6aafe2417838cad6c0 [0,2,0,0,0,0|2,0,0]=4 15452 B13R1.16 Cc1ccnc(c1Cl)NCCCS cd3db33c5908ac58a92913810d73d230 [0,2,0,0,0,0|2,0,0]=4 15453 B13R1.16 Cc1ccnc(c1F)CNCCF 09ab0908ecd996368f0889e01e895e21 [0,2,0,0,0,0|2,0,0]=4 15454 B13R1.16 Cc1ccnc(c1F)CNCCO 1037ae66cbcb03aa0d8486c112f82279 [0,2,0,0,0,0|2,0,0]=4 15455 B13R1.16 Cc1ccnc(c1F)CNCCS 3e392d66410d9a449d7ab0fce2d213fc [0,2,0,0,0,0|2,0,0]=4 15456 B13R1.16 Cc1ccnc(c1F)NCCCCl 706227e482fd527caf1325c0142bd95c [0,2,0,0,0,0|2,0,0]=4 15457 B13R1.16 Cc1ccnc(c1F)NCCCF c9e549bcd7389b15ea0c942ee29942a8 [0,2,0,0,0,0|2,0,0]=4 15458 B13R1.16 Cc1ccnc(c1F)NCCCO 069a27835f8f4553ebda84a44e376862 [0,2,0,0,0,0|2,0,0]=4 15459 B13R1.16 Cc1ccnc(c1F)NCCCS 1684abbd50bb038b5c8bbfb6d60831f4 [0,2,0,0,0,0|2,0,0]=4 15460 B13R1.16 Cc1ccnc(c1I)NCCCF 309ff77899718043987dfa8344d8d877 [0,2,0,0,0,0|2,0,0]=4 15461 B13R1.16 Cc1ccnc(c1I)NCCCO e3e320d8949881adb209ad44db19cfed [0,2,0,0,0,0|2,0,0]=4 15462 B13R1.16 Cc1ccnc(c1I)NCCCS 8261932c5b0dc6595ab920e131647358 [0,2,0,0,0,0|2,0,0]=4 15463 B13R1.16 FCCCNc1nccc(c1Br)Br 787393872c9d4f3b013d571f56e92d7b [0,2,0,0,0,0|2,0,0]=4 15464 B13R1.16 FCCCNc1nccc(c1Br)Cl b7b7fcc2f268e91713183943859b802e [0,2,0,0,0,0|2,0,0]=4 15465 B13R1.16 FCCCNc1nccc(c1Br)F 62cfbcb12238266ca067f60f5cb37acd [0,2,0,0,0,0|2,0,0]=4 15466 B13R1.16 FCCCNc1nccc(c1Cl)Br bcf10850899ab9b3a1f6caef96477035 [0,2,0,0,0,0|2,0,0]=4 15467 B13R1.16 FCCCNc1nccc(c1Cl)Cl a2919eb5c740b09abfaba18d92ba0929 [0,2,0,0,0,0|2,0,0]=4 15468 B13R1.16 FCCCNc1nccc(c1Cl)I b486db0b3d3e35c790af379cda2f03db [0,2,0,0,0,0|2,0,0]=4 15469 B13R1.16 FCCCNc1nccc(c1Cl)S 8903be9da5a3ce1bd1edaa46a8240d03 [0,2,0,0,0,0|2,0,0]=4 15470 B13R1.16 FCCCNc1nccc(c1F)Br 2ba90a5fa9de1606d399439c3f185c8a [0,2,0,0,0,0|2,0,0]=4 15471 B13R1.16 FCCCNc1nccc(c1F)Cl 3c2e58c928b624151c118721e577029c [0,2,0,0,0,0|2,0,0]=4 15472 B13R1.16 FCCCNc1nccc(c1F)F 0b89576be8e95806f1493509e5ccc34e [0,2,0,0,0,0|2,0,0]=4 15473 B13R1.16 FCCCNc1nccc(c1F)I b9f2eb4e041cbf6730db162aa7a8537c [0,2,0,0,0,0|2,0,0]=4 15474 B13R1.16 FCCCNc1nccc(c1I)Br 929e72a6ae701c962113d0011764f539 [0,2,0,0,0,0|2,0,0]=4 15475 B13R1.16 FCCCNc1nccc(c1I)Cl 192c59115ff89f20f54930d472c51b16 [0,2,0,0,0,0|2,0,0]=4 15476 B13R1.16 FCCCOc1nccc(c1Cl)Br effceb42a54e3170692510600dcf30f6 [0,2,0,0,0,0|2,0,0]=4 15477 B13R1.16 FCCCOc1nccc(c1F)I b1cf8dafaf0e79311de088593a9e2beb [0,2,0,0,0,0|2,0,0]=4 15478 B13R1.16 FCCCOc1nccc(c1I)Cl f5af9407529bdc7b39a23f800d7d82a3 [0,2,0,0,0,0|2,0,0]=4 15479 B13R1.16 FCCNCc1nccc(c1F)Cl 89969f2f3d69960cfa474aa32454c689 [0,2,0,0,0,0|2,0,0]=4 15480 B13R1.16 FCCOCc1nccc(c1Cl)Cl fece2a6f6641b95c4df43ba8e385941f [0,2,0,0,0,0|2,0,0]=4 15481 B13R1.16 Fc1c(ccnc1CNCCS)Cl 1cb570aa90e3d8b96ce764252dc390bd [0,2,0,0,0,0|2,0,0]=4 15482 B13R1.16 Fc1c(ccnc1NCCCS)Br c7e58bba926665e50dbd72f8511b1307 [0,2,0,0,0,0|2,0,0]=4 15483 B13R1.16 Fc1c(ccnc1NCCCS)Cl 8d0af91efeb4a7875747aadd251d4be0 [0,2,0,0,0,0|2,0,0]=4 15484 B13R1.16 Fc1c(ccnc1NCCCS)I 371754fea1a2793d31748dbd137514cd [0,2,0,0,0,0|2,0,0]=4 15485 B13R1.16 Fc1c(ccnc1OCCCS)I 582273b9465ef77ab14dd07d72f127b0 [0,2,0,0,0,0|2,0,0]=4 15486 B13R1.16 Fc1ccnc(c1Br)NCCCS d3b28a40ac2a8b19ff8bf816322b6209 [0,2,0,0,0,0|2,0,0]=4 15487 B13R1.16 Fc1ccnc(c1F)NCCCCl 37ea525e9e6796b41c42cab38343eaee [0,2,0,0,0,0|2,0,0]=4 15488 B13R1.16 Fc1ccnc(c1F)NCCCS 98b67602a2d39c0d0b6008a4158a11b0 [0,2,0,0,0,0|2,0,0]=4 15489 B13R1.16 Nc1ccnc(c1N)NCCCCl 2a9c2c53d1f91c8d62153e5fdd83a8ef [0,2,0,0,0,0|2,0,0]=4 15490 B13R1.16 Nc1ccnc(c1N)NCCCO 37c5c239301f79f389e8b802f5203b9e [0,2,0,0,0,0|2,0,0]=4 15491 B13R1.16 OCCCNc1nccc(c1Br)Br 84d42f0228f0454889c5f9d8fb947746 [0,2,0,0,0,0|2,0,0]=4 15492 B13R1.16 OCCCNc1nccc(c1Br)Cl 49324dfc20e75a39dc6caf115e4e6b1a [0,2,0,0,0,0|2,0,0]=4 15493 B13R1.16 OCCCNc1nccc(c1Br)F 24a97d17d56fcc50f076ed8c157723b1 [0,2,0,0,0,0|2,0,0]=4 15494 B13R1.16 OCCCNc1nccc(c1Cl)Br edd84fe0a4959ecbc8f3f9ad2810e5b7 [0,2,0,0,0,0|2,0,0]=4 15495 B13R1.16 OCCCNc1nccc(c1Cl)Cl 06e899867d23350558af13bc9d18fd66 [0,2,0,0,0,0|2,0,0]=4 15496 B13R1.16 OCCCNc1nccc(c1Cl)I 286a91aff3068bde580d4b0157241b24 [0,2,0,0,0,0|2,0,0]=4 15497 B13R1.16 OCCCNc1nccc(c1Cl)S ad9058f7112c77f1d4e6465604b77017 [0,2,0,0,0,0|2,0,0]=4 15498 B13R1.16 OCCCNc1nccc(c1F)Br 756325169ecadaf62e5c88938cc8bade [0,2,0,0,0,0|2,0,0]=4 15499 B13R1.16 OCCCNc1nccc(c1F)Cl cf1d601e6b4f44f9a8aac719afa3612e [0,2,0,0,0,0|2,0,0]=4 15500 B13R1.16 OCCCNc1nccc(c1F)F 2ee8dc3304c6e08aaf206a529e6657c7 [0,2,0,0,0,0|2,0,0]=4 15501 B13R1.16 OCCCNc1nccc(c1F)I 13a45a65685ee4f9c38f92ea96f60252 [0,2,0,0,0,0|2,0,0]=4 15502 B13R1.16 OCCCNc1nccc(c1I)Br 695f0006294105a9d432e44aa39d5949 [0,2,0,0,0,0|2,0,0]=4 15503 B13R1.16 OCCCNc1nccc(c1I)Cl 7a79cadb5365a0d1179ff9b71254a2c7 [0,2,0,0,0,0|2,0,0]=4 15504 B13R1.16 OCCNCc1nccc(c1F)Cl 7c4944d72b91e99f117e5452d0cf922e [0,2,0,0,0,0|2,0,0]=4 15505 B13R1.16 Oc1c(ccnc1NCCCCl)F f24bd9883bbfca196d8103c3945b1360 [0,2,0,0,0,0|2,0,0]=4 15506 B13R1.16 SCCCNc1nccc(c1Br)Br d88b40fc625ccecdbd967144cadcb40a [0,2,0,0,0,0|2,0,0]=4 15507 B13R1.16 SCCCNc1nccc(c1Br)Cl 91426ea3d6df312118c913591166ff4f [0,2,0,0,0,0|2,0,0]=4 15508 B13R1.16 SCCCNc1nccc(c1Cl)Br e6ac79d28e86e43dda181e38e5f88c0b [0,2,0,0,0,0|2,0,0]=4 15509 B13R1.16 SCCCNc1nccc(c1Cl)Cl 157c272c95c74a74c766663cc95c9063 [0,2,0,0,0,0|2,0,0]=4 15510 B13R1.16 SCCCNc1nccc(c1Cl)I 7401f421b70b55c75188d3f08a8152da [0,2,0,0,0,0|2,0,0]=4 15511 B13R1.16 SCCCNc1nccc(c1Cl)S 7c71a7a95cadb2ae5b7a219e3ae4a4e7 [0,2,0,0,0,0|2,0,0]=4 15512 B13R1.16 SCCCNc1nccc(c1I)Br ccba8b6c75aaff33f61d94315ebf7ad3 [0,2,0,0,0,0|2,0,0]=4 15513 B13R1.16 SCCCNc1nccc(c1I)Cl 513a3ce220bdbbeeee4e03307f1cad38 [0,2,0,0,0,0|2,0,0]=4 15514 B13R1.16 SCCCOc1nccc(c1Cl)Br 7b4c9f60477cfc9327e4008611ee9aa2 [0,2,0,0,0,0|2,0,0]=4 15515 B13R1.16 SCCCOc1nccc(c1I)Cl e0922b805fabff6d93b652ae3b7e1738 [0,2,0,0,0,0|2,0,0]=4 15516 B13R1.16 SCCOCc1nccc(c1Cl)Cl 60c23c1045f765ae1618f5133054fb40 [0,2,0,0,0,0|2,0,0]=4 15517 B13R1.18 CC(NCCF)c1cc(ccn1)Cl af46c891ae3569e4f8d430eaf5d669d0 [0,2,0,0,0,0|2,0,0]=4 15518 B13R1.18 CC(NCCF)c1cccc(n1)Br 021c3c310011f077139b82b404001714 [0,2,0,0,0,0|2,0,0]=4 15519 B13R1.18 CC(NCCF)c1cccc(n1)Cl bb96ae7a153fa5618b64b450bb57da4e [0,2,0,0,0,0|2,0,0]=4 15520 B13R1.18 CC(NCCF)c1cccc(n1)F 8738a02e7d22f38cf9c7e3bdde464ec7 [0,2,0,0,0,0|2,0,0]=4 15521 B13R1.18 CC(NCCO)c1cc(ccn1)Cl 6c8467aea643f7fbaaddcce1264503ee [0,2,0,0,0,0|2,0,0]=4 15522 B13R1.18 CC(NCCO)c1cccc(n1)Br 4d049d1781b72b1e6e31832abd569bd4 [0,2,0,0,0,0|2,0,0]=4 15523 B13R1.18 CC(NCCO)c1cccc(n1)Cl bc7e55445a1c5ae0af13e1e48821b04d [0,2,0,0,0,0|2,0,0]=4 15524 B13R1.18 CC(NCCO)c1cccc(n1)F 336e2e9ce8f858c96448b4322f73488a [0,2,0,0,0,0|2,0,0]=4 15525 B13R1.18 CC(NCCS)c1cc(ccn1)Cl 2dfba6abe06f12154498e124a58b8dd9 [0,2,0,0,0,0|2,0,0]=4 15526 B13R1.18 CC(NCCS)c1cccc(n1)Br c1301d92e9c2d02d3b75685d2fe06652 [0,2,0,0,0,0|2,0,0]=4 15527 B13R1.18 CC(NCCS)c1cccc(n1)Cl 491043997957396b210e73423aed8a1f [0,2,0,0,0,0|2,0,0]=4 15528 B13R1.18 CC(NCCS)c1cccc(n1)F 327e745ad89c8d983dbe7712b5034f9f [0,2,0,0,0,0|2,0,0]=4 15529 B13R1.18 CC(OCCF)c1cc(ccn1)Br ddfaeda778332946ae203b32eff64367 [0,2,0,0,0,0|2,0,0]=4 15530 B13R1.18 CC(OCCF)c1cc(ccn1)Cl b4e8782426cd5c4fcc756f44b85e9b0e [0,2,0,0,0,0|2,0,0]=4 15531 B13R1.18 CC(OCCF)c1cccc(n1)F f045eeb53a78e4e204fd98d898ec8e1c [0,2,0,0,0,0|2,0,0]=4 15532 B13R1.18 CC(OCCS)c1cc(ccn1)Br d986f6ef20126290647d19c446e1e8be [0,2,0,0,0,0|2,0,0]=4 15533 B13R1.18 CC(OCCS)c1cc(ccn1)Cl c2b647c670c0fd3662dd35fd788c742c [0,2,0,0,0,0|2,0,0]=4 15534 B13R1.18 CC(OCCS)c1cccc(n1)Br 8986a3fcf4da03126a90f6f987907e97 [0,2,0,0,0,0|2,0,0]=4 15535 B13R1.18 CC(OCCS)c1cccc(n1)F 1d0dd0decaf0e098714b2101477ad38f [0,2,0,0,0,0|2,0,0]=4 15536 B13R1.18 CCCCN(C)c1cc(ccn1)Br d7db7ae61d862e9972822b8e4e7c0baa [0,2,0,0,0,0|1,0,0]=3 15537 B13R1.18 CCCCN(C)c1cc(ccn1)C ca6fc735742e3ab133f19d1d4726df0f [0,2,0,0,0,0|1,0,0]=3 15538 B13R1.18 CCCCN(C)c1cc(ccn1)Cl 8e65a96f61ef8def8e18661f7a1a1a96 [0,2,0,0,0,0|1,0,0]=3 15539 B13R1.18 CCCCN(C)c1cc(ccn1)F 56cee71bccecb5c7424bc9d0a8725540 [0,2,0,0,0,0|1,0,0]=3 15540 B13R1.18 CCCCN(C)c1cc(ccn1)I 0934e5f0ca01720e829d72e82aee45ea [0,2,0,0,0,0|1,0,0]=3 15541 B13R1.18 CCCCN(C)c1cc(ncn1)Br ed6497685555816f05ccad3f81592fc6 [0,2,0,0,0,0|2,0,0]=4 15542 B13R1.18 CCCCN(C)c1cc(ncn1)Cl 03c10cb28bb21098176d40adcc054c30 [0,2,0,0,0,0|2,0,0]=4 15543 B13R1.18 CCCCN(C)c1cccc(c1)Br b491b1347b03ff91161c9eb90db11111 [0,2,0,0,0,0|2,0,0]=4 15544 B13R1.18 CCCCN(C)c1cccc(c1)C 8780f948ae3b6494beccf2428399d36b [0,2,0,0,0,0|2,0,0]=4 15545 B13R1.18 CCCCN(C)c1cccc(c1)Cl c464fb7864980bf0b358d25aa5eb3e9a [0,2,0,0,0,0|2,0,0]=4 15546 B13R1.18 CCCCN(C)c1cccc(c1)F c63603c63eac7405892409fc282cba4a [0,2,0,0,0,0|2,0,0]=4 15547 B13R1.18 CCCCN(C)c1cccc(c1)I 6c8602992a73600e53597b5370027327 [0,2,0,0,0,0|2,0,0]=4 15548 B13R1.18 CCCCN(C)c1cccc(n1)F ac60ce6d5753d0aa353b9e993ed75592 [0,2,0,0,0,0|1,0,0]=3 15549 B13R1.18 CCCCN(C)c1ccnc(n1)Br 45b0bd4f8bd1b06caf976e9cb4595b61 [0,2,0,0,0,0|2,0,0]=4 15550 B13R1.18 CCCCN(C)c1ccnc(n1)Cl f857529df90f99053abad8c059baa0d2 [0,2,0,0,0,0|2,0,0]=4 15551 B13R1.18 CCCCN(C)c1cncc(n1)Br 96de1d80feec69ef7eaac07c2eddd597 [0,2,0,0,0,0|2,0,0]=4 15552 B13R1.18 CCCCN(C)c1cncc(n1)C 9e6a6da4471dec48d016420ef4770ca4 [0,2,0,0,0,0|2,0,0]=4 15553 B13R1.18 CCCCN(C)c1cncc(n1)Cl bd2367ba166bd50f71392bab54f9030e [0,2,0,0,0,0|2,0,0]=4 15554 B13R1.18 CCCCN(C)c1nccc(n1)Br 1a61172384bb269a08a2178a1babcd14 [0,2,0,0,0,0|2,0,0]=4 15555 B13R1.18 CCCCN(C)c1nccc(n1)C 9e49362474029fa1d4bfedff69753197 [0,2,0,0,0,0|2,0,0]=4 15556 B13R1.18 CCCCN(C)c1nccc(n1)Cl df7f48db7c67f7758401817a9b7a90a8 [0,2,0,0,0,0|2,0,0]=4 15557 B13R1.18 CCCNC(=O)c1cc(ccn1)Br 49e1786823e707f7e4ceef96dc74d8a8 [0,2,0,0,0,0|1,0,1]=4 15558 B13R1.18 CCCNC(=O)c1cc(ccn1)C 126a9ec48e9c12fc23517496949b0ce9 [0,2,0,0,0,0|1,0,1]=4 15559 B13R1.18 CCCNC(=O)c1cc(ccn1)Cl a6c397b0e431771a8efbeceb9b67d9c8 [0,2,0,0,0,0|1,0,1]=4 15560 B13R1.18 CCCNC(=O)c1cc(ccn1)F cd15e10b2a6df86c2d54031f632a0321 [0,2,0,0,0,0|1,0,1]=4 15561 B13R1.18 CCCNC(=O)c1cc(ccn1)I 509884d5841d0297daa377e165238ab2 [0,2,0,0,0,0|1,0,1]=4 15562 B13R1.18 CCCNC(=O)c1cc(ccn1)O b1455a3818eac86017451229ea4f2a24 [0,2,0,0,0,0|1,0,1]=4 15563 B13R1.18 CCCNC(=O)c1cccc(n1)Br cd6c8261f3204574295fab155e815cd1 [0,2,0,0,0,0|1,0,1]=4 15564 B13R1.18 CCCNC(=O)c1cccc(n1)C 8f59eccd0f2e1ec223a2f1a6116057e1 [0,2,0,0,0,0|1,0,1]=4 15565 B13R1.18 CCCNC(=O)c1cccc(n1)Cl f863fbd9a996a5db97944f2fdbf1672a [0,2,0,0,0,0|1,0,1]=4 15566 B13R1.18 CCCNC(=O)c1cccc(n1)F 8ff0483afb7f44179a10d5af934de8ed [0,2,0,0,0,0|1,0,1]=4 15567 B13R1.18 CCCNC(=O)c1cccc(n1)I be538f993d239bfb435dc17cf2b199a1 [0,2,0,0,0,0|1,0,1]=4 15568 B13R1.18 CCCNC(=O)c1cccc(n1)O 99a0cbb3dcf038e021f99ef7a7d1c0e7 [0,2,0,0,0,0|1,0,1]=4 15569 B13R1.18 CCCNC(C)c1cc(ccn1)C c50abdcbf2537513cff10083ad42d6cf [0,2,0,0,0,0|1,0,0]=3 15570 B13R1.18 CCCNC(C)c1cc(ccn1)Cl 8a720dbea35bb59dfbb1847e4a9a9de3 [0,2,0,0,0,0|1,0,0]=3 15571 B13R1.18 CCCNC(C)c1cccc(c1)Br 796102597c2b46c0a93d5ce66e1a793e [0,2,0,0,0,0|2,0,0]=4 15572 B13R1.18 CCCNC(C)c1cccc(c1)C 4f2fbfa3ea7125d2a6a5878dc5690f4c [0,2,0,0,0,0|2,0,0]=4 15573 B13R1.18 CCCNC(C)c1cccc(c1)Cl 601006674e7735696ab9b9936f206668 [0,2,0,0,0,0|2,0,0]=4 15574 B13R1.18 CCCNC(C)c1cccc(c1)F d04b92e81f162e80d4eca0d9f9ceec7b [0,2,0,0,0,0|2,0,0]=4 15575 B13R1.18 CCCNC(C)c1cccc(n1)C cbf6aaef0557e827078fdc672a195ae2 [0,2,0,0,0,0|1,0,0]=3 15576 B13R1.18 CCCNC(C)c1cccc(n1)Cl 81ee208c904bb9d5207394f0f597ceb4 [0,2,0,0,0,0|1,0,0]=3 15577 B13R1.18 CCCNC(C)c1cccc(n1)F f4724a65264b33de7ad4603431a44429 [0,2,0,0,0,0|1,0,0]=3 15578 B13R1.18 CCCN[C@@H](C)c1cccc(c1)Br 0b601dc72ac0de21fb684eb5069a8326 [0,2,0,0,0,0|2,0,0]=4 15579 B13R1.18 CCCN[C@@H](C)c1cccc(c1)C f9770b669f59a435072958da2d34f92f [0,2,0,0,0,0|2,0,0]=4 15580 B13R1.18 CCCN[C@@H](C)c1cccc(c1)Cl 065a11a66c1e55d07de288945abe24d2 [0,2,0,0,0,0|2,0,0]=4 15581 B13R1.18 CCCN[C@@H](C)c1cccc(c1)F 283a56e69fe1b1aefc11e478d81e1a34 [0,2,0,0,0,0|2,0,0]=4 15582 B13R1.18 CCCN[C@@H](C)c1cccc(c1)I 628c9635bf1201683d8d851262f0b8ff [0,2,0,0,0,0|2,0,0]=4 15583 B13R1.18 CCCN[C@@H](C)c1cccc(n1)C aabf7a587253178af1476e6074de2278 [0,2,0,0,0,0|1,0,0]=3 15584 B13R1.18 CCCN[C@H](C)c1cccc(c1)Br 374d7dd7506bbbb80524cbc07b57f27c [0,2,0,0,0,0|2,0,0]=4 15585 B13R1.18 CCCN[C@H](C)c1cccc(c1)C aad62916290a548b031af7da0a937616 [0,2,0,0,0,0|2,0,0]=4 15586 B13R1.18 CCCN[C@H](C)c1cccc(c1)Cl 4440e8a25afc35fd304bea8e0d9558af [0,2,0,0,0,0|2,0,0]=4 15587 B13R1.18 CCCN[C@H](C)c1cccc(c1)F 669aeafb2cc987d0276b312b3fece493 [0,2,0,0,0,0|2,0,0]=4 15588 B13R1.18 CCCOC(C)c1cc(ccn1)Br eebea71dcd5287d7b051326136bf2b6e [0,2,0,0,0,0|1,0,0]=3 15589 B13R1.18 CCCOC(C)c1cc(ccn1)C 5a062067f40cd0f1940d772643207d12 [0,2,0,0,0,0|1,0,0]=3 15590 B13R1.18 CCCOC(C)c1cc(ccn1)Cl 012798d836332f3ff2b6a716f59a803d [0,2,0,0,0,0|1,0,0]=3 15591 B13R1.18 CCCOC(C)c1cccc(c1)Br 61bca04fcd7fbd4426bbf3802e216b26 [0,2,0,0,0,0|2,0,0]=4 15592 B13R1.18 CCCOC(C)c1cccc(c1)C 4597f8b4ce25c915a5f5c5bd61b0fba4 [0,2,0,0,0,0|2,0,0]=4 15593 B13R1.18 CCCOC(C)c1cccc(c1)Cl 8379d9f2e5cb7a95fd3de5ba8e3701ce [0,2,0,0,0,0|2,0,0]=4 15594 B13R1.18 CCCOC(C)c1cccc(c1)F c9d3aad8813557bbe4a74f0fef7480e1 [0,2,0,0,0,0|2,0,0]=4 15595 B13R1.18 CCCOC(C)c1cccc(c1)I b8280cfca53799488856a9f207a166d8 [0,2,0,0,0,0|2,0,0]=4 15596 B13R1.18 CCCOC(C)c1cccc(n1)F f9174a968b8203608221fb0bf379a723 [0,2,0,0,0,0|1,0,0]=3 15597 B13R1.18 CCCO[C@@H](C)c1cccc(c1)Br e1d898f01d7540ed221f9d3f367e3d3c [0,2,0,0,0,0|2,0,0]=4 15598 B13R1.18 CCCO[C@@H](C)c1cccc(c1)C 724b7240fa63853157404b05671c34b5 [0,2,0,0,0,0|2,0,0]=4 15599 B13R1.18 CCCO[C@@H](C)c1cccc(c1)Cl 02693601251f226ca0106b45d627632f [0,2,0,0,0,0|2,0,0]=4 15600 B13R1.18 CCCO[C@@H](C)c1cccc(c1)F eff5b33c8b44fcef7340eabb3889e022 [0,2,0,0,0,0|2,0,0]=4 15601 B13R1.18 CCCO[C@H](C)c1cc(ccn1)C b81792ba9e5774a45ae4a6cdaf9cff20 [0,2,0,0,0,0|1,0,0]=3 15602 B13R1.18 CCCO[C@H](C)c1cccc(c1)Br e3ab901f34d8d86c8c4ef66ca439c665 [0,2,0,0,0,0|2,0,0]=4 15603 B13R1.18 CCCO[C@H](C)c1cccc(c1)C 023cecc6d849939c08fac9cb6377a80a [0,2,0,0,0,0|2,0,0]=4 15604 B13R1.18 CCCO[C@H](C)c1cccc(c1)Cl a8e51750d6bf0a7b00225578549af946 [0,2,0,0,0,0|2,0,0]=4 15605 B13R1.18 CCCO[C@H](C)c1cccc(c1)F 39c2e315bd07eb18f17b75ed5a8ba5da [0,2,0,0,0,0|2,0,0]=4 15606 B13R1.18 CCNCC(O)c1cccc(c1)Cl 686d5049c6ad29cd3d6884ac43d05d7a [0,2,0,0,0,0|2,0,0]=4 15607 B13R1.18 CCOCN(C)c1cc(ccn1)Br b0b163061a145589fb0d65783711bc50 [0,2,0,0,0,0|2,0,0]=4 15608 B13R1.18 CCOCN(C)c1cc(ccn1)C 3974936cd41c4e625e11026f4da37d26 [0,2,0,0,0,0|2,0,0]=4 15609 B13R1.18 CCOCN(C)c1cc(ccn1)Cl 1a2c9df243c9817d982d108ba67481e9 [0,2,0,0,0,0|2,0,0]=4 15610 B13R1.18 CCOCN(C)c1cc(ccn1)F 81ac162bd4a057027ef94ca39e164afe [0,2,0,0,0,0|2,0,0]=4 15611 B13R1.18 CCOCN(C)c1cc(ccn1)I 0bb0ce2550511f0f29f0fd5c8b0a38f1 [0,2,0,0,0,0|2,0,0]=4 15612 B13R1.18 CN(CCCF)c1cc(ccn1)Br e4fc94b1420eb4167dcf5c0e32f64028 [0,2,0,0,0,0|2,0,0]=4 15613 B13R1.18 CN(CCCF)c1cc(ccn1)Cl 39fbf4bc6347e0cdd91e35aefd35687f [0,2,0,0,0,0|2,0,0]=4 15614 B13R1.18 CN(CCCF)c1cc(ccn1)F cfd50c05acefaea3a47ac69d79c120c3 [0,2,0,0,0,0|2,0,0]=4 15615 B13R1.18 CN(CCCF)c1cc(ccn1)I 5ee3b3fd08dfd12bc4788a9992baf8d6 [0,2,0,0,0,0|2,0,0]=4 15616 B13R1.18 CN(CCCF)c1cccc(n1)Br 735d88c3c463c78e683903f4e08642db [0,2,0,0,0,0|2,0,0]=4 15617 B13R1.18 CN(CCCF)c1cccc(n1)Cl 1fb31ef58da7d04476a82697b2fa355d [0,2,0,0,0,0|2,0,0]=4 15618 B13R1.18 CN(CCCF)c1cccc(n1)F 67938a30451e6e0a8f19f9fe53401c22 [0,2,0,0,0,0|2,0,0]=4 15619 B13R1.18 CN(CCCO)c1cc(ccn1)Br cfacb383e2ce73d5f5a0790b75b39e80 [0,2,0,0,0,0|2,0,0]=4 15620 B13R1.18 CN(CCCO)c1cc(ccn1)Cl c0d48caba7be8df0ceff0ac635d6b143 [0,2,0,0,0,0|2,0,0]=4 15621 B13R1.18 CN(CCCO)c1cc(ccn1)F b6634513da6973a5b192f7b7e58d7bed [0,2,0,0,0,0|2,0,0]=4 15622 B13R1.18 CN(CCCO)c1cc(ccn1)I 8298ac2d96b469beec566506e1319365 [0,2,0,0,0,0|2,0,0]=4 15623 B13R1.18 CN(CCCS)c1cc(ccn1)Br 977b8ae57d33b72fd2f33fe2294d593d [0,2,0,0,0,0|2,0,0]=4 15624 B13R1.18 CN(CCCS)c1cc(ccn1)Cl 1ba5ccfb017eef9816387a29d449e62e [0,2,0,0,0,0|2,0,0]=4 15625 B13R1.18 CN(CCCS)c1cc(ccn1)F 8d3a3c1c75e1ce47e0106423524a4e82 [0,2,0,0,0,0|2,0,0]=4 15626 B13R1.18 CN(CCCS)c1cc(ccn1)I 4de0ed7ef4640447f72fa61cfe53aa23 [0,2,0,0,0,0|2,0,0]=4 15627 B13R1.18 CN(CCCS)c1cccc(n1)Cl 62e814d3a7a5705376c971d914d9a61b [0,2,0,0,0,0|2,0,0]=4 15628 B13R1.18 CN(CCCS)c1cccc(n1)F 91936b36d94fd6aa676fb1c168c6c52b [0,2,0,0,0,0|2,0,0]=4 15629 B13R1.18 COCCN(C)c1cc(ccn1)Br 966afae8d2c8e52440527d90b4e931d0 [0,2,0,0,0,0|2,0,0]=4 15630 B13R1.18 COCCN(C)c1cc(ccn1)C 69f5e972d892c77bd42b00efb50a2cc6 [0,2,0,0,0,0|2,0,0]=4 15631 B13R1.18 COCCN(C)c1cc(ccn1)Cl 3e5fe6c71055a9044dd8350a64eb878f [0,2,0,0,0,0|2,0,0]=4 15632 B13R1.18 COCCN(C)c1cc(ccn1)F 7107ce78e382c38944970d78da24b37e [0,2,0,0,0,0|2,0,0]=4 15633 B13R1.18 COCCN(C)c1cc(ccn1)I 04c3ca9095cc9a8d08b0bd141ac45b00 [0,2,0,0,0,0|2,0,0]=4 15634 B13R1.18 COCCN(C)c1cccc(n1)Br 75e612684d805f7a67f751d4cc83e8a0 [0,2,0,0,0,0|2,0,0]=4 15635 B13R1.18 COCCN(C)c1cccc(n1)C 32fe2fe37dacbc9bb0149127a6994c14 [0,2,0,0,0,0|2,0,0]=4 15636 B13R1.18 COCCN(C)c1cccc(n1)Cl c7e13af191672a6394fe4d4d7b916a95 [0,2,0,0,0,0|2,0,0]=4 15637 B13R1.18 COCCN(C)c1cccc(n1)F fe0f18e69ebcf5d9e533c58419450da3 [0,2,0,0,0,0|2,0,0]=4 15638 B13R1.18 COCNC(C)c1cc(ccn1)C 893dbcac4f62515c65762a0401798f29 [0,2,0,0,0,0|2,0,0]=4 15639 B13R1.18 COCNC(C)c1cc(ccn1)Cl b2bd5934a7a73c3a2aacc1f251f691d6 [0,2,0,0,0,0|2,0,0]=4 15640 B13R1.18 COCNC(C)c1cccc(n1)Br 3db1edf7b6d112e94c3382b3f7657579 [0,2,0,0,0,0|2,0,0]=4 15641 B13R1.18 COCNC(C)c1cccc(n1)C 59047687a53ca35d1031c08c47cbeb40 [0,2,0,0,0,0|2,0,0]=4 15642 B13R1.18 COCNC(C)c1cccc(n1)Cl b1a8770b79cd12ab318f8ec49acdcf52 [0,2,0,0,0,0|2,0,0]=4 15643 B13R1.18 COCNC(C)c1cccc(n1)F 4af7c4eee3fa8c9895ed1bc7687566bf [0,2,0,0,0,0|2,0,0]=4 15644 B13R1.18 COCN[C@@H](C)c1cccc(n1)Br 7702a904c01f8a0357d73c65bf6da90a [0,2,0,0,0,0|2,0,0]=4 15645 B13R1.18 COCN[C@@H](C)c1cccc(n1)C 5a658a13eb4b82b1a86f4fcf7a22cd3d [0,2,0,0,0,0|2,0,0]=4 15646 B13R1.18 COCN[C@H](C)c1cccc(n1)Br 86d718e6ea2d1df6f51c6c908737ccf8 [0,2,0,0,0,0|2,0,0]=4 15647 B13R1.18 COCOC(C)c1cc(ccn1)Br 91d3acac57f40aeaa76219d0d64e6bba [0,2,0,0,0,0|2,0,0]=4 15648 B13R1.18 COCOC(C)c1cc(ccn1)C c61aebcfe67cd4e98ed395750e7bb19b [0,2,0,0,0,0|2,0,0]=4 15649 B13R1.18 COCOC(C)c1cc(ccn1)Cl 3ebf5225152c6cdc9c8a8a58aec22ed9 [0,2,0,0,0,0|2,0,0]=4 15650 B13R1.18 COCOC(C)c1cccc(n1)F 7836c9c1ed1699c64cb16871eb9674c8 [0,2,0,0,0,0|2,0,0]=4 15651 B13R1.18 COCO[C@H](C)c1cc(ccn1)C 04dc21158d2154aee7e34430a71f8bc2 [0,2,0,0,0,0|2,0,0]=4 15652 B13R1.18 CSCCN(C)c1cc(ccn1)Br 254d0f777e33e6a2a5d88d99b4cfdf0e [0,2,0,0,0,0|2,0,0]=4 15653 B13R1.18 CSCCN(C)c1cc(ccn1)C 71fdd5871203675a38dcefb369f04f8b [0,2,0,0,0,0|2,0,0]=4 15654 B13R1.18 CSCCN(C)c1cc(ccn1)Cl ea1bc70918aca26e7447637f864cc4ff [0,2,0,0,0,0|2,0,0]=4 15655 B13R1.18 CSCCN(C)c1cc(ccn1)F 512c97ebca257773a521d89a16bd6b3b [0,2,0,0,0,0|2,0,0]=4 15656 B13R1.18 CSCCN(C)c1cc(ccn1)I da86f9553d1c037f3ed403460a8c7dfc [0,2,0,0,0,0|2,0,0]=4 15657 B13R1.18 CSCCN(C)c1cccc(n1)Br 334986c61aba47015dfccbea723095a2 [0,2,0,0,0,0|2,0,0]=4 15658 B13R1.18 CSCCN(C)c1cccc(n1)C 2c43cde2eda68120b71f242c841d9a43 [0,2,0,0,0,0|2,0,0]=4 15659 B13R1.18 CSCCN(C)c1cccc(n1)Cl 31ec2bfefc2b9d76472ad749fb8cc4b5 [0,2,0,0,0,0|2,0,0]=4 15660 B13R1.18 CSCCN(C)c1cccc(n1)F 1e24d09b89a13d84f9d0d387139933a4 [0,2,0,0,0,0|2,0,0]=4 15661 B13R1.18 CSCNC(C)c1cc(ccn1)C 0cf7729ee61a1b34e8616e10fbe7bb2a [0,2,0,0,0,0|2,0,0]=4 15662 B13R1.18 CSCNC(C)c1cc(ccn1)Cl bb0d6df945bdd5d825a1951971a7fbde [0,2,0,0,0,0|2,0,0]=4 15663 B13R1.18 CSCNC(C)c1cccc(n1)Br 54a81756b508f0807e556b316c0cdede [0,2,0,0,0,0|2,0,0]=4 15664 B13R1.18 CSCNC(C)c1cccc(n1)C b8b5882c67abdb942e51f985a05c2df4 [0,2,0,0,0,0|2,0,0]=4 15665 B13R1.18 CSCNC(C)c1cccc(n1)Cl cfc3601dbe550cd4c2c37d0a9cde694b [0,2,0,0,0,0|2,0,0]=4 15666 B13R1.18 CSCNC(C)c1cccc(n1)F 087a2caccdc0b5373a7233df49b7e1e7 [0,2,0,0,0,0|2,0,0]=4 15667 B13R1.18 CSCN[C@@H](C)c1cccc(n1)Br 9942dbabb65382dd6b8f86fccc316cf6 [0,2,0,0,0,0|2,0,0]=4 15668 B13R1.18 CSCN[C@@H](C)c1cccc(n1)C e699acf0701f537fee2a5cebf4817662 [0,2,0,0,0,0|2,0,0]=4 15669 B13R1.18 CSCN[C@H](C)c1cccc(n1)Br cc4857d8af4e76071d620dd237f66234 [0,2,0,0,0,0|2,0,0]=4 15670 B13R1.18 CSCOC(C)c1cc(ccn1)Br 54323564ac92a190bd2f7d6318a226ae [0,2,0,0,0,0|2,0,0]=4 15671 B13R1.18 CSCOC(C)c1cc(ccn1)C ffa972e7449b9a146790da376c54451c [0,2,0,0,0,0|2,0,0]=4 15672 B13R1.18 CSCOC(C)c1cccc(n1)F 0d8db0b5d6fbcd84c302171f1f64b647 [0,2,0,0,0,0|2,0,0]=4 15673 B13R1.18 CSCO[C@H](C)c1cc(ccn1)C 7a8f76bc065eb4ef32a2d04475396596 [0,2,0,0,0,0|2,0,0]=4 15674 B13R1.18 C[C@@H](NCCF)c1cccc(n1)Br 00cbf5f079b86fcfe997a4bd560513a2 [0,2,0,0,0,0|2,0,0]=4 15675 B13R1.18 C[C@@H](NCCO)c1cccc(n1)Br ba41ae14f04c204d708bb9e270400a59 [0,2,0,0,0,0|2,0,0]=4 15676 B13R1.18 C[C@@H](NCCS)c1cccc(n1)Br bbe66cac7ee3965fe32747f81a39b15c [0,2,0,0,0,0|2,0,0]=4 15677 B13R1.18 C[C@@H](OCCS)c1cccc(n1)Br 4ccdb50d4c9791c138e3813d11b44d7f [0,2,0,0,0,0|2,0,0]=4 15678 B13R1.18 C[C@H](NCCF)c1cccc(n1)Br 08f0c66432b1b2b1917a292d169f6913 [0,2,0,0,0,0|2,0,0]=4 15679 B13R1.18 C[C@H](NCCO)c1cccc(n1)Br 27256ef7f9a2e61897882c9f343c1f17 [0,2,0,0,0,0|2,0,0]=4 15680 B13R1.18 C[C@H](NCCS)c1cccc(n1)Br 7740b391ea5f4988c3cdac420623336f [0,2,0,0,0,0|2,0,0]=4 15681 B13R1.18 Cc1cccc(n1)C(C)NCCF 3a8718522f911ba344892744125d7e24 [0,2,0,0,0,0|2,0,0]=4 15682 B13R1.18 Cc1cccc(n1)C(C)NCCO 9ee9c933d643e272969a83cd9c2c1332 [0,2,0,0,0,0|2,0,0]=4 15683 B13R1.18 Cc1cccc(n1)C(C)NCCS 3c2c74fd5adc257691defb3525ed36b9 [0,2,0,0,0,0|2,0,0]=4 15684 B13R1.18 Cc1cccc(n1)C(C)OCCF 41b0de57611c30165c8686107bc8fcb3 [0,2,0,0,0,0|2,0,0]=4 15685 B13R1.18 Cc1cccc(n1)C(C)OCCS 6b0da58e8a6f1e3c15ca598cb6a2f0ca [0,2,0,0,0,0|2,0,0]=4 15686 B13R1.18 Cc1cccc(n1)N(C)CCCF 6d38c2f9d5614e99787359e626832f53 [0,2,0,0,0,0|2,0,0]=4 15687 B13R1.18 Cc1cccc(n1)N(C)CCCS 0c38257d3eabcef6256f39a090984452 [0,2,0,0,0,0|2,0,0]=4 15688 B13R1.18 Cc1cccc(n1)[C@@H](C)OCCF a614f163655c3c2a95ddfcd105032616 [0,2,0,0,0,0|2,0,0]=4 15689 B13R1.18 Cc1cccc(n1)[C@@H](C)OCCS 722fa5737c0f6e0107f8bf9a9d753ea8 [0,2,0,0,0,0|2,0,0]=4 15690 B13R1.18 Cc1cccc(n1)[C@H](C)NCCF 161efc2bafe9c00c89fe2b2b1cb7c632 [0,2,0,0,0,0|2,0,0]=4 15691 B13R1.18 Cc1cccc(n1)[C@H](C)NCCO 9650987ca46d92a345c247deffe9b054 [0,2,0,0,0,0|2,0,0]=4 15692 B13R1.18 Cc1cccc(n1)[C@H](C)NCCS 289d3fe79ff56fe18e9381463794c828 [0,2,0,0,0,0|2,0,0]=4 15693 B13R1.18 Cc1ccnc(c1)C(C)NCCF a00d3b4bac184b44179cc484e4eb579b [0,2,0,0,0,0|2,0,0]=4 15694 B13R1.18 Cc1ccnc(c1)C(C)NCCO 9e80df5e1ed162d7ae28a6ceb06c019c [0,2,0,0,0,0|2,0,0]=4 15695 B13R1.18 Cc1ccnc(c1)C(C)NCCS cbf21b42bb34ec8dfc13a303b68ec7b2 [0,2,0,0,0,0|2,0,0]=4 15696 B13R1.18 Cc1ccnc(c1)C(C)OCCF c414c9bdde9529bab4cb0dd67d8b8f9e [0,2,0,0,0,0|2,0,0]=4 15697 B13R1.18 Cc1ccnc(c1)C(C)OCCS 0b632863fbf1e4a2722746fda246b153 [0,2,0,0,0,0|2,0,0]=4 15698 B13R1.18 Cc1ccnc(c1)N(C)CCCF df8759cb442f8a7f1f75f839fd0ff634 [0,2,0,0,0,0|2,0,0]=4 15699 B13R1.18 Cc1ccnc(c1)N(C)CCCO c2b050b0622ffdfcae45608686822b69 [0,2,0,0,0,0|2,0,0]=4 15700 B13R1.18 Cc1ccnc(c1)N(C)CCCS d5bf1ca8fdc7b01058167e18ec4dc949 [0,2,0,0,0,0|2,0,0]=4 15701 B13R1.18 Cc1ccnc(c1)[C@@H](C)OCCF 7f12ed22952a1db1f2a7cd422a6b1fe7 [0,2,0,0,0,0|2,0,0]=4 15702 B13R1.18 Cc1ccnc(c1)[C@@H](C)OCCS 20e94212d350e8405ec14701d04b7684 [0,2,0,0,0,0|2,0,0]=4 15703 B13R1.20 CC(CCO)Nc1cc(ccn1)Br f4141634dd88be94459a4d6e0397b278 [0,2,0,0,0,0|2,0,0]=4 15704 B13R1.20 CC(CCO)Nc1cc(ccn1)Cl b470946c0709f4c431af085966460610 [0,2,0,0,0,0|2,0,0]=4 15705 B13R1.20 CC(CCO)Nc1cc(ccn1)F 349bdebc995c1e554e3ef4834ae628ba [0,2,0,0,0,0|2,0,0]=4 15706 B13R1.20 CC(Cc1cccc(n1)F)OCF ca6972484d3e6057b9c60818b3b5be44 [0,2,0,0,0,0|2,0,0]=4 15707 B13R1.20 CCCC(=O)Nc1cc(ccn1)C 7ae95d908ff3fa8e0f2fcd86fa3d9af2 [0,2,0,0,0,0|1,0,1]=4 15708 B13R1.20 CCCC(=O)Nc1cc(ccn1)F 5bfc8d2cd1f1df88334465fceb68de45 [0,2,0,0,0,0|1,0,1]=4 15709 B13R1.20 CCCC(=O)Nc1cc(ccn1)O d98dd8f025cb5348ad7a035ea10ed62b [0,2,0,0,0,0|1,0,1]=4 15710 B13R1.20 CCCC(=O)Nc1cccc(n1)F caee0847cac8026409c0674dfdcfc8ec [0,2,0,0,0,0|1,0,1]=4 15711 B13R1.20 CCCC(=O)Nc1cccc(n1)I 85930b2d0077545014e3d0db911bb036 [0,2,0,0,0,0|1,0,1]=4 15712 B13R1.20 CCCC(C)Nc1cc(ccn1)Br 105765b4fe00d9ed2180f17ea296cf01 [0,2,0,0,0,0|1,0,0]=3 15713 B13R1.20 CCCC(C)Nc1cc(ccn1)C d94609f17ea7592e1dff8f9991fb8698 [0,2,0,0,0,0|1,0,0]=3 15714 B13R1.20 CCCC(C)Nc1cc(ccn1)F c396f5182313396b015ef5614d0dd205 [0,2,0,0,0,0|1,0,0]=3 15715 B13R1.20 CCCC(C)Nc1cc(ccn1)I d86da961d9b18b9fd4d570b7085ebf62 [0,2,0,0,0,0|1,0,0]=3 15716 B13R1.20 CCCC(C)Nc1cc(cnn1)Br 957bb2a4173b51163ff65a8bc0d8acb9 [0,2,0,0,0,0|2,0,0]=4 15717 B13R1.20 CCCC(C)Nc1cc(cnn1)Cl 298c5439c442fed29eb4ac688142ed49 [0,2,0,0,0,0|2,0,0]=4 15718 B13R1.20 CCCC(C)Nc1cc(ncn1)Br 62a0fb40c22056e10cb21a49e344edcf [0,2,0,0,0,0|2,0,0]=4 15719 B13R1.20 CCCC(C)Nc1cc(ncn1)C 06d2f8083e1de10005d7ca096dbf0eed [0,2,0,0,0,0|2,0,0]=4 15720 B13R1.20 CCCC(C)Nc1cc(ncn1)I 6a7f0684720ff21c21c4f9f8254b8efb [0,2,0,0,0,0|2,0,0]=4 15721 B13R1.20 CCCC(C)Nc1cc[nH]c(=O)n1 a9b0645e4988e4b891934e8db5da3f58 [0,2,0,0,0,0|2,0,0]=4 15722 B13R1.20 CCCC(C)Nc1cccc(c1)Br 303d895271a40defc1115eaf55ed15c2 [0,2,0,0,0,0|2,0,0]=4 15723 B13R1.20 CCCC(C)Nc1cccc(c1)C a3742919f0acaa0a4886ebf2e0b82736 [0,2,0,0,0,0|2,0,0]=4 15724 B13R1.20 CCCC(C)Nc1cccc(c1)Cl 8f8c3dfc4262466b18ccd97564ba88b3 [0,2,0,0,0,0|2,0,0]=4 15725 B13R1.20 CCCC(C)Nc1cccc(c1)F 6f36e06abdf0c5fd2cc041011089b2c8 [0,2,0,0,0,0|2,0,0]=4 15726 B13R1.20 CCCC(C)Nc1cccc(c1)I 4c6ad3da2f4c1c63ba50da7213913a46 [0,2,0,0,0,0|2,0,0]=4 15727 B13R1.20 CCCC(C)Nc1cccc(n1)C ad050022cc0b4d09bcc2a442b529cab3 [0,2,0,0,0,0|1,0,0]=3 15728 B13R1.20 CCCC(C)Nc1ccnc(n1)Br 3e60765e8227b4c0c31154f02fc874b3 [0,2,0,0,0,0|2,0,0]=4 15729 B13R1.20 CCCC(C)Nc1ccnc(n1)C 95a35afb0eebe8d2268d2edd7b470caf [0,2,0,0,0,0|2,0,0]=4 15730 B13R1.20 CCCC(C)Nc1ccnc(n1)Cl 4ec407b01c60c7c19224a89656a7800e [0,2,0,0,0,0|2,0,0]=4 15731 B13R1.20 CCCC(C)Nc1ccnc(n1)F 6c75e875618ef6eefccc98b3c720bb73 [0,2,0,0,0,0|2,0,0]=4 15732 B13R1.20 CCCC(C)Nc1nccc(=O)[nH]1 3e71c4130977d162d79ffa84cceea4fa [0,2,0,0,0,0|2,0,0]=4 15733 B13R1.20 CCCC(C)Nc1nccc(n1)Br 14ca3156f9e5ba1b181b6b9f90e176a2 [0,2,0,0,0,0|2,0,0]=4 15734 B13R1.20 CCCC(C)Nc1nccc(n1)C 15171364488a59b1fe8b9140b102f11e [0,2,0,0,0,0|2,0,0]=4 15735 B13R1.20 CCCC(C)Nc1nccc(n1)F 146e4daad79a0f339f810fcabc108833 [0,2,0,0,0,0|2,0,0]=4 15736 B13R1.20 CCCC(C)Oc1cc(ccn1)Br 4aa1dc514a62fa3039e4f78db9173ec0 [0,2,0,0,0,0|1,0,0]=3 15737 B13R1.20 CCCC(C)Oc1cc(ccn1)C 4e9edb552cbdf14063eafb638295d147 [0,2,0,0,0,0|1,0,0]=3 15738 B13R1.20 CCCC(C)Oc1cc(ccn1)Cl 48ab3fe562ae0f604686eeb1bf2923b6 [0,2,0,0,0,0|1,0,0]=3 15739 B13R1.20 CCCC(C)Oc1cc(ccn1)F 75a67063db9fb60568d7c337049aec91 [0,2,0,0,0,0|1,0,0]=3 15740 B13R1.20 CCCC(C)Oc1cc(ncn1)Br 7e0f2e23db95b3201e44d65988955015 [0,2,0,0,0,0|2,0,0]=4 15741 B13R1.20 CCCC(C)Oc1cc(ncn1)C 0481c0bce52c2b3ced41263980abebf2 [0,2,0,0,0,0|2,0,0]=4 15742 B13R1.20 CCCC(C)Oc1cc(ncn1)Cl 4737b74ece39713dcfe77d70e439403a [0,2,0,0,0,0|2,0,0]=4 15743 B13R1.20 CCCC(C)Oc1cccc(c1)Br 89f1e5e64003c87d04ec7ef3131b0261 [0,2,0,0,0,0|2,0,0]=4 15744 B13R1.20 CCCC(C)Oc1cccc(c1)C d7efed964ed1127af67f597e5ec5e8d0 [0,2,0,0,0,0|2,0,0]=4 15745 B13R1.20 CCCC(C)Oc1cccc(c1)Cl 5e381a51844bb86c47bba6f8f02cb6a7 [0,2,0,0,0,0|2,0,0]=4 15746 B13R1.20 CCCC(C)Oc1cccc(c1)F dc2f565145a23c87426a7c56416bbaa8 [0,2,0,0,0,0|2,0,0]=4 15747 B13R1.20 CCCC(C)Oc1cccc(c1)I 3cbcf8bc526caa9f7fdf32144c433b6d [0,2,0,0,0,0|2,0,0]=4 15748 B13R1.20 CCCC(C)Oc1cccc(c1)S 3eeee7e0e37ee9de83cc9a0dbb49dd39 [0,2,0,0,0,0|2,0,0]=4 15749 B13R1.20 CCCC(C)Oc1cccc(n1)Br 9217cd030bbbe4810270d1b611ff3676 [0,2,0,0,0,0|1,0,0]=3 15750 B13R1.20 CCCC(C)Oc1cccc(n1)C fd33101cbe02f6bc3fc5d632e2a3cb6e [0,2,0,0,0,0|1,0,0]=3 15751 B13R1.20 CCCC(C)Oc1cccc(n1)F 51713685c59e8ed2be44e10e5b992c78 [0,2,0,0,0,0|1,0,0]=3 15752 B13R1.20 CCCC(C)Oc1ccnc(n1)C 3af33ceed3eb89bc1c02a082256a5463 [0,2,0,0,0,0|2,0,0]=4 15753 B13R1.20 CCCC(C)Oc1ccnc(n1)Cl fcb4ff87899ff4343383fefbe645abb5 [0,2,0,0,0,0|2,0,0]=4 15754 B13R1.20 CCCC(C)Oc1cncc(n1)Cl 01f80275ca1159e0b7f69be6996bb71f [0,2,0,0,0,0|2,0,0]=4 15755 B13R1.20 CCCC(C)Oc1nccc(n1)Cl 560464fa362429e6e0a84ddf9347d612 [0,2,0,0,0,0|2,0,0]=4 15756 B13R1.20 CCCC(C)Oc1nccc(n1)S fd02aa599aa39f60d6dfcee3ea1c53ce [0,2,0,0,0,0|2,0,0]=4 15757 B13R1.20 CCCN(C)Cc1cc(ccn1)Br ab9985badf861dcdae7eb8306b80e2ef [0,2,0,0,0,0|1,0,0]=3 15758 B13R1.20 CCCN(C)Cc1cc(ccn1)C 26be08db7e7f3df845b705b9d7ac043f [0,2,0,0,0,0|1,0,0]=3 15759 B13R1.20 CCCN(C)Cc1cc(ccn1)Cl e2f5eb2e02687003ab2368ad81733f5a [0,2,0,0,0,0|1,0,0]=3 15760 B13R1.20 CCCN(C)Cc1cccc(c1)Br a597ef3745c2d38e97ef51a5078be4da [0,2,0,0,0,0|2,0,0]=4 15761 B13R1.20 CCCN(C)Cc1cccc(c1)C c3c715842a086ae3cb4f2b1727438a32 [0,2,0,0,0,0|2,0,0]=4 15762 B13R1.20 CCCN(C)Cc1cccc(c1)Cl a6a0c166d85137d136d769cd3d195e58 [0,2,0,0,0,0|2,0,0]=4 15763 B13R1.20 CCCN(C)Cc1cccc(c1)F 0de8c397d5ac8c2d62a3b2eac31e7cc5 [0,2,0,0,0,0|2,0,0]=4 15764 B13R1.20 CCCN(C)Cc1cccc(c1)I 16c0e582460ed684da1473e40e742aae [0,2,0,0,0,0|2,0,0]=4 15765 B13R1.20 CCCN(C)Cc1cccc(n1)Br 0466c743638823bb108db1ae28cba4fa [0,2,0,0,0,0|1,0,0]=3 15766 B13R1.20 CCCN(C)Cc1cccc(n1)C 4db5fccb9c7c60199ded03bca12686d3 [0,2,0,0,0,0|1,0,0]=3 15767 B13R1.20 CCCN(C)Cc1cccc(n1)Cl b07f8f575faaf77c48ae5201cffd9470 [0,2,0,0,0,0|1,0,0]=3 15768 B13R1.20 CCCN(C)Cc1cccc(n1)F a541cb73772d676afee8b41128dc9867 [0,2,0,0,0,0|1,0,0]=3 15769 B13R1.20 CCCN(C)Cc1ccnc(n1)Cl b62633d2583bc2f62f0ca9fbb4369c2a [0,2,0,0,0,0|2,0,0]=4 15770 B13R1.20 CCCN(C)Cc1nccc(n1)C 1e954bb6b9c0f323af27c1289373cfb3 [0,2,0,0,0,0|2,0,0]=4 15771 B13R1.20 CCN[C@@H](C)Cc1cccc(c1)Cl c456e49f858a7ce6678944c5ae82c0fc [0,2,0,0,0,0|2,0,0]=4 15772 B13R1.20 CCOC(C)Cc1cc(ccn1)C 4441298e943247e5414863a691c165a6 [0,2,0,0,0,0|1,0,0]=3 15773 B13R1.20 CCOC(C)Cc1cccc(c1)C 9046d53424b42d14ed7ea1a6d84af16b [0,2,0,0,0,0|2,0,0]=4 15774 B13R1.20 CCOC(C)Cc1cccc(c1)F 9e479b2d2829091be4341f19c9b83a4c [0,2,0,0,0,0|2,0,0]=4 15775 B13R1.20 CCOC(C)Cc1cccc(n1)C db0d27942a93b8b19deff68cc3810215 [0,2,0,0,0,0|1,0,0]=3 15776 B13R1.20 CCOC(C)Cc1cccc(n1)F 302f1d4f2e58d96b918e963b0f458545 [0,2,0,0,0,0|1,0,0]=3 15777 B13R1.20 CN(CCF)Cc1cc(ccn1)Br ee49f66f716268e81e508a3f188254a5 [0,2,0,0,0,0|2,0,0]=4 15778 B13R1.20 CN(CCF)Cc1cc(ccn1)Cl 6d293bc942b5270b342fdb9903c49e7f [0,2,0,0,0,0|2,0,0]=4 15779 B13R1.20 CN(CCF)Cc1cccc(n1)Br 919115e7a95a352cbaeb57f29e28bbff [0,2,0,0,0,0|2,0,0]=4 15780 B13R1.20 CN(CCF)Cc1cccc(n1)Cl 6514a1d1a3a90afeb869d581a8556e34 [0,2,0,0,0,0|2,0,0]=4 15781 B13R1.20 CN(CCF)Cc1cccc(n1)F 115a545cae3772f743d46ec19c4e3324 [0,2,0,0,0,0|2,0,0]=4 15782 B13R1.20 CN(CCO)Cc1cc(ccn1)Br 1680a2b1c7ed54ee25343c39a5c95ac8 [0,2,0,0,0,0|2,0,0]=4 15783 B13R1.20 CN(CCO)Cc1cc(ccn1)Cl 8c45e31173e85f132ab5add6ac1348d7 [0,2,0,0,0,0|2,0,0]=4 15784 B13R1.20 CN(CCO)Cc1cccc(n1)Br 880051d370625a8628901ce8b4e218e7 [0,2,0,0,0,0|2,0,0]=4 15785 B13R1.20 CN(CCO)Cc1cccc(n1)Cl 4145f95429890d375ed5cf1628494c55 [0,2,0,0,0,0|2,0,0]=4 15786 B13R1.20 CN(CCO)Cc1cccc(n1)F 39624e647c30472705c30aedbbf31525 [0,2,0,0,0,0|2,0,0]=4 15787 B13R1.20 CN(CCS)Cc1cc(ccn1)Cl e8d6ccac8388f0e2d74752bd9aa3054e [0,2,0,0,0,0|2,0,0]=4 15788 B13R1.20 CN(CCS)Cc1cccc(n1)Br cd81127e1223e03d6182be56fe8df756 [0,2,0,0,0,0|2,0,0]=4 15789 B13R1.20 COCC(C)Nc1cc(ccn1)Br 21b08c1a121417be248db61eb0b5a455 [0,2,0,0,0,0|2,0,0]=4 15790 B13R1.20 COCC(C)Nc1cc(ccn1)C a9780210ec22c31eeab6f6865ece3fb9 [0,2,0,0,0,0|2,0,0]=4 15791 B13R1.20 COCC(C)Nc1cc(ccn1)Cl 0a7b8adee0b9e917779c04008a22629a [0,2,0,0,0,0|2,0,0]=4 15792 B13R1.20 COCC(C)Nc1cc(ccn1)F 9ea1eeb4f42aeddd656c179c354c2b4d [0,2,0,0,0,0|2,0,0]=4 15793 B13R1.20 COCC(C)Nc1cc(ccn1)I 7f82c99bf34beb737b367a2cb60c9901 [0,2,0,0,0,0|2,0,0]=4 15794 B13R1.20 COCC(C)Nc1cccc(n1)Br 292472cf8bb9ad291ace7a896e48e5ba [0,2,0,0,0,0|2,0,0]=4 15795 B13R1.20 COCC(C)Nc1cccc(n1)C ca48dff222926d1b90e0536033860b4f [0,2,0,0,0,0|2,0,0]=4 15796 B13R1.20 COCC(C)Nc1cccc(n1)Cl 50d17291e07d27b24bab710f566f220c [0,2,0,0,0,0|2,0,0]=4 15797 B13R1.20 COCC(C)Nc1cccc(n1)F 5413c8c92c08adfb5f2caaa1adda9ed8 [0,2,0,0,0,0|2,0,0]=4 15798 B13R1.20 COCC(C)Nc1cccc(n1)I 3b1ac33e5b177ba0f3bfb2cef2474c2e [0,2,0,0,0,0|2,0,0]=4 15799 B13R1.20 COCC(C)Oc1cc(ccn1)Br 4ab663db90aa034db516a4d3afd80790 [0,2,0,0,0,0|2,0,0]=4 15800 B13R1.20 COCC(C)Oc1cc(ccn1)C bffbdcb6f15004a8f50c575d423d99fd [0,2,0,0,0,0|2,0,0]=4 15801 B13R1.20 COCC(C)Oc1cc(ccn1)Cl b00bc54219a11cc45db59237012d36d7 [0,2,0,0,0,0|2,0,0]=4 15802 B13R1.20 COCC(C)Oc1cc(ccn1)F d20b5b0f422f7b1c90f4f2765fb1976b [0,2,0,0,0,0|2,0,0]=4 15803 B13R1.20 COCC(C)Oc1cccc(n1)Br 2a55c56392cdaa4cad815221480adca0 [0,2,0,0,0,0|2,0,0]=4 15804 B13R1.20 COCC(C)Oc1cccc(n1)C 2a261250e80280eb214a12b1eb5ff888 [0,2,0,0,0,0|2,0,0]=4 15805 B13R1.20 COCC(C)Oc1cccc(n1)F 69ce92eb1dc492914b5f9b0434d46b0a [0,2,0,0,0,0|2,0,0]=4 15806 B13R1.20 COCN(C)Cc1cc(ccn1)C 8d6942c93a83b301f73071cc86015bce [0,2,0,0,0,0|2,0,0]=4 15807 B13R1.20 COCN(C)Cc1cc(ccn1)Cl f46c47be7060c099f6949bba804e96d2 [0,2,0,0,0,0|2,0,0]=4 15808 B13R1.20 COCN(C)Cc1cccc(n1)Br 607fd6083216a1dbcb90cc7ed619495d [0,2,0,0,0,0|2,0,0]=4 15809 B13R1.20 COCN(C)Cc1cccc(n1)C 1cf011d1ea56449c10d04ac8d4a480ea [0,2,0,0,0,0|2,0,0]=4 15810 B13R1.20 CSCN(C)Cc1cc(ccn1)C f09b12f4ce0069ff140fb1a7e59906fb [0,2,0,0,0,0|2,0,0]=4 15811 B13R1.20 CSCN(C)Cc1cc(ccn1)Cl 9687d92c07d356aadb5f834e9c97233e [0,2,0,0,0,0|2,0,0]=4 15812 B13R1.20 CSCN(C)Cc1cccc(n1)Br 2be76417aa3ac25ec0100e20d8ae6fa0 [0,2,0,0,0,0|2,0,0]=4 15813 B13R1.20 CSCN(C)Cc1cccc(n1)C 91b122b152cb50fc8216ebb7c2db285a [0,2,0,0,0,0|2,0,0]=4 15814 B13R1.20 Cc1cccc(n1)CC(C)OCF 3a33e7389d1a50c5009769b97b1006d4 [0,2,0,0,0,0|2,0,0]=4 15815 B13R1.20 Cc1cccc(n1)CN(C)CCF 11d070130da0d07187645b5c34489d97 [0,2,0,0,0,0|2,0,0]=4 15816 B13R1.20 Cc1cccc(n1)CN(C)CCO 693e99309ea8d7c83a8ede0405c7cdee [0,2,0,0,0,0|2,0,0]=4 15817 B13R1.20 Cc1cccc(n1)CN(C)CCS 4edde0e228ad9027f77f393992c3a958 [0,2,0,0,0,0|2,0,0]=4 15818 B13R1.20 Cc1ccnc(c1)CC(C)OCF 48e8ea9ef065bf8971e9b65945dbb91a [0,2,0,0,0,0|2,0,0]=4 15819 B13R1.20 Cc1ccnc(c1)CN(C)CCF cf042df23cfa043212d5f8efa1648a20 [0,2,0,0,0,0|2,0,0]=4 15820 B13R1.20 Cc1ccnc(c1)CN(C)CCO 2365fe6eeadbbef3fbba86ee2b422514 [0,2,0,0,0,0|2,0,0]=4 15821 B13R1.20 Cc1ccnc(c1)CN(C)CCS 9fff2576cad2abce169e71dd07f6bbd1 [0,2,0,0,0,0|2,0,0]=4 15822 B13R1.20 Cc1ccnc(c1)NC(C)CCO 348b4f37d4d340459a8225ee291c8adc [0,2,0,0,0,0|2,0,0]=4 15823 B13R1.55 CCCCNc1cc([nH]c(=O)n1)Cl cc44808626a2be9b91ca26426d72ec56 [0,2,0,0,0,0|2,0,0]=4 15824 B13R1.55 CCCCNc1cc(cc(c1)Br)Br 17770aaae9537c113696a436179f2550 [0,2,0,0,0,0|2,0,0]=4 15825 B13R1.55 CCCCNc1cc(cc(c1)Br)C 5b4e7f504c6132cdbb9ef003017ba00c [0,2,0,0,0,0|2,0,0]=4 15826 B13R1.55 CCCCNc1cc(cc(c1)Br)Cl 1b74c99263c9ed10216de93c9aa02b62 [0,2,0,0,0,0|2,0,0]=4 15827 B13R1.55 CCCCNc1cc(cc(c1)Br)F a515c6cd1e42ddf78dda215b7d34bd54 [0,2,0,0,0,0|2,0,0]=4 15828 B13R1.55 CCCCNc1cc(cc(c1)C)C 2334a76bec4984fc2b328e0a399786db [0,2,0,0,0,0|2,0,0]=4 15829 B13R1.55 CCCCNc1cc(cc(c1)Cl)C 1b2a82753e87914d9f25834409e8d505 [0,2,0,0,0,0|2,0,0]=4 15830 B13R1.55 CCCCNc1cc(cc(c1)Cl)Cl 88d9e15c0b4c17a8d9538185df2cca57 [0,2,0,0,0,0|2,0,0]=4 15831 B13R1.55 CCCCNc1cc(cc(c1)Cl)F a7b6f14fa7118b4225447ab162a60a68 [0,2,0,0,0,0|2,0,0]=4 15832 B13R1.55 CCCCNc1cc(cc(c1)F)C 9f4ebb1d436fc224044cf844f93eb074 [0,2,0,0,0,0|2,0,0]=4 15833 B13R1.55 CCCCNc1cc(cc(c1)F)F f3460dc5a15087ddba79bf541a9a8e58 [0,2,0,0,0,0|2,0,0]=4 15834 B13R1.55 CCCCNc1cc(cc(c1)I)Br a52569bd320392c66f3de812dfbb6510 [0,2,0,0,0,0|2,0,0]=4 15835 B13R1.55 CCCCNc1cc(cc(c1)I)C de1182933787646d1026052f7cd307f3 [0,2,0,0,0,0|2,0,0]=4 15836 B13R1.55 CCCCNc1cc(cc(c1)I)Cl 98bd87d0760a0ff64c21ed2bb3668b25 [0,2,0,0,0,0|2,0,0]=4 15837 B13R1.55 CCCCNc1cc(cc(c1)I)F fd39698c12fa35c115150641f79b0712 [0,2,0,0,0,0|2,0,0]=4 15838 B13R1.55 CCCCNc1cc(cc(c1)I)I 99acd910998c80dfff3eb1ecc4d53db7 [0,2,0,0,0,0|2,0,0]=4 15839 B13R1.55 CCCCNc1cc(cc(c1)N)N d838ef6e7ff87dfccbe35df91450d8e5 [0,2,0,0,0,0|2,0,0]=4 15840 B13R1.55 CCCCNc1cc(cc(c1)O)C 7314de57b506c6a97d57103b228d4f18 [0,2,0,0,0,0|2,0,0]=4 15841 B13R1.55 CCCCNc1cc(cc(c1)S)F f5b26d0fbbf90f73e96a1eb256b9b867 [0,2,0,0,0,0|2,0,0]=4 15842 B13R1.55 CCCCNc1cc(cc(c1)S)S 8ab98f888d64bf9d0df1f5c2c4f8ef79 [0,2,0,0,0,0|2,0,0]=4 15843 B13R1.55 CCCCNc1cc(cc(n1)Br)Br 65f87a924f3106646e896e213f2b5e58 [0,2,0,0,0,0|1,0,0]=3 15844 B13R1.55 CCCCNc1cc(cc(n1)Br)C 4547992f52841a252215f543bdf12413 [0,2,0,0,0,0|1,0,0]=3 15845 B13R1.55 CCCCNc1cc(cc(n1)Br)Cl 4759be221c8d59eea35a5ef79fafdd57 [0,2,0,0,0,0|1,0,0]=3 15846 B13R1.55 CCCCNc1cc(cc(n1)C)Br 2727197cb731e02c81a1c4cfe891b71d [0,2,0,0,0,0|1,0,0]=3 15847 B13R1.55 CCCCNc1cc(cc(n1)C)C 8b39ab96fd5e0def86cb819d09df8072 [0,2,0,0,0,0|1,0,0]=3 15848 B13R1.55 CCCCNc1cc(cc(n1)C)Cl a572899237c34722c5f9beec1b728a32 [0,2,0,0,0,0|1,0,0]=3 15849 B13R1.55 CCCCNc1cc(cc(n1)Cl)Br e8e9d101717f3ef8fb8908762044c385 [0,2,0,0,0,0|1,0,0]=3 15850 B13R1.55 CCCCNc1cc(cc(n1)Cl)C ea6a20ba227c1def3430c6e014406359 [0,2,0,0,0,0|1,0,0]=3 15851 B13R1.55 CCCCNc1cc(cc(n1)Cl)Cl aef82db45631db5c7b5153b5adfa2c05 [0,2,0,0,0,0|1,0,0]=3 15852 B13R1.55 CCCCNc1cc(cc(n1)Cl)F 487d8628580163c33e3765bf3c929f46 [0,2,0,0,0,0|1,0,0]=3 15853 B13R1.55 CCCCNc1cc(cc(n1)Cl)I edf29d7a8bfc6162027514bcef87fc91 [0,2,0,0,0,0|1,0,0]=3 15854 B13R1.55 CCCCNc1cc(cc(n1)F)Br c55214b26c556a6071bdc134e18b5ecb [0,2,0,0,0,0|1,0,0]=3 15855 B13R1.55 CCCCNc1cc(cc(n1)F)C 3e21ee036873d8582dc69050def91c4e [0,2,0,0,0,0|1,0,0]=3 15856 B13R1.55 CCCCNc1cc(nc(n1)Br)C 9ecb3c0264274c3dbea4fed702b522d8 [0,2,0,0,0,0|2,0,0]=4 15857 B13R1.55 CCCCNc1cc(nc(n1)C)Br 41fe7f50b144d219f14a2819059ebf2f [0,2,0,0,0,0|2,0,0]=4 15858 B13R1.55 CCCCNc1cc(nc(n1)C)C 4e8a7cbe8a72c6c5263165f8c9b14985 [0,2,0,0,0,0|2,0,0]=4 15859 B13R1.55 CCCCNc1cc(nc(n1)C)Cl c55d327cda84fa4d857f4e685994a2ad [0,2,0,0,0,0|2,0,0]=4 15860 B13R1.55 CCCCNc1cc(nc(n1)C)I cb2649d257a2a301bf03945479a951b9 [0,2,0,0,0,0|2,0,0]=4 15861 B13R1.55 CCCCNc1cc(nc(n1)Cl)Br 5bde4b1e1f69eee98ecc2751aea6aa44 [0,2,0,0,0,0|2,0,0]=4 15862 B13R1.55 CCCCNc1cc(nc(n1)Cl)C 146e16982483189c00b63fb263c3ec21 [0,2,0,0,0,0|2,0,0]=4 15863 B13R1.55 CCCCNc1cc(nc(n1)Cl)Cl c92ab989ec416232957c1373695f1677 [0,2,0,0,0,0|2,0,0]=4 15864 B13R1.55 CCCCNc1cc(nc(n1)F)F dcd335df14be9ff2507ec50797029ecf [0,2,0,0,0,0|2,0,0]=4 15865 B13R1.55 CCCCNc1cc(nc(n1)N)N d4cb16acdbf92e71f1f83d30da49586f [0,2,0,0,0,0|2,0,0]=4 15866 B13R1.55 CCCCNc1cc(nc(n1)S)C 80f44ad66a46a06cfc455cd11f341520 [0,2,0,0,0,0|2,0,0]=4 15867 B13R1.55 CCCCNc1nc(cc(n1)Br)Br a97e9e10c5cf06ab12e2b06961866eab [0,2,0,0,0,0|2,0,0]=4 15868 B13R1.55 CCCCNc1nc(cc(n1)Br)C fb1c2434817ae84da5a4c12a7338c70f [0,2,0,0,0,0|2,0,0]=4 15869 B13R1.55 CCCCNc1nc(cc(n1)C)C cd99f027410ab09f319b66919f771404 [0,2,0,0,0,0|2,0,0]=4 15870 B13R1.55 CCCCNc1nc(cc(n1)Cl)C 2b3a21abceb790e1f174ce85d867aa63 [0,2,0,0,0,0|2,0,0]=4 15871 B13R1.55 CCCCNc1nc(cc(n1)Cl)Cl 9973cf1d5152d76fa3294e208ba3de13 [0,2,0,0,0,0|2,0,0]=4 15872 B13R1.55 CCCCNc1nc(cc(n1)F)C bdb92266916c825f1cdcba503efb67d6 [0,2,0,0,0,0|2,0,0]=4 15873 B13R1.55 CCCCNc1nc(cc(n1)F)F a4d5c4632a2ef79efa85d4c76beaaef2 [0,2,0,0,0,0|2,0,0]=4 15874 B13R1.55 CCCCNc1nc(cc(n1)I)C d6a2c92163be44b12c5dc171210744fa [0,2,0,0,0,0|2,0,0]=4 15875 B13R1.55 CCCCNc1nc(cc(n1)I)I 92023ce47e74350113fdfc16d0515886 [0,2,0,0,0,0|2,0,0]=4 15876 B13R1.55 CCCCNc1nc(cc(n1)S)C c8ee46f0407513fff807028ab0c66a90 [0,2,0,0,0,0|2,0,0]=4 15877 B13R1.55 CCCCOc1cc(=O)cc(o1)C 80d0a66c4fe3f1a0be8220710f01bef3 [0,2,0,0,0,0|2,0,0]=4 15878 B13R1.55 CCCCOc1cc(cc(c1)Br)Br c6072daa6dc4b71c52c7007b1ccd42e9 [0,2,0,0,0,0|2,0,0]=4 15879 B13R1.55 CCCCOc1cc(cc(c1)Br)C 58ccb7e81812fa8781b14b99412ccb9a [0,2,0,0,0,0|2,0,0]=4 15880 B13R1.55 CCCCOc1cc(cc(c1)Br)Cl 9125dd70be03bfa0599d2f405d0d8286 [0,2,0,0,0,0|2,0,0]=4 15881 B13R1.55 CCCCOc1cc(cc(c1)Br)F 4ccc7130d7a7ec174c48d54ff934056d [0,2,0,0,0,0|2,0,0]=4 15882 B13R1.55 CCCCOc1cc(cc(c1)C)C c7059d17f402c5f4c88492595e87c639 [0,2,0,0,0,0|2,0,0]=4 15883 B13R1.55 CCCCOc1cc(cc(c1)Cl)C 9d18c5528846ddc60859bb4100a060c0 [0,2,0,0,0,0|2,0,0]=4 15884 B13R1.55 CCCCOc1cc(cc(c1)Cl)Cl 748c638011e4ea5782b7cc85dad600d3 [0,2,0,0,0,0|2,0,0]=4 15885 B13R1.55 CCCCOc1cc(cc(c1)Cl)F 82d916a050916916213ef5e1bcaeb3a4 [0,2,0,0,0,0|2,0,0]=4 15886 B13R1.55 CCCCOc1cc(cc(c1)F)C 71e2cb7cf362409abe6ade45a62bfcfa [0,2,0,0,0,0|2,0,0]=4 15887 B13R1.55 CCCCOc1cc(cc(c1)F)F 3cd89e893dfda31ef0bb423d281f8d5b [0,2,0,0,0,0|2,0,0]=4 15888 B13R1.55 CCCCOc1cc(cc(c1)I)Br fa8aa9335a4e9697c9efb47ba3712ff6 [0,2,0,0,0,0|2,0,0]=4 15889 B13R1.55 CCCCOc1cc(cc(c1)I)C e855cd493351dc669cb82b7eac880e6d [0,2,0,0,0,0|2,0,0]=4 15890 B13R1.55 CCCCOc1cc(cc(c1)I)Cl 2bac309e0f0a8f8c313a03d6eb947f0f [0,2,0,0,0,0|2,0,0]=4 15891 B13R1.55 CCCCOc1cc(cc(c1)I)F 04e9e540994e2fd8eb4ce053ab64fd87 [0,2,0,0,0,0|2,0,0]=4 15892 B13R1.55 CCCCOc1cc(cc(n1)Br)C 07f1d8093a55e4efb708e0e08aaa574a [0,2,0,0,0,0|1,0,0]=3 15893 B13R1.55 CCCCOc1cc(cc(n1)C)Br da06e2488a5fc9f343d9f7b002c3a83f [0,2,0,0,0,0|1,0,0]=3 15894 B13R1.55 CCCCOc1cc(cc(n1)C)C 4b3068080370c513e3c5d91657cf1a24 [0,2,0,0,0,0|1,0,0]=3 15895 B13R1.55 CCCCOc1cc(cc(n1)C)Cl fd99eb83676320003180d4ab2db45958 [0,2,0,0,0,0|1,0,0]=3 15896 B13R1.55 CCCCOc1cc(cc(n1)C)F a0b08a75daaa7886af2d6f9b282c90ec [0,2,0,0,0,0|1,0,0]=3 15897 B13R1.55 CCCCOc1cc(cc(n1)Cl)Br c10910b8216b9e30d05079210f0a6f20 [0,2,0,0,0,0|1,0,0]=3 15898 B13R1.55 CCCCOc1cc(cc(n1)Cl)C 158d0718490e8fc39085164ebeab07da [0,2,0,0,0,0|1,0,0]=3 15899 B13R1.55 CCCCOc1cc(cc(n1)Cl)Cl 999047ea4744e4bea56d91d0a6b3dfab [0,2,0,0,0,0|1,0,0]=3 15900 B13R1.55 CCCCOc1cc(nc(n1)C)Br eb656558f8a6b4549d613a53ef75f24f [0,2,0,0,0,0|2,0,0]=4 15901 B13R1.55 CCCCOc1cc(nc(n1)C)C dc98652a32fc78443997d70eb159f6dc [0,2,0,0,0,0|2,0,0]=4 15902 B13R1.55 CCCCOc1cc(nc(n1)C)Cl a1c90c8754891bca937af803ceeecd9f [0,2,0,0,0,0|2,0,0]=4 15903 B13R1.55 CCCCOc1cc(nc(n1)Cl)C 25719f53ca5ba716c262dd4baa50914a [0,2,0,0,0,0|2,0,0]=4 15904 B13R1.55 CCCCOc1cc(nc(n1)S)C 0cca1c1246a76093d597e936c7f1180e [0,2,0,0,0,0|2,0,0]=4 15905 B13R1.55 CCCCOc1nc(cc(n1)C)C 425589960affd748992577f7f945faf9 [0,2,0,0,0,0|2,0,0]=4 15906 B13R1.55 CCCCOc1nc(cc(n1)S)C 48d248a1bc4a095f77ac144d3a76fd7c [0,2,0,0,0,0|2,0,0]=4 15907 B13R1.55 CCCNCc1cc(=O)cc(o1)C 0abaecce1c4269b70fc0505bf8335b56 [0,2,0,0,0,0|2,0,0]=4 15908 B13R1.55 CCCNCc1cc(cc(c1)Br)Br 3fe3a8d916e7d3e5d2c71c21130dfe09 [0,2,0,0,0,0|2,0,0]=4 15909 B13R1.55 CCCNCc1cc(cc(c1)Br)C 2b24fb2b8cc0e1e623e0698f969ea07f [0,2,0,0,0,0|2,0,0]=4 15910 B13R1.55 CCCNCc1cc(cc(c1)Br)Cl 1cf4e478e3c8eaa75b7dfb5d7a495ce5 [0,2,0,0,0,0|2,0,0]=4 15911 B13R1.55 CCCNCc1cc(cc(c1)Br)F 29eb8d81886d46c7c13adeb10c16f1c9 [0,2,0,0,0,0|2,0,0]=4 15912 B13R1.55 CCCNCc1cc(cc(c1)C)C 60bd0531923104ea06c2e76bc1890770 [0,2,0,0,0,0|2,0,0]=4 15913 B13R1.55 CCCNCc1cc(cc(c1)Cl)C 0e61726961a57b928a182f67f091ad03 [0,2,0,0,0,0|2,0,0]=4 15914 B13R1.55 CCCNCc1cc(cc(c1)Cl)Cl 92b641537dc8a4bcf56662eca0c609a2 [0,2,0,0,0,0|2,0,0]=4 15915 B13R1.55 CCCNCc1cc(cc(c1)Cl)F 717dd5d98f1a26bbfe4849eb49f37eb0 [0,2,0,0,0,0|2,0,0]=4 15916 B13R1.55 CCCNCc1cc(cc(c1)F)C fa1c340c6d42784ac9127fffc5feba85 [0,2,0,0,0,0|2,0,0]=4 15917 B13R1.55 CCCNCc1cc(cc(c1)F)F 834cd7c0ff30e072b2795f407f5f852d [0,2,0,0,0,0|2,0,0]=4 15918 B13R1.55 CCCNCc1cc(cc(c1)I)Br 36586a7ac5f5ae48230d4420c321020f [0,2,0,0,0,0|2,0,0]=4 15919 B13R1.55 CCCNCc1cc(cc(c1)I)Cl af099cc204bd6b74d966c90b4bfbe97b [0,2,0,0,0,0|2,0,0]=4 15920 B13R1.55 CCCNCc1cc(cc(c1)I)F 808aef1517b9e98c8054b6249650242c [0,2,0,0,0,0|2,0,0]=4 15921 B13R1.55 CCCNCc1cc(cc(c1)I)I 77e65c48b3a25699264c02ecede56b59 [0,2,0,0,0,0|2,0,0]=4 15922 B13R1.55 CCCNCc1cc(cc(n1)C)C 1cefa7fb0ad1cb71f5d4c040d18182d3 [0,2,0,0,0,0|1,0,0]=3 15923 B13R1.55 CCCNCc1cc(cc(n1)Cl)Cl 2d1031efdca85b27e5886cb1237e35c6 [0,2,0,0,0,0|1,0,0]=3 15924 B13R1.55 CCCNCc1nc(=O)cc([nH]1)Cl 4be6f33a45e8335b4b423b893f25859a [0,2,0,0,0,0|2,0,0]=4 15925 B13R1.55 CCCNCc1nc(cc(n1)C)C 79eb064bfe47159f2ec4a615f20e75ae [0,2,0,0,0,0|2,0,0]=4 15926 B13R1.55 CCCNCc1nc(cc(n1)Cl)C 637828a80443510cbb50e29ec5fd08a7 [0,2,0,0,0,0|2,0,0]=4 15927 B13R1.55 CCCNCc1nc(cc(n1)Cl)Cl 4eb747fa72fc143bd5997efaa7fca39a [0,2,0,0,0,0|2,0,0]=4 15928 B13R1.55 CCCOCc1cc(=O)cc(o1)C 9a142c2ff31c2b5a325744a9ac77efa4 [0,2,0,0,0,0|2,0,0]=4 15929 B13R1.55 CCCOCc1cc(cc(c1)Br)Br 63d2ca376587ca87621b9aff93d105c7 [0,2,0,0,0,0|2,0,0]=4 15930 B13R1.55 CCCOCc1cc(cc(c1)Br)C 5e65c0e5e7d566db9b5b4930a2943af2 [0,2,0,0,0,0|2,0,0]=4 15931 B13R1.55 CCCOCc1cc(cc(c1)Br)Cl 95b706a027fc0355a1da9161b5ce1afa [0,2,0,0,0,0|2,0,0]=4 15932 B13R1.55 CCCOCc1cc(cc(c1)Br)F ad0aab384cc4ed52f9101f5b8cb8acf8 [0,2,0,0,0,0|2,0,0]=4 15933 B13R1.55 CCCOCc1cc(cc(c1)C)C a5f2c26fc4b0567b488c1d5b512d92d0 [0,2,0,0,0,0|2,0,0]=4 15934 B13R1.55 CCCOCc1cc(cc(c1)Cl)C 8b90eef81e6c96f38ce731285d023e01 [0,2,0,0,0,0|2,0,0]=4 15935 B13R1.55 CCCOCc1cc(cc(c1)Cl)Cl cba34766550b17ce74f024f3afa3e811 [0,2,0,0,0,0|2,0,0]=4 15936 B13R1.55 CCCOCc1cc(cc(c1)Cl)F 9b2b83d91d4c264b428f000a4039fee9 [0,2,0,0,0,0|2,0,0]=4 15937 B13R1.55 CCCOCc1cc(cc(c1)F)C 9231c471d152f71884fcf185cdae48a0 [0,2,0,0,0,0|2,0,0]=4 15938 B13R1.55 CCCOCc1cc(cc(c1)F)F 3660b68a3430ee2a057cb32c1d73592e [0,2,0,0,0,0|2,0,0]=4 15939 B13R1.55 CCCOCc1cc(cc(c1)I)Br da7387d136912b2cbae0c40c6c6e04f3 [0,2,0,0,0,0|2,0,0]=4 15940 B13R1.55 CCCOCc1cc(cc(c1)I)C 03cc4fe701c64dbb29d6d6179d64f0f4 [0,2,0,0,0,0|2,0,0]=4 15941 B13R1.55 CCCOCc1cc(cc(c1)I)Cl e9ad89978c6db581321ed8fec43e34eb [0,2,0,0,0,0|2,0,0]=4 15942 B13R1.55 CCCOCc1cc(cc(c1)I)F 6ff4b22e90593c14697da35e6023b1e4 [0,2,0,0,0,0|2,0,0]=4 15943 B13R1.55 CCCOCc1cc(cc(c1)I)I f619095cb964e512ea4daf47e523aba5 [0,2,0,0,0,0|2,0,0]=4 15944 B13R1.55 CCCOCc1cc(cc(c1)O)O b1f7ea8f8744295befe73ccd6a5d9599 [0,2,0,0,0,0|2,0,0]=4 15945 B13R1.55 CCCOCc1cc(cc(n1)Br)Br 4f987b635de4e24c509c064cb48f13c8 [0,2,0,0,0,0|1,0,0]=3 15946 B13R1.55 CCCOCc1cc(cc(n1)Br)Cl 0656f5890ae96a96e56aecc171949f64 [0,2,0,0,0,0|1,0,0]=3 15947 B13R1.55 CCCOCc1cc(cc(n1)C)Br 5ae938b1168a996b87534a6ae74c3a4c [0,2,0,0,0,0|1,0,0]=3 15948 B13R1.55 CCCOCc1cc(cc(n1)C)C eec4cd875534d2af8ad33894075d0ad1 [0,2,0,0,0,0|1,0,0]=3 15949 B13R1.55 CCCOCc1cc(cc(n1)C)Cl ad36baa2a2f824f01cc1e86c979a95a3 [0,2,0,0,0,0|1,0,0]=3 15950 B13R1.55 CCCOCc1cc(cc(n1)Cl)Br 2b25a5c0ceba01420b838ced75fe4853 [0,2,0,0,0,0|1,0,0]=3 15951 B13R1.55 CCCOCc1cc(cc(n1)Cl)C 470ef51db8d03721a8fd2994c39aca3c [0,2,0,0,0,0|1,0,0]=3 15952 B13R1.55 CCCOCc1cc(cc(n1)Cl)Cl 563f91852bbbfe645ca3014c82f33206 [0,2,0,0,0,0|1,0,0]=3 15953 B13R1.55 CCCOCc1cc(nc(n1)Cl)Cl 79faa0d6f7a55c01bddd4f0d8baf0113 [0,2,0,0,0,0|2,0,0]=4 15954 B13R1.55 CCCOCc1nc(=O)cc([nH]1)Cl 689b2ab648a3a7a6fa29f6393379b657 [0,2,0,0,0,0|2,0,0]=4 15955 B13R1.55 CCCOCc1nc(cc(n1)C)C 6c101da8f0cae74ba6b7dd64129c0b7e [0,2,0,0,0,0|2,0,0]=4 15956 B13R1.55 CCCOCc1nc(cc(n1)Cl)Cl 5d7785fc4bc4434e28654ee79049f902 [0,2,0,0,0,0|2,0,0]=4 15957 B13R1.55 CCNCCc1cc(cc(c1)Cl)Cl c6d3d3c053e71d72f85d2812bdac4642 [0,2,0,0,0,0|2,0,0]=4 15958 B13R1.55 CCNCCc1cc(cc(c1)F)F e80ac2f2724156418d5b430c74353643 [0,2,0,0,0,0|2,0,0]=4 15959 B13R1.55 CCOCCc1cc(cc(c1)Br)Br 7c264d4af71a4cb1f3a1bee2e07df916 [0,2,0,0,0,0|2,0,0]=4 15960 B13R1.55 CCOCCc1cc(cc(c1)Br)F 64117930d9197747e405630b3d91addd [0,2,0,0,0,0|2,0,0]=4 15961 B13R1.55 CCOCCc1cc(cc(c1)Cl)Cl 12369b317ae6776931db868d1a2dfc85 [0,2,0,0,0,0|2,0,0]=4 15962 B13R1.55 CCOCCc1cc(cc(c1)Cl)F 39feff05e042d418cf1f8d43040974ae [0,2,0,0,0,0|2,0,0]=4 15963 B13R1.55 CCOCCc1cc(cc(c1)F)F 491826104da9d54b0b401c1e613baa44 [0,2,0,0,0,0|2,0,0]=4 15964 B13R1.55 CCOCCc1cc(cc(n1)C)C d764bfd186046e946a5596c84bafb64b [0,2,0,0,0,0|1,0,0]=3 15965 B13R1.55 CCOCNc1cc(cc(n1)Br)Br 7b0cb31fcd16f891f862671b8a08f15b [0,2,0,0,0,0|2,0,0]=4 15966 B13R1.55 CCOCNc1cc(cc(n1)F)Br b44f4c935c745031e3064c7317d7ffc6 [0,2,0,0,0,0|2,0,0]=4 15967 B13R1.55 CCOCNc1cc(cc(n1)F)C c61d8ecdb8c3638505024e0dde430045 [0,2,0,0,0,0|2,0,0]=4 15968 B13R1.55 CCOCOc1cc(cc(n1)Cl)Br c3e23b1ffd73b855a936972e8fab8c24 [0,2,0,0,0,0|2,0,0]=4 15969 B13R1.55 CCOCOc1cc(cc(n1)Cl)Cl 279309945430325d284bc6956d60f0e8 [0,2,0,0,0,0|2,0,0]=4 15970 B13R1.55 COCCNc1cc(cc(n1)Br)Br 2110211b2f101fac2dd63e712043cad2 [0,2,0,0,0,0|2,0,0]=4 15971 B13R1.55 COCCNc1cc(cc(n1)Br)C 1543951d83ae2050dcfc6ec1c36d5a15 [0,2,0,0,0,0|2,0,0]=4 15972 B13R1.55 COCCNc1cc(cc(n1)Br)Cl 599ca078aed84a2e5687ea8085897288 [0,2,0,0,0,0|2,0,0]=4 15973 B13R1.55 COCCNc1cc(cc(n1)C)Br ad4190f895330e814ad18c49f82363a0 [0,2,0,0,0,0|2,0,0]=4 15974 B13R1.55 COCCNc1cc(cc(n1)C)C 86c0509ae5f58ef203be5067291d9b60 [0,2,0,0,0,0|2,0,0]=4 15975 B13R1.55 COCCNc1cc(cc(n1)C)Cl b2a9382956ca1d606118ec14af8472d8 [0,2,0,0,0,0|2,0,0]=4 15976 B13R1.55 COCCNc1cc(cc(n1)C)F 3e4f25d8e944acda4ae0ed3817d3112d [0,2,0,0,0,0|2,0,0]=4 15977 B13R1.55 COCCNc1cc(cc(n1)Cl)Br cec395a099e59e043d96ee208c46cf5e [0,2,0,0,0,0|2,0,0]=4 15978 B13R1.55 COCCNc1cc(cc(n1)Cl)C 3833ba69baf862d0014f80bd4167d5ac [0,2,0,0,0,0|2,0,0]=4 15979 B13R1.55 COCCNc1cc(cc(n1)Cl)Cl 259efc08d5969e6f900f54c11d630326 [0,2,0,0,0,0|2,0,0]=4 15980 B13R1.55 COCCNc1cc(cc(n1)Cl)F ed909fdd5b8971bbdb637715db2d5447 [0,2,0,0,0,0|2,0,0]=4 15981 B13R1.55 COCCNc1cc(cc(n1)Cl)I 9e9194058dfb42be15066bf67f2fe47f [0,2,0,0,0,0|2,0,0]=4 15982 B13R1.55 COCCNc1cc(cc(n1)F)Br 8ddb3b855ace309a9f2081ece5a77953 [0,2,0,0,0,0|2,0,0]=4 15983 B13R1.55 COCCNc1cc(cc(n1)F)C 2a3746b80408fc95b381df363aa0301a [0,2,0,0,0,0|2,0,0]=4 15984 B13R1.55 COCCNc1cc(cc(n1)F)F 637850e828ed3d5bea5479e9a2f97c99 [0,2,0,0,0,0|2,0,0]=4 15985 B13R1.55 COCCNc1cc(cc(n1)O)C 69bd0fcba17cc1c70f308fd720653e4a [0,2,0,0,0,0|2,0,0]=4 15986 B13R1.55 COCCOc1cc(cc(n1)Br)C d8473f066761a097f75dbb8b38d4310f [0,2,0,0,0,0|2,0,0]=4 15987 B13R1.55 COCCOc1cc(cc(n1)C)Br efb6bfd070593c40b899f7fcb6160d45 [0,2,0,0,0,0|2,0,0]=4 15988 B13R1.55 COCCOc1cc(cc(n1)C)C 82ae88ba0d5de9e4db33713dc70c03a6 [0,2,0,0,0,0|2,0,0]=4 15989 B13R1.55 COCCOc1cc(cc(n1)C)Cl ab132d7d6c3af44139194378169fc371 [0,2,0,0,0,0|2,0,0]=4 15990 B13R1.55 COCCOc1cc(cc(n1)C)F 2c1945908f50877f23180ebcb5df96e6 [0,2,0,0,0,0|2,0,0]=4 15991 B13R1.55 COCCOc1cc(cc(n1)Cl)Br a55a38ceb6a90fe859cf7f95e88625e4 [0,2,0,0,0,0|2,0,0]=4 15992 B13R1.55 COCCOc1cc(cc(n1)Cl)C 661e696320d3334ef86d3c678ae1711d [0,2,0,0,0,0|2,0,0]=4 15993 B13R1.55 COCCOc1cc(cc(n1)Cl)Cl d3b5dec5678dfe6ff5c6eaef3d19dbfd [0,2,0,0,0,0|2,0,0]=4 15994 B13R1.55 COCNCc1cc(cc(n1)C)Br 7d283fb64966235e3122e86847a38840 [0,2,0,0,0,0|2,0,0]=4 15995 B13R1.55 COCNCc1cc(cc(n1)Cl)Cl c13d27e11dc2c8244e965cc30faa7ebb [0,2,0,0,0,0|2,0,0]=4 15996 B13R1.55 COCOCc1cc(cc(n1)Br)Br 2b116764f3427305c4833d7c9a901bb6 [0,2,0,0,0,0|2,0,0]=4 15997 B13R1.55 COCOCc1cc(cc(n1)Br)Cl 8ecd10c1eb205ae4eeabac9dd0c5a1fa [0,2,0,0,0,0|2,0,0]=4 15998 B13R1.55 COCOCc1cc(cc(n1)C)Br 0a73ca09588913f6c03410c67f664b52 [0,2,0,0,0,0|2,0,0]=4 15999 B13R1.55 COCOCc1cc(cc(n1)C)C b0730c748144e4731bd52e2ac6c19efc [0,2,0,0,0,0|2,0,0]=4 16000 B13R1.55 COCOCc1cc(cc(n1)C)Cl 1722b6836a8d01e975870c6425e5a1d9 [0,2,0,0,0,0|2,0,0]=4 16001 B13R1.55 COCOCc1cc(cc(n1)Cl)Br 9e1ebab8b685d07f89e8a8644c907230 [0,2,0,0,0,0|2,0,0]=4 16002 B13R1.55 COCOCc1cc(cc(n1)Cl)C 2ccfdaafe6e0948148752e84a9ad9c9e [0,2,0,0,0,0|2,0,0]=4 16003 B13R1.55 COCOCc1cc(cc(n1)Cl)Cl 0f10ec8855b25de143f1f263adc12cb2 [0,2,0,0,0,0|2,0,0]=4 16004 B13R1.55 CSCCNc1cc(cc(n1)Br)Br 724c1eed48e1a92a7b937a3eb2b409fe [0,2,0,0,0,0|2,0,0]=4 16005 B13R1.55 CSCCNc1cc(cc(n1)Br)C e793f6d84e3080d4a7c4d2de892a1953 [0,2,0,0,0,0|2,0,0]=4 16006 B13R1.55 CSCCNc1cc(cc(n1)Br)Cl 38e9c51e44a896daf6f40fcf57db38a3 [0,2,0,0,0,0|2,0,0]=4 16007 B13R1.55 CSCCNc1cc(cc(n1)C)Br 4c82b55e1a7ce708ddfd24136696b0c1 [0,2,0,0,0,0|2,0,0]=4 16008 B13R1.55 CSCCNc1cc(cc(n1)C)C 31265b1c95882003f3742fdf682dae8e [0,2,0,0,0,0|2,0,0]=4 16009 B13R1.55 CSCCNc1cc(cc(n1)C)Cl 47a3a0c7d836f134f3c050cc4aba5a7d [0,2,0,0,0,0|2,0,0]=4 16010 B13R1.55 CSCCNc1cc(cc(n1)Cl)Br b00b3d15bf049733f6c5739f392c1afe [0,2,0,0,0,0|2,0,0]=4 16011 B13R1.55 CSCCNc1cc(cc(n1)Cl)C 85895a167630a6392a3117f0f3e01c30 [0,2,0,0,0,0|2,0,0]=4 16012 B13R1.55 CSCCNc1cc(cc(n1)Cl)Cl 59fc8f1dd3ef88aa3a1d049b0c5f206a [0,2,0,0,0,0|2,0,0]=4 16013 B13R1.55 CSCCNc1cc(cc(n1)Cl)F 4efa42d659a324638e01560ef54b919b [0,2,0,0,0,0|2,0,0]=4 16014 B13R1.55 CSCCNc1cc(cc(n1)Cl)I 20e7fe04934b5d29a10fa4d1f5dca3d1 [0,2,0,0,0,0|2,0,0]=4 16015 B13R1.55 CSCCNc1cc(cc(n1)F)Br dca5e163405997fb522d9e0f93db5992 [0,2,0,0,0,0|2,0,0]=4 16016 B13R1.55 CSCCNc1cc(cc(n1)F)C ea2e3253f26233a72f621087fd44e282 [0,2,0,0,0,0|2,0,0]=4 16017 B13R1.55 CSCCOc1cc(cc(n1)Br)C 9a88d4bbf0c6637787228672bf5d7990 [0,2,0,0,0,0|2,0,0]=4 16018 B13R1.55 CSCCOc1cc(cc(n1)C)Br b6d682136fbd0131cd415f24016d58a1 [0,2,0,0,0,0|2,0,0]=4 16019 B13R1.55 CSCCOc1cc(cc(n1)C)C e8e04972875cd04603aea697de82f044 [0,2,0,0,0,0|2,0,0]=4 16020 B13R1.55 CSCCOc1cc(cc(n1)C)Cl e018e8453f76d710b98cd1454fcd3a21 [0,2,0,0,0,0|2,0,0]=4 16021 B13R1.55 CSCCOc1cc(cc(n1)C)F 9eefc8e8507ee815324ee7b75f4a216f [0,2,0,0,0,0|2,0,0]=4 16022 B13R1.55 CSCCOc1cc(cc(n1)Cl)Br 5d501dc57d74e860c5766f2333946b80 [0,2,0,0,0,0|2,0,0]=4 16023 B13R1.55 CSCCOc1cc(cc(n1)Cl)C 73415f3da0467761e408603dd32cebda [0,2,0,0,0,0|2,0,0]=4 16024 B13R1.55 CSCCOc1cc(cc(n1)Cl)Cl f018444bc5b6af7687bdb70f19082b4d [0,2,0,0,0,0|2,0,0]=4 16025 B13R1.55 CSCNCc1cc(cc(n1)Cl)Cl f9bc4dac10255d6237e89ac2286a2ab7 [0,2,0,0,0,0|2,0,0]=4 16026 B13R1.55 CSCOCc1cc(cc(n1)Br)Br 660328c0539afb401cfd6e0170338c6d [0,2,0,0,0,0|2,0,0]=4 16027 B13R1.55 CSCOCc1cc(cc(n1)Br)Cl efb410f3a530eb3a2d834c523257dc47 [0,2,0,0,0,0|2,0,0]=4 16028 B13R1.55 CSCOCc1cc(cc(n1)C)C c2e423a3516a992ef5641f501f3c1d43 [0,2,0,0,0,0|2,0,0]=4 16029 B13R1.55 CSCOCc1cc(cc(n1)C)Cl c6c58e25290d6046db838205ba1ced54 [0,2,0,0,0,0|2,0,0]=4 16030 B13R1.55 CSCOCc1cc(cc(n1)Cl)Br ff86e3ebf76864337273559cb1544dfe [0,2,0,0,0,0|2,0,0]=4 16031 B13R1.55 CSCOCc1cc(cc(n1)Cl)C 125db5211fd673244aad5c07850f2b80 [0,2,0,0,0,0|2,0,0]=4 16032 B13R1.55 CSCOCc1cc(cc(n1)Cl)Cl 14f88dfe2390ff1831bacaad437452ba [0,2,0,0,0,0|2,0,0]=4 16033 B13R1.55 Cc1cc(cc(n1)CNCCO)Br 8a45226139749891e3606816fe860c05 [0,2,0,0,0,0|2,0,0]=4 16034 B13R1.55 Cc1cc(cc(n1)CNCCS)Br c70979bfae82268efe0922af65630da1 [0,2,0,0,0,0|2,0,0]=4 16035 B13R1.55 Cc1cc(cc(n1)COCCF)Br 8efc1edec4129bc5921556ddcf6e9d6c [0,2,0,0,0,0|2,0,0]=4 16036 B13R1.55 Cc1cc(cc(n1)COCCF)Cl 4bcc9aaa011a209eb8bb934e6ef7f24d [0,2,0,0,0,0|2,0,0]=4 16037 B13R1.55 Cc1cc(cc(n1)COCCS)Br a84e7876bd195a95ef42732fdbbe3b09 [0,2,0,0,0,0|2,0,0]=4 16038 B13R1.55 Cc1cc(cc(n1)COCCS)Cl dfd4638e6b633ba4c2003b815612a55d [0,2,0,0,0,0|2,0,0]=4 16039 B13R1.55 Cc1cc(cc(n1)NCCCF)Br 54714462e3328bc9bcac6f40228b4017 [0,2,0,0,0,0|2,0,0]=4 16040 B13R1.55 Cc1cc(cc(n1)NCCCF)Cl 643118c284ba498344a426a8464bdde8 [0,2,0,0,0,0|2,0,0]=4 16041 B13R1.55 Cc1cc(cc(n1)NCCCS)Br 52da9f520f74d02417b4efcfb60680db [0,2,0,0,0,0|2,0,0]=4 16042 B13R1.55 Cc1cc(cc(n1)NCCCS)Cl 904571c534f80c9d459e2d521cc5bea7 [0,2,0,0,0,0|2,0,0]=4 16043 B13R1.55 Cc1cc(cc(n1)OCCCF)Br 5b05adf2f8a41faf5beedbd08545bbfb [0,2,0,0,0,0|2,0,0]=4 16044 B13R1.55 Cc1cc(cc(n1)OCCCF)Cl 41dda44adfd8e71e635a4f719f50a93b [0,2,0,0,0,0|2,0,0]=4 16045 B13R1.55 Cc1cc(cc(n1)OCCCF)F 206bcf9a2121a866607100fe1b66a1e6 [0,2,0,0,0,0|2,0,0]=4 16046 B13R1.55 Cc1cc(cc(n1)OCCCS)Br 90c157dfdee57e179d32f99957757fd9 [0,2,0,0,0,0|2,0,0]=4 16047 B13R1.55 Cc1cc(cc(n1)OCCCS)Cl 446297a52d3257a4a3e2303ba66aba01 [0,2,0,0,0,0|2,0,0]=4 16048 B13R1.55 Cc1cc(cc(n1)OCCCS)F 7cd5ef1f2027244209b30de819ed40dc [0,2,0,0,0,0|2,0,0]=4 16049 B13R1.55 Cc1cc(nc(c1)CCOCF)C 2216b67d4faa54571bcbaf1cc865862d [0,2,0,0,0,0|2,0,0]=4 16050 B13R1.55 Cc1cc(nc(c1)CNCCBr)C 11890527329f4d1f6fb9b3de01b38ed0 [0,2,0,0,0,0|2,0,0]=4 16051 B13R1.55 Cc1cc(nc(c1)CNCCF)C c2af667b48da7b9e01c8b5177e271eb5 [0,2,0,0,0,0|2,0,0]=4 16052 B13R1.55 Cc1cc(nc(c1)CNCCI)C 7e72495c5c98f800b5f7ff7b7a35e3d1 [0,2,0,0,0,0|2,0,0]=4 16053 B13R1.55 Cc1cc(nc(c1)CNCCO)C eb98a697162990ffd1ddc3fd6078ac9b [0,2,0,0,0,0|2,0,0]=4 16054 B13R1.55 Cc1cc(nc(c1)CNCCS)C 01ed653b7feef70627c643849dd800cb [0,2,0,0,0,0|2,0,0]=4 16055 B13R1.55 Cc1cc(nc(c1)COCCF)C 497a4da900e67c02f0dc87ab764d76e6 [0,2,0,0,0,0|2,0,0]=4 16056 B13R1.55 Cc1cc(nc(c1)COCCF)Cl 0f3294258cb3bb3c003291883e9dd8c2 [0,2,0,0,0,0|2,0,0]=4 16057 B13R1.55 Cc1cc(nc(c1)COCCS)C c61dea1457a68d461bcb78b5efe5d3f6 [0,2,0,0,0,0|2,0,0]=4 16058 B13R1.55 Cc1cc(nc(c1)COCCS)Cl 889be635d39c5cd794a66fd20d131cd0 [0,2,0,0,0,0|2,0,0]=4 16059 B13R1.55 Cc1cc(nc(c1)NCCCF)Br b3ab4327ff8c19ec9c1934b38fc2cb80 [0,2,0,0,0,0|2,0,0]=4 16060 B13R1.55 Cc1cc(nc(c1)NCCCF)C c3106da99049a3b69b0b3716ec57ad5c [0,2,0,0,0,0|2,0,0]=4 16061 B13R1.55 Cc1cc(nc(c1)NCCCF)Cl cdf093378b4198dbaab80c082040d3ec [0,2,0,0,0,0|2,0,0]=4 16062 B13R1.55 Cc1cc(nc(c1)NCCCF)F f9c3696851f85b2bbc305a0d9bcc3514 [0,2,0,0,0,0|2,0,0]=4 16063 B13R1.55 Cc1cc(nc(c1)NCCCO)Br f618a2e26f727d5692e2392f879b1410 [0,2,0,0,0,0|2,0,0]=4 16064 B13R1.55 Cc1cc(nc(c1)NCCCO)C 5bfe461a96866181c65bdbeabf5e40eb [0,2,0,0,0,0|2,0,0]=4 16065 B13R1.55 Cc1cc(nc(c1)NCCCO)Cl b8adcf07869d1ebbd3360ecb1ff969a1 [0,2,0,0,0,0|2,0,0]=4 16066 B13R1.55 Cc1cc(nc(c1)NCCCO)F 4a5b6e231060fb282086ab589f93fd73 [0,2,0,0,0,0|2,0,0]=4 16067 B13R1.55 Cc1cc(nc(c1)NCCCS)Br 7f55bd92db4beb807afedd5085c94537 [0,2,0,0,0,0|2,0,0]=4 16068 B13R1.55 Cc1cc(nc(c1)NCCCS)C 5817a7de6d5598cc3b14c713393ada1d [0,2,0,0,0,0|2,0,0]=4 16069 B13R1.55 Cc1cc(nc(c1)NCCCS)Cl 9da4b15881a9197fd04ec0bbaaa2b9b7 [0,2,0,0,0,0|2,0,0]=4 16070 B13R1.55 Cc1cc(nc(c1)NCCCS)F 35a1894214121b139e85526c0136280d [0,2,0,0,0,0|2,0,0]=4 16071 B13R1.55 Cc1cc(nc(c1)OCCCF)Br 53d174890be57fdc6399b8f567028e4a [0,2,0,0,0,0|2,0,0]=4 16072 B13R1.55 Cc1cc(nc(c1)OCCCF)C 12a9674bb25d0ff4e077027d8e042fdb [0,2,0,0,0,0|2,0,0]=4 16073 B13R1.55 Cc1cc(nc(c1)OCCCF)Cl c56bfcd0ef1207ed4e3e691e72bf2537 [0,2,0,0,0,0|2,0,0]=4 16074 B13R1.55 Cc1cc(nc(c1)OCCCS)Br 394fba96c5cf9a7737697da2ee33a45d [0,2,0,0,0,0|2,0,0]=4 16075 B13R1.55 Cc1cc(nc(c1)OCCCS)C 9db38a4ff099c6528f930e17950f14fa [0,2,0,0,0,0|2,0,0]=4 16076 B13R1.55 Cc1cc(nc(c1)OCCCS)Cl 83129ddf3950ff26240031ddc085957a [0,2,0,0,0,0|2,0,0]=4 16077 B13R1.55 FCCCNc1cc(cc(n1)Br)Br 74a023f5f16c652b3c3c5ab9d2d700c3 [0,2,0,0,0,0|2,0,0]=4 16078 B13R1.55 FCCCNc1cc(cc(n1)Br)Cl cc0955fd4e712afbdc2d47b449164c55 [0,2,0,0,0,0|2,0,0]=4 16079 B13R1.55 FCCCNc1cc(cc(n1)Cl)Br b39689ffd3307efdcfc32f232e489360 [0,2,0,0,0,0|2,0,0]=4 16080 B13R1.55 FCCCNc1cc(cc(n1)Cl)Cl 348aded133a38c204d7c7b1565c6aaf9 [0,2,0,0,0,0|2,0,0]=4 16081 B13R1.55 FCCCNc1cc(cc(n1)Cl)F 0a0d589bee67b5559fdaafdd9cbbdb87 [0,2,0,0,0,0|2,0,0]=4 16082 B13R1.55 FCCCNc1cc(cc(n1)Cl)I 07c2cbc1d65288184fba907ac2247075 [0,2,0,0,0,0|2,0,0]=4 16083 B13R1.55 FCCCNc1cc(cc(n1)F)Br 9c5eedc9151470eded921710217e4a8f [0,2,0,0,0,0|2,0,0]=4 16084 B13R1.55 FCCCOc1cc(cc(n1)Cl)Br 7cf3ae7b5d5955502e99da51799d6760 [0,2,0,0,0,0|2,0,0]=4 16085 B13R1.55 FCCCOc1cc(cc(n1)Cl)Cl 5a014625c26e21b8aac844b27dc6b678 [0,2,0,0,0,0|2,0,0]=4 16086 B13R1.55 FCCNCc1cc(cc(n1)Cl)Cl f2c75e78adf78c34836c3f5a7e788dc6 [0,2,0,0,0,0|2,0,0]=4 16087 B13R1.55 FCCOCc1cc(cc(n1)Br)Br 58ab3728b86aa86704509f1ada2ba3ef [0,2,0,0,0,0|2,0,0]=4 16088 B13R1.55 FCCOCc1cc(cc(n1)Br)Cl b797ea67297a9acfb062a385b729b910 [0,2,0,0,0,0|2,0,0]=4 16089 B13R1.55 FCCOCc1cc(cc(n1)Cl)Br 27b41af50ae68da7c2a236bbab407ef8 [0,2,0,0,0,0|2,0,0]=4 16090 B13R1.55 FCCOCc1cc(cc(n1)Cl)Cl 70861c02c6d315ece1354a1808bb9989 [0,2,0,0,0,0|2,0,0]=4 16091 B13R1.55 Fc1cc(cc(n1)NCCCS)Br 0e2106d91347c81645caf998ef2e3c36 [0,2,0,0,0,0|2,0,0]=4 16092 B13R1.55 Fc1cc(nc(c1)NCCCS)Cl fc58fb5670416cbb6cac4202f852269f [0,2,0,0,0,0|2,0,0]=4 16093 B13R1.55 OCCCNc1cc(cc(n1)Br)Br 9bfd9f56456ff5a3de87197a2ea81436 [0,2,0,0,0,0|2,0,0]=4 16094 B13R1.55 OCCCNc1cc(cc(n1)Br)Cl 0cd1ded7b5a7a6ed2e0fb11cb4ada7f9 [0,2,0,0,0,0|2,0,0]=4 16095 B13R1.55 OCCCNc1cc(cc(n1)Cl)Br af0f0603312a50b5574bfd889f51ef9a [0,2,0,0,0,0|2,0,0]=4 16096 B13R1.55 OCCCNc1cc(cc(n1)Cl)Cl 75c9470e0e65fef433368361ab5ce5a4 [0,2,0,0,0,0|2,0,0]=4 16097 B13R1.55 OCCCNc1cc(cc(n1)Cl)F d032c9a84a5ccfb9c6b494be2df8e2f5 [0,2,0,0,0,0|2,0,0]=4 16098 B13R1.55 OCCCNc1cc(cc(n1)Cl)I a2475fcf61279bda8e91d51b7e5b859e [0,2,0,0,0,0|2,0,0]=4 16099 B13R1.55 OCCCNc1cc(cc(n1)F)Br d96d26b77e2513010a7feada4b4c0dc9 [0,2,0,0,0,0|2,0,0]=4 16100 B13R1.55 OCCNCc1cc(cc(n1)Cl)Cl cd2d65a53dcacf4efd78894db610fd31 [0,2,0,0,0,0|2,0,0]=4 16101 B13R1.55 SCCCNc1cc(cc(n1)Br)Br d3f7d62d594b48693ae64bf3dbd8c79b [0,2,0,0,0,0|2,0,0]=4 16102 B13R1.55 SCCCNc1cc(cc(n1)Br)Cl b9149ea920416b2def495510adb4673c [0,2,0,0,0,0|2,0,0]=4 16103 B13R1.55 SCCCNc1cc(cc(n1)Cl)Br dee7a6dde8e9f5267f2840c0f208e9e2 [0,2,0,0,0,0|2,0,0]=4 16104 B13R1.55 SCCCNc1cc(cc(n1)Cl)Cl ffb6723c0d26c88225c716edcab9faa2 [0,2,0,0,0,0|2,0,0]=4 16105 B13R1.55 SCCCNc1cc(cc(n1)Cl)I b41343bebfcbce20f5a2acbfb984a96f [0,2,0,0,0,0|2,0,0]=4 16106 B13R1.55 SCCCOc1cc(cc(n1)Cl)Br c0b66edce83da625d838b345b4a0ffb3 [0,2,0,0,0,0|2,0,0]=4 16107 B13R1.55 SCCCOc1cc(cc(n1)Cl)Cl b5bf8cc1fe419c62db2852a5fb00da8b [0,2,0,0,0,0|2,0,0]=4 16108 B13R1.55 SCCNCc1cc(cc(n1)Cl)Cl ccc0f567215185752b52f22c41ec34fe [0,2,0,0,0,0|2,0,0]=4 16109 B13R1.55 SCCOCc1cc(cc(n1)Br)Br cf363109a098bf46503c167eb0c307ae [0,2,0,0,0,0|2,0,0]=4 16110 B13R1.55 SCCOCc1cc(cc(n1)Br)Cl 049ad851f17bcfb54abd9298d6ef6fb6 [0,2,0,0,0,0|2,0,0]=4 16111 B13R1.55 SCCOCc1cc(cc(n1)Cl)Br fef40e66737c776d9975e8f0d565b90a [0,2,0,0,0,0|2,0,0]=4 16112 B13R1.55 SCCOCc1cc(cc(n1)Cl)Cl 7cfa34649ec01fd530561e4e37481391 [0,2,0,0,0,0|2,0,0]=4 16113 B13R1.149 C=C(C)CCNc1cc(ccn1)Br a2aec3f916dcdb9913d0a12855760764 [0,2,0,0,0,0|1,0,1]=4 16114 B13R1.149 C=C(C)CCNc1cc(ccn1)C c933f777858ccf314bd5fcffa9e7c8e3 [0,2,0,0,0,0|1,0,1]=4 16115 B13R1.149 C=C(C)CCNc1cc(ccn1)Cl ffd082002d865cc40fed90095736ac6d [0,2,0,0,0,0|1,0,1]=4 16116 B13R1.149 C=C(C)CCNc1cc(ccn1)F 55ad6d9d99d2a829041de14a52bcab37 [0,2,0,0,0,0|1,0,1]=4 16117 B13R1.149 C=C(C)CCNc1cc(ccn1)I 24153d9e856d3144bcf93ed5b0be2667 [0,2,0,0,0,0|1,0,1]=4 16118 B13R1.149 C=C(C)CCNc1cccc(n1)Br a1ceb8f497c18ea268774922702f7360 [0,2,0,0,0,0|1,0,1]=4 16119 B13R1.149 C=C(C)CCNc1cccc(n1)C fe01546371847f86de4ddcc9bca67962 [0,2,0,0,0,0|1,0,1]=4 16120 B13R1.149 C=C(C)CCNc1cccc(n1)Cl 73e6bdd1fcf856be942e1e681c9b8293 [0,2,0,0,0,0|1,0,1]=4 16121 B13R1.149 C=C(C)CCNc1cccc(n1)F 78b79dfd3c4c11e3f728a5548d36407b [0,2,0,0,0,0|1,0,1]=4 16122 B13R1.149 C=C(C)CCNc1cccc(n1)I 2a4e0c38aec74c40a42d29805e776855 [0,2,0,0,0,0|1,0,1]=4 16123 B13R1.149 C=C(C)CCOc1cc(ccn1)Br 5e693d405b05b758fb1eab5ef7cb6fb7 [0,2,0,0,0,0|1,0,1]=4 16124 B13R1.149 C=C(C)CCOc1cc(ccn1)C 7048f56c6dd07ec27e7ddbe2da323d7d [0,2,0,0,0,0|1,0,1]=4 16125 B13R1.149 C=C(C)CCOc1cc(ccn1)Cl 243fcf6532bd91fb6c8b77b7da23ef91 [0,2,0,0,0,0|1,0,1]=4 16126 B13R1.149 C=C(C)CCOc1cc(ccn1)F f989d4be6ca7c3a7f498807132651a0a [0,2,0,0,0,0|1,0,1]=4 16127 B13R1.149 C=C(C)CCOc1cccc(n1)Br 6dccfa6e812bc5629b0dc00647a18cf0 [0,2,0,0,0,0|1,0,1]=4 16128 B13R1.149 C=C(C)CCOc1cccc(n1)C 12aa654fcc0842aa332ea8f7f8d7504e [0,2,0,0,0,0|1,0,1]=4 16129 B13R1.149 C=C(C)CCOc1cccc(n1)F 5731ebe1f9cfa327dc09fdaf15282f75 [0,2,0,0,0,0|1,0,1]=4 16130 B13R1.149 C=C(C)CNCc1cc(ccn1)Br 470899bcb6cbb57470017d515c791b2d [0,2,0,0,0,0|1,0,1]=4 16131 B13R1.149 C=C(C)CNCc1cc(ccn1)C dea4e37ca2c965331a76b8e514706b40 [0,2,0,0,0,0|1,0,1]=4 16132 B13R1.149 C=C(C)CNCc1cc(ccn1)Cl 52c8fcea7275ffec545fbec9439bcb39 [0,2,0,0,0,0|1,0,1]=4 16133 B13R1.149 C=C(C)CNCc1cccc(n1)Br 0bfd6eb987c97be9dbe469154626f555 [0,2,0,0,0,0|1,0,1]=4 16134 B13R1.149 C=C(C)CNCc1cccc(n1)C 3e52ba597dffeff7f7c17e87f293404c [0,2,0,0,0,0|1,0,1]=4 16135 B13R1.149 C=C(C)CNCc1cccc(n1)Cl 71967e016d2edf77145b3c94b409b727 [0,2,0,0,0,0|1,0,1]=4 16136 B13R1.149 C=C(C)CNCc1cccc(n1)F c8347cfd1fb42bc70be49053b537cf9c [0,2,0,0,0,0|1,0,1]=4 16137 B13R1.149 C=C(C)COCc1cc(ccn1)Br 34cddbc847bb35aafbc6a0faacf099b6 [0,2,0,0,0,0|1,0,1]=4 16138 B13R1.149 C=C(C)COCc1cc(ccn1)C 0d5172dc7602751318d5090642ce787c [0,2,0,0,0,0|1,0,1]=4 16139 B13R1.149 C=C(C)COCc1cc(ccn1)Cl ad26ea707a6ee7e70e732d7d3e1faaee [0,2,0,0,0,0|1,0,1]=4 16140 B13R1.149 C=C(C)COCc1cc(ccn1)F 306455be552440ed1cc29dd6a6178107 [0,2,0,0,0,0|1,0,1]=4 16141 B13R1.149 C=C(C)COCc1cc(ccn1)I b0a34c7e451896cd4a9ec8de54ae3354 [0,2,0,0,0,0|1,0,1]=4 16142 B13R1.149 C=C(C)COCc1cccc(n1)Br 531b4c14ee358e0c785010ca0866f26f [0,2,0,0,0,0|1,0,1]=4 16143 B13R1.149 C=C(C)COCc1cccc(n1)C 1fd4df109979b71f4f8d4078ad9810ef [0,2,0,0,0,0|1,0,1]=4 16144 B13R1.149 C=C(C)COCc1cccc(n1)Cl 88086b8684d95129db3616208aedc0a2 [0,2,0,0,0,0|1,0,1]=4 16145 B13R1.149 C=C(C)COCc1cccc(n1)F 3eaa7faa112061815275cdf787ce14ef [0,2,0,0,0,0|1,0,1]=4 16146 B13R1.149 C=C(C)COCc1cccc(n1)I 0770a36e20436eb95b4692e3063f9272 [0,2,0,0,0,0|1,0,1]=4 16147 B13R1.149 CC(=O)CCNc1cc(ccn1)Br 3cbddb64db146840ddf45c7ebc6db7a7 [0,2,0,0,0,0|1,0,1]=4 16148 B13R1.149 CC(=O)CCNc1cc(ccn1)C cc0c3f59249ae9690f96e5380278d2c9 [0,2,0,0,0,0|1,0,1]=4 16149 B13R1.149 CC(=O)CCNc1cc(ccn1)Cl 320adcc14d6db7c15aebf241a473d665 [0,2,0,0,0,0|1,0,1]=4 16150 B13R1.149 CC(=O)CCNc1cc(ccn1)F 37e5fb2dfe455fdfcd58e4eb912fa927 [0,2,0,0,0,0|1,0,1]=4 16151 B13R1.149 CC(=O)CCNc1cc(ccn1)I 5ac516d0be7a1f740d2490111b62c8cd [0,2,0,0,0,0|1,0,1]=4 16152 B13R1.149 CC(=O)CCNc1cccc(n1)Br e752dcc6617112247386c62a22748b74 [0,2,0,0,0,0|1,0,1]=4 16153 B13R1.149 CC(=O)CCNc1cccc(n1)C fb5c28d6deca44ebf50dab1f340b5be5 [0,2,0,0,0,0|1,0,1]=4 16154 B13R1.149 CC(=O)CCNc1cccc(n1)Cl bade04ce2da50adda578c425a21a8336 [0,2,0,0,0,0|1,0,1]=4 16155 B13R1.149 CC(=O)CCNc1cccc(n1)F 8588b1af6289720379cbc61373382573 [0,2,0,0,0,0|1,0,1]=4 16156 B13R1.149 CC(=O)CCNc1cccc(n1)I e5411c8c8968cdf8dfd1e792590fccab [0,2,0,0,0,0|1,0,1]=4 16157 B13R1.149 CC(=O)CCOc1cc(ccn1)Br 0bd44edf536a002e60ca3ba460108f7b [0,2,0,0,0,0|1,0,1]=4 16158 B13R1.149 CC(=O)CCOc1cc(ccn1)C 95a53ba2c1b3932a0e97b38a16eba382 [0,2,0,0,0,0|1,0,1]=4 16159 B13R1.149 CC(=O)CCOc1cc(ccn1)Cl afa91580fee26350d38ecc475aba04de [0,2,0,0,0,0|1,0,1]=4 16160 B13R1.149 CC(=O)CCOc1cc(ccn1)F f559c68cde3ecef8b4ea4350385f4f45 [0,2,0,0,0,0|1,0,1]=4 16161 B13R1.149 CC(=O)CCOc1cccc(n1)Br 748b91cd8b068e601794c4e38b045926 [0,2,0,0,0,0|1,0,1]=4 16162 B13R1.149 CC(=O)CCOc1cccc(n1)C 6d1dfe82d82585366fd3f536d738c548 [0,2,0,0,0,0|1,0,1]=4 16163 B13R1.149 CC(=O)CNCc1cc(ccn1)Br 41365a5a7e66590fbb45a7264e390513 [0,2,0,0,0,0|1,0,1]=4 16164 B13R1.149 CC(=O)CNCc1cc(ccn1)C 166109936aed7339644ceaa1523eaa96 [0,2,0,0,0,0|1,0,1]=4 16165 B13R1.149 CC(=O)CNCc1cc(ccn1)Cl 96296581e5776667926edc039a59558d [0,2,0,0,0,0|1,0,1]=4 16166 B13R1.149 CC(=O)CNCc1cccc(n1)Br 9f62481cbbf405e4fa8ed3e96f27fa0a [0,2,0,0,0,0|1,0,1]=4 16167 B13R1.149 CC(=O)CNCc1cccc(n1)C 57b7b56d2251e93b09bc724b99098bda [0,2,0,0,0,0|1,0,1]=4 16168 B13R1.149 CC(=O)CNCc1cccc(n1)Cl 3e1d765ab9026a3f887d7d2d11f657f4 [0,2,0,0,0,0|1,0,1]=4 16169 B13R1.149 CC(=O)CNCc1cccc(n1)F 763ff54f1ebe0ddaf1d60fe19d062740 [0,2,0,0,0,0|1,0,1]=4 16170 B13R1.149 CC(=O)COCc1cc(ccn1)Br fb6094af6c47013a9210564aba685705 [0,2,0,0,0,0|1,0,1]=4 16171 B13R1.149 CC(=O)COCc1cc(ccn1)C 0746a5822a6e424bde40e8830778c782 [0,2,0,0,0,0|1,0,1]=4 16172 B13R1.149 CC(=O)COCc1cc(ccn1)Cl d7bb5cdbc9c219ad67a830d2bfbdb109 [0,2,0,0,0,0|1,0,1]=4 16173 B13R1.149 CC(=O)COCc1cccc(n1)Br c5850c0e96f6e7dddb686a9ccc822db3 [0,2,0,0,0,0|1,0,1]=4 16174 B13R1.149 CC(=O)COCc1cccc(n1)C 9cdfe7648e9ca38e7660a1d73e412f28 [0,2,0,0,0,0|1,0,1]=4 16175 B13R1.149 CC(=O)COCc1cccc(n1)Cl ea5afbb490f4a410d5a41cb8dd631700 [0,2,0,0,0,0|1,0,1]=4 16176 B13R1.149 CC(=O)COCc1cccc(n1)F 50c315d22adcdebc0ad8f140f2b209a0 [0,2,0,0,0,0|1,0,1]=4 16177 B13R1.149 CC(=O)NCCc1cccc(n1)C d4af43807ce62dbd6667fdb38cb4556a [0,2,0,0,0,0|1,0,1]=4 16178 B13R1.149 CC(C)CCNc1cc(ccn1)Br c325b16657fb7bcd30e2bbbe076f9ba0 [0,2,0,0,0,0|1,0,0]=3 16179 B13R1.149 CC(C)CCNc1cc(ccn1)Cl ca09d5ee7823fdb7720ce41140c80b83 [0,2,0,0,0,0|1,0,0]=3 16180 B13R1.149 CC(C)CCNc1cc(ccn1)F cd36d2dd8fea675a5daaa2b51be56ed9 [0,2,0,0,0,0|1,0,0]=3 16181 B13R1.149 CC(C)CCNc1cc(ccn1)I 18c80922240fa0b40ed1ebe17aa1d7bc [0,2,0,0,0,0|1,0,0]=3 16182 B13R1.149 CC(C)CCNc1cc(cnn1)Br 11142b56e38f2d1cf6448cccd9815859 [0,2,0,0,0,0|2,0,0]=4 16183 B13R1.149 CC(C)CCNc1cc(cnn1)Cl 677956cb1c6c6c3bcda5f88f1b62b019 [0,2,0,0,0,0|2,0,0]=4 16184 B13R1.149 CC(C)CCNc1cc(ncn1)Br ae207e4e311f6f329310307dae5d31a7 [0,2,0,0,0,0|2,0,0]=4 16185 B13R1.149 CC(C)CCNc1cc(ncn1)Cl a96cff1655c12896d5e27ee25db80501 [0,2,0,0,0,0|2,0,0]=4 16186 B13R1.149 CC(C)CCNc1cc(ncn1)F b065e289f99c5f16dd1c1f1818246f69 [0,2,0,0,0,0|2,0,0]=4 16187 B13R1.149 CC(C)CCNc1cc(ncn1)I 1c4b0f072b81ce5714be3c20bc6ef294 [0,2,0,0,0,0|2,0,0]=4 16188 B13R1.149 CC(C)CCNc1cc[nH]c(=O)n1 3073eb40712a4718717481dbde2e7e6c [0,2,0,0,0,0|2,0,0]=4 16189 B13R1.149 CC(C)CCNc1cccc(c1)Br c0c9db3281de426d0f0e3da0b592ea16 [0,2,0,0,0,0|2,0,0]=4 16190 B13R1.149 CC(C)CCNc1cccc(c1)Cl b478c1e58dbde2b5c9303f459bd41bfa [0,2,0,0,0,0|2,0,0]=4 16191 B13R1.149 CC(C)CCNc1cccc(c1)F e6f5ebcb22a8150ef3e97da097b46c2e [0,2,0,0,0,0|2,0,0]=4 16192 B13R1.149 CC(C)CCNc1cccc(c1)I 4d352f50adf80771ca10c8a1e313380d [0,2,0,0,0,0|2,0,0]=4 16193 B13R1.149 CC(C)CCNc1cccc(c1)S 21276ee639dcb8385dec7ab37ba4a6f3 [0,2,0,0,0,0|2,0,0]=4 16194 B13R1.149 CC(C)CCNc1cccc(n1)Br b6a8a391b6c57f3020cc4ee5d284d115 [0,2,0,0,0,0|1,0,0]=3 16195 B13R1.149 CC(C)CCNc1cccc(n1)Cl fd71117d0ab12ea3075ab6dd3b02c485 [0,2,0,0,0,0|1,0,0]=3 16196 B13R1.149 CC(C)CCNc1cccc(n1)F 0fd35affddec5711254dd408d47ed2cd [0,2,0,0,0,0|1,0,0]=3 16197 B13R1.149 CC(C)CCNc1cccc(n1)I 57f5512e6c9f316d0b291390dbe4a455 [0,2,0,0,0,0|1,0,0]=3 16198 B13R1.149 CC(C)CCNc1ccnc(n1)Br 1e5c5b6469f25441d6dfb001a7945fc9 [0,2,0,0,0,0|2,0,0]=4 16199 B13R1.149 CC(C)CCNc1ccnc(n1)Cl e92c5344ea562eb369908be7053bda34 [0,2,0,0,0,0|2,0,0]=4 16200 B13R1.149 CC(C)CCNc1ccnc(n1)F 488776767c28913ef67d7cbaa78f150c [0,2,0,0,0,0|2,0,0]=4 16201 B13R1.149 CC(C)CCNc1ccnc(n1)S d416e3ec91dc7226b54a33896d60bb89 [0,2,0,0,0,0|2,0,0]=4 16202 B13R1.149 CC(C)CCNc1cncc(n1)Br 20c70d2747db860785a759293a236411 [0,2,0,0,0,0|2,0,0]=4 16203 B13R1.149 CC(C)CCNc1cncc(n1)Cl 9e7766a62c9c2a646c730c12e3de0a52 [0,2,0,0,0,0|2,0,0]=4 16204 B13R1.149 CC(C)CCNc1cncc(n1)F 9c90370f00453a9ddd662d745a75368a [0,2,0,0,0,0|2,0,0]=4 16205 B13R1.149 CC(C)CCNc1nccc(=O)[nH]1 c7c2131f9c65db5cf52378ad2ba95f75 [0,2,0,0,0,0|2,0,0]=4 16206 B13R1.149 CC(C)CCNc1nccc(n1)Br 9f0f42a784668224803b7cf5db4ea3a5 [0,2,0,0,0,0|2,0,0]=4 16207 B13R1.149 CC(C)CCNc1nccc(n1)Cl 5c23924d4f3cba1fe3725b25c6c2a862 [0,2,0,0,0,0|2,0,0]=4 16208 B13R1.149 CC(C)CCNc1nccc(n1)F 75c2f0b14f094484adf4254132c0e1e5 [0,2,0,0,0,0|2,0,0]=4 16209 B13R1.149 CC(C)CCNc1nccc(n1)I ac97a38e30c85daa30f3936d97c0442c [0,2,0,0,0,0|2,0,0]=4 16210 B13R1.149 CC(C)CCNc1nccc(n1)S 2a9ef1b9b7d09a48badf53c8d6206df3 [0,2,0,0,0,0|2,0,0]=4 16211 B13R1.149 CC(C)CCOc1cc(ccn1)Br 48983036bb00bca5de839de8ab5cf5e0 [0,2,0,0,0,0|1,0,0]=3 16212 B13R1.149 CC(C)CCOc1cc(ccn1)Cl b1be8bf989f390a4333ddfd479bab08d [0,2,0,0,0,0|1,0,0]=3 16213 B13R1.149 CC(C)CCOc1cc(ccn1)F 137cd945d2491c6af229cb7491280b0b [0,2,0,0,0,0|1,0,0]=3 16214 B13R1.149 CC(C)CCOc1cc(ncn1)Br 07dcca8b4b31de72fbce3204e466a4d3 [0,2,0,0,0,0|2,0,0]=4 16215 B13R1.149 CC(C)CCOc1cc(ncn1)Cl f6a889d70fa8767cc0892b87b13699fb [0,2,0,0,0,0|2,0,0]=4 16216 B13R1.149 CC(C)CCOc1cccc(=O)[nH]1 6617317216283c819da549bebc096260 [0,2,0,0,0,0|1,0,1]=4 16217 B13R1.149 CC(C)CCOc1cccc(c1)Br b0dce33868fdc94f17827a74732ea079 [0,2,0,0,0,0|2,0,0]=4 16218 B13R1.149 CC(C)CCOc1cccc(c1)Cl ee0d28f3dcea533da3349be080100f81 [0,2,0,0,0,0|2,0,0]=4 16219 B13R1.149 CC(C)CCOc1cccc(c1)F 90aac71b85e4ed240956314416860f77 [0,2,0,0,0,0|2,0,0]=4 16220 B13R1.149 CC(C)CCOc1cccc(c1)I 5b5684e96b8673ee543da59a61fd307a [0,2,0,0,0,0|2,0,0]=4 16221 B13R1.149 CC(C)CCOc1cccc(c1)S 8d62308cf44a0d25ecf9b5d6e04df76e [0,2,0,0,0,0|2,0,0]=4 16222 B13R1.149 CC(C)CCOc1cccc(n1)Br 13be18eef3c21b69459f3b1932f7e3e1 [0,2,0,0,0,0|1,0,0]=3 16223 B13R1.149 CC(C)CCOc1cccc(n1)F 2916d111d4686e847a797fdb7cf55d53 [0,2,0,0,0,0|1,0,0]=3 16224 B13R1.149 CC(C)CCOc1ccnc(n1)Cl 2b6fd2947bc0b43fe42d7b9891f53655 [0,2,0,0,0,0|2,0,0]=4 16225 B13R1.149 CC(C)CCOc1cncc(n1)Br e927284ccddccbfe122f02541fb25827 [0,2,0,0,0,0|2,0,0]=4 16226 B13R1.149 CC(C)CCOc1cncc(n1)Cl e0e7db0558426fac74da08cbb1fcb6a8 [0,2,0,0,0,0|2,0,0]=4 16227 B13R1.149 CC(C)CCOc1nccc(n1)Cl 91a7d735b13a83400c2016aa5debdf65 [0,2,0,0,0,0|2,0,0]=4 16228 B13R1.149 CC(C)CCOc1nccc(n1)S e41710c9e367a1c23ff813ef28b0b196 [0,2,0,0,0,0|2,0,0]=4 16229 B13R1.149 CC(C)CNCc1cc(ccn1)Br 04abaa939c7bbd46e34860c87bddceb0 [0,2,0,0,0,0|1,0,0]=3 16230 B13R1.149 CC(C)CNCc1cc(ccn1)Cl dd72dfaae67b8be95de50e68a1686d09 [0,2,0,0,0,0|1,0,0]=3 16231 B13R1.149 CC(C)CNCc1cc[nH]c(=O)n1 2bfaa4b5fe2ac34ce4a518776e1fccb4 [0,2,0,0,0,0|2,0,0]=4 16232 B13R1.149 CC(C)CNCc1cccc(c1)Br 158cabc92a94009f2714cda73f3cb9b5 [0,2,0,0,0,0|2,0,0]=4 16233 B13R1.149 CC(C)CNCc1cccc(c1)Cl fcb04b624a02b5c6c45fcd2bfdcf38e4 [0,2,0,0,0,0|2,0,0]=4 16234 B13R1.149 CC(C)CNCc1cccc(c1)F ea4ae6161c29ad5890528e0d690eae62 [0,2,0,0,0,0|2,0,0]=4 16235 B13R1.149 CC(C)CNCc1cccc(c1)I 597b045d4c6dd3b5509b829b665131f4 [0,2,0,0,0,0|2,0,0]=4 16236 B13R1.149 CC(C)CNCc1cccc(n1)Br e28a3011b682f48b8b8db3e0a6bf41ec [0,2,0,0,0,0|1,0,0]=3 16237 B13R1.149 CC(C)CNCc1cccc(n1)Cl 7fb43cb34770ecbf9d0de58783d1cdfe [0,2,0,0,0,0|1,0,0]=3 16238 B13R1.149 CC(C)CNCc1cccc(n1)F b09e45033b1e3229a1adacc9bdb1d204 [0,2,0,0,0,0|1,0,0]=3 16239 B13R1.149 CC(C)CNCc1ccnc(n1)Cl 82bf9bd92985e623cb9103d8c8abe51a [0,2,0,0,0,0|2,0,0]=4 16240 B13R1.149 CC(C)CNCc1cncc(n1)Cl 9b6e342589463b1b6b126875bd2dc2cc [0,2,0,0,0,0|2,0,0]=4 16241 B13R1.149 CC(C)CNCc1nccc(n1)Cl 92bd5026801858e04a9f40fbfbb69ce0 [0,2,0,0,0,0|2,0,0]=4 16242 B13R1.149 CC(C)COCc1cc(ccn1)Br 4fcc11aba823481c37aa62be16fea992 [0,2,0,0,0,0|1,0,0]=3 16243 B13R1.149 CC(C)COCc1cc(ccn1)Cl 197df98f049aa8a6ccba83ca0052273f [0,2,0,0,0,0|1,0,0]=3 16244 B13R1.149 CC(C)COCc1cc(ccn1)F 700858b0bc3b69351db67adbe6682380 [0,2,0,0,0,0|1,0,0]=3 16245 B13R1.149 CC(C)COCc1cc(ccn1)I 5647339a63e52b388e59b4072e51e99e [0,2,0,0,0,0|1,0,0]=3 16246 B13R1.149 CC(C)COCc1cc(ncn1)Cl 5776b06986aee36b14cff7e0b464d429 [0,2,0,0,0,0|2,0,0]=4 16247 B13R1.149 CC(C)COCc1cccc(c1)Br 3f6f4466f8a025e2ef783bad24f7989f [0,2,0,0,0,0|2,0,0]=4 16248 B13R1.149 CC(C)COCc1cccc(c1)Cl ef0582628be7c6f10b2610587d28cf64 [0,2,0,0,0,0|2,0,0]=4 16249 B13R1.149 CC(C)COCc1cccc(c1)F 65aeebf9dcbfe0d1cbf16d41affc9310 [0,2,0,0,0,0|2,0,0]=4 16250 B13R1.149 CC(C)COCc1cccc(c1)I 15a67c80e5880dd60fb46d1517814b0d [0,2,0,0,0,0|2,0,0]=4 16251 B13R1.149 CC(C)COCc1cccc(n1)Br 26a79f09bdc642ec8229c19e6499ef23 [0,2,0,0,0,0|1,0,0]=3 16252 B13R1.149 CC(C)COCc1cccc(n1)Cl 06aac3b54972c1e4bf430b8de457b3de [0,2,0,0,0,0|1,0,0]=3 16253 B13R1.149 CC(C)COCc1cccc(n1)F 274e5bb5dc53acc5c6a5c1c57cea2d00 [0,2,0,0,0,0|1,0,0]=3 16254 B13R1.149 CC(C)COCc1cccc(n1)I 18a8c481ae2f617d88ea1c72308ba61a [0,2,0,0,0,0|1,0,0]=3 16255 B13R1.149 CC(C)COCc1ccnc(n1)Cl 012baccbf5ca30b61eda2e796c56c582 [0,2,0,0,0,0|2,0,0]=4 16256 B13R1.149 CC(C)COCc1cncc(n1)Br 4973be768beb17b14a4e0caa4d4be226 [0,2,0,0,0,0|2,0,0]=4 16257 B13R1.149 CC(C)COCc1cncc(n1)Cl 7ec746f4a89f33b7267bcbf00e60e3eb [0,2,0,0,0,0|2,0,0]=4 16258 B13R1.149 CC(C)COCc1nccc(n1)Cl 7f92a8619c50356143527ae96b2be3cd [0,2,0,0,0,0|2,0,0]=4 16259 B13R1.149 CC(C)NCCc1cccc(c1)Br 8de20e1121b931370da151be05b3a039 [0,2,0,0,0,0|2,0,0]=4 16260 B13R1.149 CC(C)NCCc1cccc(c1)Cl b6d9a799d14c868f44fb0830438d0b51 [0,2,0,0,0,0|2,0,0]=4 16261 B13R1.149 CC(C)NCCc1cccc(c1)F 5fe75d0459c58fdaa11161dd3e5ec8ed [0,2,0,0,0,0|2,0,0]=4 16262 B13R1.149 CC(C)NCCc1cccc(c1)I 6ba10e440219a1bac9651c81bdc990d5 [0,2,0,0,0,0|2,0,0]=4 16263 B13R1.149 CC(C)OCCc1cc(ccn1)Br 338160f0e45c11f9f07262a9b4016d96 [0,2,0,0,0,0|1,0,0]=3 16264 B13R1.149 CC(C)OCCc1cccc(c1)Br 6c3b910e9b9bc913f927157e8874b9f4 [0,2,0,0,0,0|2,0,0]=4 16265 B13R1.149 CC(C)OCCc1cccc(c1)Cl 2ded6407717a9d8ce2f096b2120c7b1b [0,2,0,0,0,0|2,0,0]=4 16266 B13R1.149 CC(C)OCCc1cccc(c1)F 1b022fc8cb1f6530ac57f59b3e47e2f7 [0,2,0,0,0,0|2,0,0]=4 16267 B13R1.149 CC(C)OCCc1cccc(c1)I 685700cdc2a0c3a460a07e5b2973908f [0,2,0,0,0,0|2,0,0]=4 16268 B13R1.149 CC(C)OCCc1cncc(n1)Cl dadad57606aeca0f19202bb332d74e7b [0,2,0,0,0,0|2,0,0]=4 16269 B13R1.149 CC(C)OCNc1cc(ccn1)Br 398ffaadb1548c8e7a0d6e419e361b03 [0,2,0,0,0,0|2,0,0]=4 16270 B13R1.149 CC(C)OCNc1cc(ccn1)Cl 1306050f4f12bbd127c4bb31d6addb0b [0,2,0,0,0,0|2,0,0]=4 16271 B13R1.149 CC(C)OCNc1cc(ccn1)F 26962dcd363e3fa4e4e4c48436719466 [0,2,0,0,0,0|2,0,0]=4 16272 B13R1.149 CC(C)OCNc1cc(ccn1)I 2d2fe79caf6ac1e8596265263962ba78 [0,2,0,0,0,0|2,0,0]=4 16273 B13R1.149 CC(C)OCNc1cccc(n1)Br 73d8c43880bada1d1fec15e8f58d54db [0,2,0,0,0,0|2,0,0]=4 16274 B13R1.149 CC(C)OCNc1cccc(n1)F a944b6fa0c3c6a7d740f2d007ae44ffe [0,2,0,0,0,0|2,0,0]=4 16275 B13R1.149 CC(C)OCNc1cccc(n1)I ffa1e309f46976a4774a88a58a39c57b [0,2,0,0,0,0|2,0,0]=4 16276 B13R1.149 CC(C)OCOc1cc(ccn1)Br 12e9f0536e1bf0aea89ee247ec955e69 [0,2,0,0,0,0|2,0,0]=4 16277 B13R1.149 CC(C)OCOc1cc(ccn1)Cl 04209db41e79429507046f61eb98108a [0,2,0,0,0,0|2,0,0]=4 16278 B13R1.149 CC(C)OCOc1cc(ccn1)F 5f59743de0275103ddcae30f4ee0554f [0,2,0,0,0,0|2,0,0]=4 16279 B13R1.149 CC(C)OCOc1cccc(n1)Br 7c05e43bac2c313e0469bf7f54222939 [0,2,0,0,0,0|2,0,0]=4 16280 B13R1.149 CC(C)OCOc1cccc(n1)F c6956c30f259380c071f782852c44cb7 [0,2,0,0,0,0|2,0,0]=4 16281 B13R1.149 CC(F)COCc1cc(ccn1)Br 393019dc4b30ab0a6acf28cb1b4b8a67 [0,2,0,0,0,0|1,0,0]=3 16282 B13R1.149 CC(F)COCc1cc(ccn1)Cl 91c4e79d281f3d2681962af09d2281a5 [0,2,0,0,0,0|1,0,0]=3 16283 B13R1.149 CC(F)COCc1cccc(c1)Br 28d2a8a60c002911121ebba946e62946 [0,2,0,0,0,0|2,0,0]=4 16284 B13R1.149 CC(F)COCc1cccc(c1)Cl 13e28dac92c97e560c132eea5e6316da [0,2,0,0,0,0|2,0,0]=4 16285 B13R1.149 CC(F)COCc1cccc(c1)F 18e455b4e5b71b1ee65f062a6d21c581 [0,2,0,0,0,0|2,0,0]=4 16286 B13R1.149 CC(F)COCc1cccc(c1)I 0c1aad849a8374c912b0747a46ba1a7a [0,2,0,0,0,0|2,0,0]=4 16287 B13R1.149 CC(F)COCc1cccc(n1)Br c9eb3ed8d7285d1b3dae941bb52b9598 [0,2,0,0,0,0|1,0,0]=3 16288 B13R1.149 CC(F)COCc1cccc(n1)Cl 651a00e1c31dfb93e08f63a947d60837 [0,2,0,0,0,0|1,0,0]=3 16289 B13R1.149 CC(F)COCc1cccc(n1)F d5895683c60c72c6375f104cd1b8569b [0,2,0,0,0,0|1,0,0]=3 16290 B13R1.149 CC(F)COCc1ccnc(n1)Cl fc5ee9ea1289f9668fdd7a1550daf55f [0,2,0,0,0,0|2,0,0]=4 16291 B13R1.149 CC(F)COCc1nccc(n1)Cl 6329cd7784f107ca1789dbfbf02166c8 [0,2,0,0,0,0|2,0,0]=4 16292 B13R1.149 CC(O)CCNc1cc(ccn1)Br 01e1d1506c5f3f61452df2e15c582a26 [0,2,0,0,0,0|1,0,0]=3 16293 B13R1.149 CC(O)CCNc1cc(ccn1)Cl 81456a28819849b16a2b9ee3fde2fbcc [0,2,0,0,0,0|1,0,0]=3 16294 B13R1.149 CC(O)CCNc1cc(ccn1)F aacf1ee53d8ea70a6394bb5594be25b6 [0,2,0,0,0,0|1,0,0]=3 16295 B13R1.149 CC(O)CCNc1cc(ccn1)I e2b67d7d6770e73e2b31ce5e21c843a4 [0,2,0,0,0,0|1,0,0]=3 16296 B13R1.149 CC(O)CCNc1cc(ccn1)O ffcf18e962f6644a39e862556597ac80 [0,2,0,0,0,0|1,0,0]=3 16297 B13R1.149 CC(O)CCNc1cc(cnn1)Br bb2800ca6d2dc7772459b5c171ab8283 [0,2,0,0,0,0|2,0,0]=4 16298 B13R1.149 CC(O)CCNc1cc(cnn1)Cl 52451e7a342d88335cfcf8aad8733904 [0,2,0,0,0,0|2,0,0]=4 16299 B13R1.149 CC(O)CCNc1cc(ncn1)Br a7a2410d2d770add38c4a1b9cbd22e58 [0,2,0,0,0,0|2,0,0]=4 16300 B13R1.149 CC(O)CCNc1cc(ncn1)Cl 820023aa40ba57bd265edde344074a9a [0,2,0,0,0,0|2,0,0]=4 16301 B13R1.149 CC(O)CCNc1cc(ncn1)F f6aac9fed1a3f8daa157832b95d37675 [0,2,0,0,0,0|2,0,0]=4 16302 B13R1.149 CC(O)CCNc1cc(ncn1)I c646e54c5af36b80bfde6ea5b21768fc [0,2,0,0,0,0|2,0,0]=4 16303 B13R1.149 CC(O)CCNc1cc[nH]c(=O)n1 ab594316849138914e6438a44c921a72 [0,2,0,0,0,0|2,0,0]=4 16304 B13R1.149 CC(O)CCNc1cccc(c1)Br de49fa03e8539ffac044994033dcb5c1 [0,2,0,0,0,0|2,0,0]=4 16305 B13R1.149 CC(O)CCNc1cccc(c1)Cl acbe11411fcfc3899aba22fe3aa1634c [0,2,0,0,0,0|2,0,0]=4 16306 B13R1.149 CC(O)CCNc1cccc(c1)F ec75dc7ad57a9f0b057ea6f35b3f78f2 [0,2,0,0,0,0|2,0,0]=4 16307 B13R1.149 CC(O)CCNc1cccc(c1)I 9a2d223db75a09fdf1b51d9f4b1bc5d5 [0,2,0,0,0,0|2,0,0]=4 16308 B13R1.149 CC(O)CCNc1cccc(c1)S 92726849de281a59802cb828c5b24f2d [0,2,0,0,0,0|2,0,0]=4 16309 B13R1.149 CC(O)CCNc1cccc(n1)Br 141e2c0f682724e97579ab74bae7d72f [0,2,0,0,0,0|1,0,0]=3 16310 B13R1.149 CC(O)CCNc1cccc(n1)Cl 8832d50f7a66f28585e1b2dcf074ada0 [0,2,0,0,0,0|1,0,0]=3 16311 B13R1.149 CC(O)CCNc1cccc(n1)F 205b5826d41f754a6ef6a74b5b45c86f [0,2,0,0,0,0|1,0,0]=3 16312 B13R1.149 CC(O)CCNc1cccc(n1)I cdaa6a1aa4413b1bdd431c9e64bc9a62 [0,2,0,0,0,0|1,0,0]=3 16313 B13R1.149 CC(O)CCNc1ccnc(n1)Br 695f7e08d95a07390a1e47e7d5d383fa [0,2,0,0,0,0|2,0,0]=4 16314 B13R1.149 CC(O)CCNc1ccnc(n1)Cl 1eec7dff2ac1857591dcce509292a3d3 [0,2,0,0,0,0|2,0,0]=4 16315 B13R1.149 CC(O)CCNc1ccnc(n1)F 7bdf814f6d1dd5e0b2db1c8ad58fe04d [0,2,0,0,0,0|2,0,0]=4 16316 B13R1.149 CC(O)CCNc1ccnc(n1)S bf3b4b6c71d5b4a398d4bdf01a9deed8 [0,2,0,0,0,0|2,0,0]=4 16317 B13R1.149 CC(O)CCNc1cncc(n1)Br 633fa152baacd507482eeea8932e86dc [0,2,0,0,0,0|2,0,0]=4 16318 B13R1.149 CC(O)CCNc1cncc(n1)Cl 0d4ba50148926a19a87b96d9acc811df [0,2,0,0,0,0|2,0,0]=4 16319 B13R1.149 CC(O)CCNc1cncc(n1)F b294425ac4bcc44fd0bb9dc00568f93f [0,2,0,0,0,0|2,0,0]=4 16320 B13R1.149 CC(O)CCNc1nccc(=O)[nH]1 8a4242fecc8fe2da0a452f4e8a2e998a [0,2,0,0,0,0|2,0,0]=4 16321 B13R1.149 CC(O)CCNc1nccc(n1)Br 860b963ac2fa06767c946fba79845e90 [0,2,0,0,0,0|2,0,0]=4 16322 B13R1.149 CC(O)CCNc1nccc(n1)Cl 91cc8a3f64403690cb15b1d1e3642a9c [0,2,0,0,0,0|2,0,0]=4 16323 B13R1.149 CC(O)CCNc1nccc(n1)F c948a50818a9bfffddbab26f6f62e5c6 [0,2,0,0,0,0|2,0,0]=4 16324 B13R1.149 CC(O)CCNc1nccc(n1)I 3a5c47e1ca3b4b2f978fd31c77cd01e5 [0,2,0,0,0,0|2,0,0]=4 16325 B13R1.149 CC(O)CCNc1nccc(n1)S 5e0e33880aab8d6a04d3dd7a3c389837 [0,2,0,0,0,0|2,0,0]=4 16326 B13R1.149 CC(O)CNCc1cc(ccn1)Br b42b5c13e6be062e7c051036ae4934d6 [0,2,0,0,0,0|1,0,0]=3 16327 B13R1.149 CC(O)CNCc1cc(ccn1)Cl 59b5e87329bfe6e78fce0d8330d87041 [0,2,0,0,0,0|1,0,0]=3 16328 B13R1.149 CC(O)CNCc1cc[nH]c(=O)n1 5a93f7ccdfaa877a193828e43184c232 [0,2,0,0,0,0|2,0,0]=4 16329 B13R1.149 CC(O)CNCc1cccc(c1)Br 96c3a210b71936f93aa38f67bf96eb35 [0,2,0,0,0,0|2,0,0]=4 16330 B13R1.149 CC(O)CNCc1cccc(c1)Cl bfa2522930e68a852f8c633c49a75b0c [0,2,0,0,0,0|2,0,0]=4 16331 B13R1.149 CC(O)CNCc1cccc(c1)F 8b2d350c09d7c6f09c1b6adfeb3cde72 [0,2,0,0,0,0|2,0,0]=4 16332 B13R1.149 CC(O)CNCc1cccc(c1)I 6e3819fea386711bc80dd904df96cb02 [0,2,0,0,0,0|2,0,0]=4 16333 B13R1.149 CC(O)CNCc1cccc(n1)Br 988dbaf2f810ff24ae572eec60dc76fe [0,2,0,0,0,0|1,0,0]=3 16334 B13R1.149 CC(O)CNCc1cccc(n1)Cl c15fda34701f063dce91af67b5f54507 [0,2,0,0,0,0|1,0,0]=3 16335 B13R1.149 CC(O)CNCc1cccc(n1)F 5b2cd1d8adfa69c114be7062ec92ed20 [0,2,0,0,0,0|1,0,0]=3 16336 B13R1.149 CC(O)CNCc1ccnc(n1)Cl 2703165c97fa61e120dc20200be7b988 [0,2,0,0,0,0|2,0,0]=4 16337 B13R1.149 CC(O)CNCc1cncc(n1)Cl 2e165b6b38a360e64a4c3d4bc6cfaa4e [0,2,0,0,0,0|2,0,0]=4 16338 B13R1.149 CC(O)CNCc1nccc(n1)Cl a35a724898b279814a5400585fcac20c [0,2,0,0,0,0|2,0,0]=4 16339 B13R1.149 CC(S)COCc1cc(ccn1)Br 7e6ed502f527e2c412333271fa307bba [0,2,0,0,0,0|1,0,0]=3 16340 B13R1.149 CC(S)COCc1cc(ccn1)Cl 6bb8a91fe98d7da7eb1f92413496ef8b [0,2,0,0,0,0|1,0,0]=3 16341 B13R1.149 CC(S)COCc1cccc(c1)Br 4e4b0a9a54a6d21896c2aa9b2d986515 [0,2,0,0,0,0|2,0,0]=4 16342 B13R1.149 CC(S)COCc1cccc(c1)Cl df58bec81e56d886a9b607d3d3099deb [0,2,0,0,0,0|2,0,0]=4 16343 B13R1.149 CC(S)COCc1cccc(c1)F 0742c947c8c8395b8dd90ba316d60b64 [0,2,0,0,0,0|2,0,0]=4 16344 B13R1.149 CC(S)COCc1cccc(c1)I f8e3b20e5d7b3dbfc46679a270ae382e [0,2,0,0,0,0|2,0,0]=4 16345 B13R1.149 CC(S)COCc1cccc(n1)Br a9b8f09d701d15a7bbfee2d1b80635ad [0,2,0,0,0,0|1,0,0]=3 16346 B13R1.149 CC(S)COCc1cccc(n1)Cl 23723193d3f8b87c54614a5481e552de [0,2,0,0,0,0|1,0,0]=3 16347 B13R1.149 CC(S)COCc1cccc(n1)F 5f8bfb957e6718542b9aec08f2e90297 [0,2,0,0,0,0|1,0,0]=3 16348 B13R1.149 CC(S)COCc1ccnc(n1)Cl ba4294e34a24eb99f0b62412bc6c906c [0,2,0,0,0,0|2,0,0]=4 16349 B13R1.149 CC(S)COCc1nccc(n1)Cl 6d1e2df721287de2446441118630a332 [0,2,0,0,0,0|2,0,0]=4 16350 B13R1.149 CN(C)CCNc1cc(ccn1)Br fe9ae1d6f1d1caca0b497ced11e28ba8 [0,2,0,0,0,0|2,0,0]=4 16351 B13R1.149 CN(C)CCNc1cc(ccn1)Cl 3e8427ffa62da25388fa0baae048e2bb [0,2,0,0,0,0|2,0,0]=4 16352 B13R1.149 CN(C)CCNc1cc(ccn1)F 87d45566f8b60d634cbb14a7268bf7b7 [0,2,0,0,0,0|2,0,0]=4 16353 B13R1.149 CN(C)CCNc1cc(ccn1)I 3e02a08187f6cea7a8d30c7e8200e7f6 [0,2,0,0,0,0|2,0,0]=4 16354 B13R1.149 CN(C)CCNc1cccc(n1)Br 9bfe6edd7d74e22c03f453a142d11608 [0,2,0,0,0,0|2,0,0]=4 16355 B13R1.149 CN(C)CCNc1cccc(n1)Cl eb010857dcd7dce6febf88baeb1ae21f [0,2,0,0,0,0|2,0,0]=4 16356 B13R1.149 CN(C)CCNc1cccc(n1)F ce64301178d197c77be04c0764627e59 [0,2,0,0,0,0|2,0,0]=4 16357 B13R1.149 CN(C)CCNc1cccc(n1)I 902950a132aee2d838e04484cf9b3a5e [0,2,0,0,0,0|2,0,0]=4 16358 B13R1.149 CN(C)CCOc1cc(ccn1)Br 6e21d62ebb4921bb7a668d9fe7899664 [0,2,0,0,0,0|2,0,0]=4 16359 B13R1.149 CN(C)CCOc1cc(ccn1)Cl e71cbc600dfe0946cfb97f26500c75ae [0,2,0,0,0,0|2,0,0]=4 16360 B13R1.149 CN(C)CCOc1cc(ccn1)F 960e3d931cef52a8a970f24f2bcc1d32 [0,2,0,0,0,0|2,0,0]=4 16361 B13R1.149 CN(C)CCOc1cccc(n1)Br a93c70eb9ba17a6183e1dddf57ff36d0 [0,2,0,0,0,0|2,0,0]=4 16362 B13R1.149 CN(C)CCOc1cccc(n1)F 8db1dbee97fc2c03ec8ec0c4a9084226 [0,2,0,0,0,0|2,0,0]=4 16363 B13R1.149 CN(C)CNCc1cc(ccn1)Br 962bfbbf1db20e277d7880aff28e0b8c [0,2,0,0,0,0|2,0,0]=4 16364 B13R1.149 CN(C)CNCc1cc(ccn1)Cl c7c70119d902ccb5f37c4fa40761ba44 [0,2,0,0,0,0|2,0,0]=4 16365 B13R1.149 CN(C)CNCc1cccc(n1)Cl 1892a61580ce38194a78e99af38ebf37 [0,2,0,0,0,0|2,0,0]=4 16366 B13R1.149 CN(C)CNCc1cccc(n1)F 69ef21eb40b970beed17d05e2ec16cc6 [0,2,0,0,0,0|2,0,0]=4 16367 B13R1.149 CN(C)COCc1cc(ccn1)Br 053a90d6543bc466a5fcdbd9de0ecb72 [0,2,0,0,0,0|2,0,0]=4 16368 B13R1.149 CN(C)COCc1cc(ccn1)Cl 7a94b6837ca8b7d11cef4ca80c1deaac [0,2,0,0,0,0|2,0,0]=4 16369 B13R1.149 CN(C)COCc1cc(ccn1)F b9e740602df7fcc3dc40a279bfdbb85d [0,2,0,0,0,0|2,0,0]=4 16370 B13R1.149 CN(C)COCc1cc(ccn1)I 4c3c7206a46096390b1b52daef906dc5 [0,2,0,0,0,0|2,0,0]=4 16371 B13R1.149 CN(C)COCc1cccc(n1)F e7a17bf65b65b28cc9e2e2397ac0fc45 [0,2,0,0,0,0|2,0,0]=4 16372 B13R1.149 CN(C)COCc1cccc(n1)I dc51e2d2c36747cc704040699a8ce4e7 [0,2,0,0,0,0|2,0,0]=4 16373 B13R1.149 CS(=O)CCNc1cc(ccn1)Br e54d887ae4960cc926adf370c56738e7 [0,2,0,0,0,0|2,0,0]=4 16374 B13R1.149 CS(=O)CCNc1cc(ccn1)Cl f61e311dff5063104354a5b95019bdd7 [0,2,0,0,0,0|2,0,0]=4 16375 B13R1.149 CS(=O)CCNc1cc(ccn1)F 0f6aaa218e145d60cb31a5e5a92533e7 [0,2,0,0,0,0|2,0,0]=4 16376 B13R1.149 CS(=O)CCNc1cc(ccn1)I fda535bb76465aa1b6ca8e874b1eb475 [0,2,0,0,0,0|2,0,0]=4 16377 B13R1.149 CS(=O)CCNc1cc(ccn1)O 9380a59f1e03fbd285cca77fe0e2456e [0,2,0,0,0,0|2,0,0]=4 16378 B13R1.149 CS(=O)CCNc1cccc(n1)Br bd2e8b735dffa01836134215ea17fde3 [0,2,0,0,0,0|2,0,0]=4 16379 B13R1.149 CS(=O)CCNc1cccc(n1)Cl 42010361e63deecd27458d38b0b8eeb7 [0,2,0,0,0,0|2,0,0]=4 16380 B13R1.149 CS(=O)CCNc1cccc(n1)F 725d3f9e160915062431dd78418a7174 [0,2,0,0,0,0|2,0,0]=4 16381 B13R1.149 CS(=O)CCNc1cccc(n1)I 5ab06134034851e24d320b1b2e92c954 [0,2,0,0,0,0|2,0,0]=4 16382 B13R1.149 CS(=O)CCOc1cc(ccn1)Br bd59ec579fea4e69820c543e17bb9e29 [0,2,0,0,0,0|2,0,0]=4 16383 B13R1.149 CS(=O)CCOc1cc(ccn1)Cl 6fdb570b3cdbc98ef1ddd0d824315468 [0,2,0,0,0,0|2,0,0]=4 16384 B13R1.149 CS(=O)CCOc1cc(ccn1)F 1d645922887b400355cea0ff31c25674 [0,2,0,0,0,0|2,0,0]=4 16385 B13R1.149 CS(=O)CCOc1cccc(n1)Br 28ebd00c88fa34b4b97472a247c0ec59 [0,2,0,0,0,0|2,0,0]=4 16386 B13R1.149 CS(=O)CCOc1cccc(n1)F adbf6d06f9a9a40c3dcd2b9189d75cf6 [0,2,0,0,0,0|2,0,0]=4 16387 B13R1.149 C[C@@H](F)COCc1cc(ccn1)Br 4c9c94084f4304b3237cba815223fb1c [0,2,0,0,0,0|1,0,0]=3 16388 B13R1.149 C[C@@H](F)COCc1cc(ccn1)Cl 2b7ee0cb032d07f77685ffcc12cf1d29 [0,2,0,0,0,0|1,0,0]=3 16389 B13R1.149 C[C@@H](F)COCc1cccc(c1)Br cf1cc6262d2a693227c6d4ea409c1595 [0,2,0,0,0,0|2,0,0]=4 16390 B13R1.149 C[C@@H](F)COCc1cccc(c1)Cl 62bf4e37ec89a54c7f5353fceb510bcd [0,2,0,0,0,0|2,0,0]=4 16391 B13R1.149 C[C@@H](F)COCc1cccc(c1)F 4b8e13c530775dd4071dd9a88ff78ef4 [0,2,0,0,0,0|2,0,0]=4 16392 B13R1.149 C[C@@H](F)COCc1cccc(c1)I 9e63ecaae8b9f4c0832f6f3dbcab4847 [0,2,0,0,0,0|2,0,0]=4 16393 B13R1.149 C[C@@H](F)COCc1cccc(n1)Br 42ed97b0aa947c67af42e0da998df518 [0,2,0,0,0,0|1,0,0]=3 16394 B13R1.149 C[C@@H](F)COCc1cccc(n1)Cl 588b6fccb1bdd1cc95801d01584570e5 [0,2,0,0,0,0|1,0,0]=3 16395 B13R1.149 C[C@@H](F)COCc1cccc(n1)F 56cdfc9af32efffd23f14d422c040725 [0,2,0,0,0,0|1,0,0]=3 16396 B13R1.149 C[C@@H](F)COCc1ccnc(n1)Cl 95988fe036ef1057960e49abaa0df2ce [0,2,0,0,0,0|2,0,0]=4 16397 B13R1.149 C[C@@H](F)COCc1nccc(n1)Cl bd079425b6718d309a7beb2ae5abedee [0,2,0,0,0,0|2,0,0]=4 16398 B13R1.149 C[C@@H](O)CCNc1cc(ccn1)O bf3f08225dd16d53d1f67b2a5b34da6b [0,2,0,0,0,0|1,0,0]=3 16399 B13R1.149 C[C@@H](O)CCNc1cccc(c1)S c01831baa5d1b1a2a99d9e318c0596d4 [0,2,0,0,0,0|2,0,0]=4 16400 B13R1.149 C[C@@H](O)CCNc1ccnc(n1)F 7481c19b11b6aec9f71e0a09855b20a8 [0,2,0,0,0,0|2,0,0]=4 16401 B13R1.149 C[C@@H](O)CCNc1ccnc(n1)O c3143f65574a5ecaa58b32411cd0bc7d [0,2,0,0,0,0|2,0,0]=4 16402 B13R1.149 C[C@@H](O)CCNc1cncc(n1)F 47d38351e4da9d58871823fc90e3e3d7 [0,2,0,0,0,0|2,0,0]=4 16403 B13R1.149 C[C@@H](O)CNCc1cc(ccn1)Br 5c925d0d6a272e8068189da5f405ae78 [0,2,0,0,0,0|1,0,0]=3 16404 B13R1.149 C[C@@H](O)CNCc1cc(ccn1)Cl 4e96dd3d15964daae4d62e9041fd9d86 [0,2,0,0,0,0|1,0,0]=3 16405 B13R1.149 C[C@@H](O)CNCc1cc[nH]c(=O)n1 bc2860130bae38461fd6f65cb77f34a5 [0,2,0,0,0,0|2,0,0]=4 16406 B13R1.149 C[C@@H](O)CNCc1cccc(c1)Br 69874046edb7aeb76259b569be3fa78e [0,2,0,0,0,0|2,0,0]=4 16407 B13R1.149 C[C@@H](O)CNCc1cccc(c1)Cl f9ad7dabf65b4f1d156e2d87ab0c2ee1 [0,2,0,0,0,0|2,0,0]=4 16408 B13R1.149 C[C@@H](O)CNCc1cccc(c1)F 4f5e9662828dc90cc515c9d71b89caef [0,2,0,0,0,0|2,0,0]=4 16409 B13R1.149 C[C@@H](O)CNCc1cccc(c1)I 258c7599f672f8fbe7cbdedd9936e6a4 [0,2,0,0,0,0|2,0,0]=4 16410 B13R1.149 C[C@@H](O)CNCc1cccc(n1)Br bf5c3d8cd0f78353b68a34210b01cacb [0,2,0,0,0,0|1,0,0]=3 16411 B13R1.149 C[C@@H](O)CNCc1cccc(n1)Cl 86cb7db700c4fe21d2d82debff0375fa [0,2,0,0,0,0|1,0,0]=3 16412 B13R1.149 C[C@@H](O)CNCc1cccc(n1)F 75e5e6e7be25e631dd6a26df5fb9254d [0,2,0,0,0,0|1,0,0]=3 16413 B13R1.149 C[C@@H](O)CNCc1ccnc(n1)Cl f61f5382b218f3d2c254207d834753ca [0,2,0,0,0,0|2,0,0]=4 16414 B13R1.149 C[C@@H](O)CNCc1cncc(n1)Cl 5695265addc4f5a5a084f3cd9a60dcb5 [0,2,0,0,0,0|2,0,0]=4 16415 B13R1.149 C[C@@H](O)CNCc1nccc(n1)Cl 999334bd3b1657b37b097fcb35b2745a [0,2,0,0,0,0|2,0,0]=4 16416 B13R1.149 C[C@H](F)COCc1cc(ccn1)Br 4a6cade4c9ce67a33ce1401557c05eab [0,2,0,0,0,0|1,0,0]=3 16417 B13R1.149 C[C@H](F)COCc1cc(ccn1)Cl a1497efa9d329ad08e7c7a754da801b8 [0,2,0,0,0,0|1,0,0]=3 16418 B13R1.149 C[C@H](F)COCc1cccc(c1)Br 4a39d21bccfaa9b95907c148417192be [0,2,0,0,0,0|2,0,0]=4 16419 B13R1.149 C[C@H](F)COCc1cccc(c1)Cl c71c22b683c9dc015eb02289c9b1ae3f [0,2,0,0,0,0|2,0,0]=4 16420 B13R1.149 C[C@H](F)COCc1cccc(c1)F 83013d8fec29391e2fd05412adfe034d [0,2,0,0,0,0|2,0,0]=4 16421 B13R1.149 C[C@H](F)COCc1cccc(c1)I 56cfd3be5b9b1a7177f5ef5d5983ab4a [0,2,0,0,0,0|2,0,0]=4 16422 B13R1.149 C[C@H](F)COCc1cccc(n1)Br aa7c1cd2b8ac0b586763a31182c86afb [0,2,0,0,0,0|1,0,0]=3 16423 B13R1.149 C[C@H](F)COCc1cccc(n1)Cl f22dffdff3ec6e25b1bbe80d4166fc83 [0,2,0,0,0,0|1,0,0]=3 16424 B13R1.149 C[C@H](F)COCc1cccc(n1)F 8e6a0444804660d08a4b66d651b724cf [0,2,0,0,0,0|1,0,0]=3 16425 B13R1.149 C[C@H](F)COCc1ccnc(n1)Cl 83bebbeb4edfb1dce2aac4a67ba3c810 [0,2,0,0,0,0|2,0,0]=4 16426 B13R1.149 C[C@H](F)COCc1nccc(n1)Cl 942c221aa09673f9ad5ab520d3555b15 [0,2,0,0,0,0|2,0,0]=4 16427 B13R1.149 C[C@H](O)CCNc1cc(ccn1)O 110a851348f641555e733319881636b0 [0,2,0,0,0,0|1,0,0]=3 16428 B13R1.149 C[C@H](O)CCNc1cccc(c1)S 615c850fa48c1799db2bc7f9ddc9798e [0,2,0,0,0,0|2,0,0]=4 16429 B13R1.149 C[C@H](O)CCNc1ccnc(n1)F fc4bc5ef673527d07bb08ae07b9b2b57 [0,2,0,0,0,0|2,0,0]=4 16430 B13R1.149 C[C@H](O)CCNc1ccnc(n1)O 4dccc82fd13436b2057f5822f080c300 [0,2,0,0,0,0|2,0,0]=4 16431 B13R1.149 C[C@H](O)CCNc1cncc(n1)F 14ff735711346e6fe9bdc5b910dbf26f [0,2,0,0,0,0|2,0,0]=4 16432 B13R1.149 C[C@H](O)CNCc1cc(ccn1)Br 539f22cd6ef3a5031fca7cf79f463a3c [0,2,0,0,0,0|1,0,0]=3 16433 B13R1.149 C[C@H](O)CNCc1cc(ccn1)Cl 2bb03a79d36d61f4f610e0817108ce4a [0,2,0,0,0,0|1,0,0]=3 16434 B13R1.149 C[C@H](O)CNCc1cc[nH]c(=O)n1 69f4656168e3aa4bd00a6ed0315105d9 [0,2,0,0,0,0|2,0,0]=4 16435 B13R1.149 C[C@H](O)CNCc1cccc(c1)Br a700fc84111e1d6dbfad025016f8f9dd [0,2,0,0,0,0|2,0,0]=4 16436 B13R1.149 C[C@H](O)CNCc1cccc(c1)Cl f173ac5763c9fdac0f8a064275aa9547 [0,2,0,0,0,0|2,0,0]=4 16437 B13R1.149 C[C@H](O)CNCc1cccc(c1)F b8b5fde3fd2f274022ce343ba3c10973 [0,2,0,0,0,0|2,0,0]=4 16438 B13R1.149 C[C@H](O)CNCc1cccc(c1)I 8a98f34e84eaf0bd0d7cfae126aa46a6 [0,2,0,0,0,0|2,0,0]=4 16439 B13R1.149 C[C@H](O)CNCc1cccc(n1)Br 9b91617262e688769c8162b8bb182363 [0,2,0,0,0,0|1,0,0]=3 16440 B13R1.149 C[C@H](O)CNCc1cccc(n1)Cl 1e8d60d1990683ddc7e0e9a0a73e4a9f [0,2,0,0,0,0|1,0,0]=3 16441 B13R1.149 C[C@H](O)CNCc1cccc(n1)F 4f27dc1d092ddddce9c7bb3a328ca365 [0,2,0,0,0,0|1,0,0]=3 16442 B13R1.149 C[C@H](O)CNCc1ccnc(n1)Cl 5e79789bd086f88e2ece509bf80ce343 [0,2,0,0,0,0|2,0,0]=4 16443 B13R1.149 C[C@H](O)CNCc1cncc(n1)Cl 3202ff486d86924a7c32430b49c6d4f7 [0,2,0,0,0,0|2,0,0]=4 16444 B13R1.149 C[C@H](O)CNCc1nccc(n1)Cl 0fd2be54ca746a44cb3aa8b1672dca60 [0,2,0,0,0,0|2,0,0]=4 16445 B13R1.149 Cc1cc(ncn1)COCC(C)C 943722d61526878760b22ea7b3ef4184 [0,2,0,0,0,0|2,0,0]=4 16446 B13R1.149 Cc1cc(ncn1)NCCC(C)C 322964951d1b1b8b97c1b622e31bbb6b [0,2,0,0,0,0|2,0,0]=4 16447 B13R1.149 Cc1cc(ncn1)NCCC(C)O d2685fd6b7de8bd400c2cbacd8d1dae6 [0,2,0,0,0,0|2,0,0]=4 16448 B13R1.149 Cc1cc(ncn1)OCCC(C)C afa91787fbab5b6202dd26522402a4ae [0,2,0,0,0,0|2,0,0]=4 16449 B13R1.149 Cc1cccc(c1)CCNC(C)C c39e9eb6cd3172a22f2d9d4871d0035b [0,2,0,0,0,0|2,0,0]=4 16450 B13R1.149 Cc1cccc(c1)CCOC(C)C cd2152cc295c42783fd32e0023dabc76 [0,2,0,0,0,0|2,0,0]=4 16451 B13R1.149 Cc1cccc(c1)CNCC(C)C bb0334a779fbb99d989ae97d253da6e4 [0,2,0,0,0,0|2,0,0]=4 16452 B13R1.149 Cc1cccc(c1)CNCC(C)O 6cd8b22b8b66596ec7f6cf4781ce8f07 [0,2,0,0,0,0|2,0,0]=4 16453 B13R1.149 Cc1cccc(c1)CNC[C@@H](C)O d2b7c55835ed26af16973da42cd2c877 [0,2,0,0,0,0|2,0,0]=4 16454 B13R1.149 Cc1cccc(c1)CNC[C@H](C)O 8519a715397b2285cd74367a46cfad5e [0,2,0,0,0,0|2,0,0]=4 16455 B13R1.149 Cc1cccc(c1)COCC(C)C 83cff12924188163800d8a65ff2e2ffa [0,2,0,0,0,0|2,0,0]=4 16456 B13R1.149 Cc1cccc(c1)COCC(C)F 4c27974e7009d439231850c64086182a [0,2,0,0,0,0|2,0,0]=4 16457 B13R1.149 Cc1cccc(c1)COCC(C)S 4682f7210be9fa1d483415cedf6d9161 [0,2,0,0,0,0|2,0,0]=4 16458 B13R1.149 Cc1cccc(c1)COC[C@@H](C)F beb9987f076613d9a3f70e0d5fc40c08 [0,2,0,0,0,0|2,0,0]=4 16459 B13R1.149 Cc1cccc(c1)COC[C@H](C)F 91d91eac1f7bc52b38fee473aadac7e9 [0,2,0,0,0,0|2,0,0]=4 16460 B13R1.149 Cc1cccc(c1)NCCC(C)C 8db9566c14d7eabdc062f980450fbf7e [0,2,0,0,0,0|2,0,0]=4 16461 B13R1.149 Cc1cccc(c1)NCCC(C)O b07cff58b2674b4597cec64c761b6ada [0,2,0,0,0,0|2,0,0]=4 16462 B13R1.149 Cc1cccc(c1)NCC[C@@H](C)O b37f185c717ea55d21c399087dc9810a [0,2,0,0,0,0|2,0,0]=4 16463 B13R1.149 Cc1cccc(c1)NCC[C@H](C)O 0645bdc59ab1937e7c831605852b54be [0,2,0,0,0,0|2,0,0]=4 16464 B13R1.149 Cc1cccc(c1)OCCC(C)C 28d5797108494efc011346ebebffb4c4 [0,2,0,0,0,0|2,0,0]=4 16465 B13R1.149 Cc1cccc(n1)CCNC(C)C 919c963320960ea9a28eaea5eb388d52 [0,2,0,0,0,0|1,0,0]=3 16466 B13R1.149 Cc1cccc(n1)CCOC(C)C 0be5b7de39b8cf294823c56493e86900 [0,2,0,0,0,0|1,0,0]=3 16467 B13R1.149 Cc1cccc(n1)CNCC(C)C ff11eee154679a8dd9d18c440b01466d [0,2,0,0,0,0|1,0,0]=3 16468 B13R1.149 Cc1cccc(n1)CNCC(C)O dbe605d552e7b7a32658b082b6c918a6 [0,2,0,0,0,0|1,0,0]=3 16469 B13R1.149 Cc1cccc(n1)CNCC(F)F 93099184f775c655892a8a4d1785ba75 [0,2,0,0,0,0|2,0,0]=4 16470 B13R1.149 Cc1cccc(n1)CNCN(C)C 27eab59f88c4985f3551b8f37f68e759 [0,2,0,0,0,0|2,0,0]=4 16471 B13R1.149 Cc1cccc(n1)CNC[C@@H](C)O 496f3652559425c483c2dd0671b0558f [0,2,0,0,0,0|1,0,0]=3 16472 B13R1.149 Cc1cccc(n1)CNC[C@H](C)O 343e3d694eb954adba06fee9ef16e620 [0,2,0,0,0,0|1,0,0]=3 16473 B13R1.149 Cc1cccc(n1)COCC(C)C 31d233a0afc0449026efad09f271804a [0,2,0,0,0,0|1,0,0]=3 16474 B13R1.149 Cc1cccc(n1)COCC(C)F ee9bb05730777a92efad5aba67b2f923 [0,2,0,0,0,0|1,0,0]=3 16475 B13R1.149 Cc1cccc(n1)COCC(C)S 4d7afe12d3a6083d4b82b392494a3a83 [0,2,0,0,0,0|1,0,0]=3 16476 B13R1.149 Cc1cccc(n1)COCC(F)F e67b0eb97e84d502ff162f8990d8a5a9 [0,2,0,0,0,0|2,0,0]=4 16477 B13R1.149 Cc1cccc(n1)COCN(C)C 01dafa25dc9bfdf5732bbb352d0ea158 [0,2,0,0,0,0|2,0,0]=4 16478 B13R1.149 Cc1cccc(n1)COC[C@@H](C)F c533d45266adb920a73cd341c0179d2c [0,2,0,0,0,0|1,0,0]=3 16479 B13R1.149 Cc1cccc(n1)COC[C@H](C)F 40febd2f0e7d7f9eca6d58c76d6e33ea [0,2,0,0,0,0|1,0,0]=3 16480 B13R1.149 Cc1cccc(n1)NCCC(C)C 74e7b5fd1046e05eaafd2f1ab4d5b617 [0,2,0,0,0,0|1,0,0]=3 16481 B13R1.149 Cc1cccc(n1)NCCC(C)O ee23b477569d6d3fe068aec6187ef8be [0,2,0,0,0,0|1,0,0]=3 16482 B13R1.149 Cc1cccc(n1)NCCC(F)F cadfa997168be583f7d762cc115fe6a6 [0,2,0,0,0,0|2,0,0]=4 16483 B13R1.149 Cc1cccc(n1)NCCN(C)C 8f39a197fd8b4f3db08c66d84e5f456c [0,2,0,0,0,0|2,0,0]=4 16484 B13R1.149 Cc1cccc(n1)NCCS(=O)C 345041861d49286e5d040436906e8f10 [0,2,0,0,0,0|2,0,0]=4 16485 B13R1.149 Cc1cccc(n1)NCC[C@@H](C)O 7bef61ea07af8d7b25c30b40a9bffcf5 [0,2,0,0,0,0|1,0,0]=3 16486 B13R1.149 Cc1cccc(n1)NCC[C@H](C)O 091e8df36232d2062b287d20eecc4c16 [0,2,0,0,0,0|1,0,0]=3 16487 B13R1.149 Cc1cccc(n1)NCOC(C)C aaf0f6812d79b80334ccbfd2871517be [0,2,0,0,0,0|2,0,0]=4 16488 B13R1.149 Cc1cccc(n1)OCCC(C)C bdfe612e4273e729b6e2e74a2302e3c9 [0,2,0,0,0,0|1,0,0]=3 16489 B13R1.149 Cc1cccc(n1)OCCN(C)C 2ddab0850c988cadc2ce2b4a620c664f [0,2,0,0,0,0|2,0,0]=4 16490 B13R1.149 Cc1cccc(n1)OCCS(=O)C b22288c6fecf492acdf5c4f0f6d22836 [0,2,0,0,0,0|2,0,0]=4 16491 B13R1.149 Cc1cccc(n1)OCOC(C)C c338b4d57d6d686a0f768f427e14339d [0,2,0,0,0,0|2,0,0]=4 16492 B13R1.149 Cc1ccnc(c1)CNCC(C)C 714bf57c1edbf5ec7caac8542e751d36 [0,2,0,0,0,0|1,0,0]=3 16493 B13R1.149 Cc1ccnc(c1)CNCC(C)O 8f8d2f8c4be0304346330fa789deecec [0,2,0,0,0,0|1,0,0]=3 16494 B13R1.149 Cc1ccnc(c1)CNCC(F)F 5f958416906b3f4ce0fbcf5564fe0e60 [0,2,0,0,0,0|2,0,0]=4 16495 B13R1.149 Cc1ccnc(c1)CNCN(C)C 504632ebb4b6eee456764bb153e8cab1 [0,2,0,0,0,0|2,0,0]=4 16496 B13R1.149 Cc1ccnc(c1)CNC[C@@H](C)O 584fd7b9f8240d4a3246f3f3dd542740 [0,2,0,0,0,0|1,0,0]=3 16497 B13R1.149 Cc1ccnc(c1)CNC[C@H](C)O f043a8e61df5dd1eedd4b93e4c11efc9 [0,2,0,0,0,0|1,0,0]=3 16498 B13R1.149 Cc1ccnc(c1)COCC(C)C 730d34729b3ce37c817a02d6c707f62f [0,2,0,0,0,0|1,0,0]=3 16499 B13R1.149 Cc1ccnc(c1)COCC(C)F 81ec7ffac26b84fa787ef8ca2ddf8332 [0,2,0,0,0,0|1,0,0]=3 16500 B13R1.149 Cc1ccnc(c1)COCC(C)S 97940bb1bb3f05048e69dd40d7b1ec7f [0,2,0,0,0,0|1,0,0]=3 16501 B13R1.149 Cc1ccnc(c1)COCC(F)F 0fbeeb02047ddfb867cbd4e194828ccd [0,2,0,0,0,0|2,0,0]=4 16502 B13R1.149 Cc1ccnc(c1)COCN(C)C ea70cbeef206b376f8d9dbf9800ae605 [0,2,0,0,0,0|2,0,0]=4 16503 B13R1.149 Cc1ccnc(c1)COC[C@@H](C)F 4cd53ffc68b658c9e9cb7a6bd74cf8be [0,2,0,0,0,0|1,0,0]=3 16504 B13R1.149 Cc1ccnc(c1)COC[C@H](C)F 6e3a1f51e34a46c43bde42e3760a46a0 [0,2,0,0,0,0|1,0,0]=3 16505 B13R1.149 Cc1ccnc(c1)NCCC(C)C 82214eecf4bc83fffb9b1f226440a776 [0,2,0,0,0,0|1,0,0]=3 16506 B13R1.149 Cc1ccnc(c1)NCCC(C)O 563f53e85ee48db22a1ddf3fc4b02341 [0,2,0,0,0,0|1,0,0]=3 16507 B13R1.149 Cc1ccnc(c1)NCCN(C)C 2baf2a5baaf8b6316d23efa33b915967 [0,2,0,0,0,0|2,0,0]=4 16508 B13R1.149 Cc1ccnc(c1)NCCS(=O)C c992546f433598fba8f8999521ac1ca7 [0,2,0,0,0,0|2,0,0]=4 16509 B13R1.149 Cc1ccnc(c1)NCC[C@@H](C)O 34adecaef7ab810c25b8aac02c53fb62 [0,2,0,0,0,0|1,0,0]=3 16510 B13R1.149 Cc1ccnc(c1)NCC[C@H](C)O 862682ed164e39205889c2b34640f1dc [0,2,0,0,0,0|1,0,0]=3 16511 B13R1.149 Cc1ccnc(c1)NCOC(C)C 12742f527acf11ef70d6a50870d966ca [0,2,0,0,0,0|2,0,0]=4 16512 B13R1.149 Cc1ccnc(c1)OCCC(C)C cc26977101e1ee731b5a3ebaa081464a [0,2,0,0,0,0|1,0,0]=3 16513 B13R1.149 Cc1ccnc(c1)OCCN(C)C 68172b08ad78fc594416d0f527eeb47e [0,2,0,0,0,0|2,0,0]=4 16514 B13R1.149 Cc1ccnc(c1)OCCS(=O)C 420418bc30fc2e89cec234cadf497954 [0,2,0,0,0,0|2,0,0]=4 16515 B13R1.149 Cc1ccnc(c1)OCOC(C)C b013854aef5d5396c42144d0f527cf09 [0,2,0,0,0,0|2,0,0]=4 16516 B13R1.149 Cc1ccnc(n1)CNCC(C)C 8e6cb3e34d51ad8d98d9c864ecd42ce6 [0,2,0,0,0,0|2,0,0]=4 16517 B13R1.149 Cc1ccnc(n1)CNCC(C)O e314c4a834775631165039231f2ec6b1 [0,2,0,0,0,0|2,0,0]=4 16518 B13R1.149 Cc1ccnc(n1)CNC[C@@H](C)O d0e038c6b9c087878e3872a74537a669 [0,2,0,0,0,0|2,0,0]=4 16519 B13R1.149 Cc1ccnc(n1)CNC[C@H](C)O 86da75d023048031a3bbc4cee869c751 [0,2,0,0,0,0|2,0,0]=4 16520 B13R1.149 Cc1ccnc(n1)COCC(C)C 450befb6438af7abfb4ce7e18232fff9 [0,2,0,0,0,0|2,0,0]=4 16521 B13R1.149 Cc1ccnc(n1)COCC(C)F 9874072fcf99fb3a393a92fd0ff1e601 [0,2,0,0,0,0|2,0,0]=4 16522 B13R1.149 Cc1ccnc(n1)COCC(C)S e12e7be99151b2121a081ce785e83c23 [0,2,0,0,0,0|2,0,0]=4 16523 B13R1.149 Cc1ccnc(n1)COC[C@@H](C)F ce239f87ff386774a1720d73103150a2 [0,2,0,0,0,0|2,0,0]=4 16524 B13R1.149 Cc1ccnc(n1)COC[C@H](C)F 28e0942fad255ff02e4557affb2b986e [0,2,0,0,0,0|2,0,0]=4 16525 B13R1.149 Cc1ccnc(n1)NCCC(C)C 1a0e03674b4a408a60a06cd9cc4d1fdb [0,2,0,0,0,0|2,0,0]=4 16526 B13R1.149 Cc1ccnc(n1)NCCC(C)O 7c43697bc45ac9529f37794e8e0e6e3b [0,2,0,0,0,0|2,0,0]=4 16527 B13R1.149 Cc1ccnc(n1)NCC[C@@H](C)O 4c9b41d03d27d4a249d4efbd58f6773c [0,2,0,0,0,0|2,0,0]=4 16528 B13R1.149 Cc1ccnc(n1)NCC[C@H](C)O 8180477bb2d4a64a451d4094ca0152f1 [0,2,0,0,0,0|2,0,0]=4 16529 B13R1.149 Cc1cncc(n1)NCCC(C)C f2a4ffcf62009d00ab06725fa6dcdb07 [0,2,0,0,0,0|2,0,0]=4 16530 B13R1.149 Cc1cncc(n1)NCCC(C)O 6c20b06a74ffd3194e21a181c8003974 [0,2,0,0,0,0|2,0,0]=4 16531 B13R1.149 Cc1cncc(n1)OCCC(C)C 34841ffd1e8916107d120c759c779c64 [0,2,0,0,0,0|2,0,0]=4 16532 B13R1.149 Cc1cnnc(c1)CNCC(C)C 22531065bfa81e6f0416c7cb03e51105 [0,2,0,0,0,0|2,0,0]=4 16533 B13R1.149 Cc1cnnc(c1)COCC(C)C 46bdbaaa770fab010a21a7ca12234bc4 [0,2,0,0,0,0|2,0,0]=4 16534 B13R1.149 Cc1cnnc(c1)NCCC(C)C c8d77d68fa11a61dffe7665edf02857f [0,2,0,0,0,0|2,0,0]=4 16535 B13R1.149 Cc1cnnc(c1)NCCC(C)O 16b56e1134e21e7a3931ee2128964fef [0,2,0,0,0,0|2,0,0]=4 16536 B13R1.149 Cc1nccc(n1)CNCC(C)C c4025d1c2b24032674356047b92fef5f [0,2,0,0,0,0|2,0,0]=4 16537 B13R1.149 Cc1nccc(n1)CNCC(C)O f3097061f29c408aa39b6a3808ae908c [0,2,0,0,0,0|2,0,0]=4 16538 B13R1.149 Cc1nccc(n1)CNC[C@@H](C)O 753a6abcc8e99a638fb172aa8ba4a4d7 [0,2,0,0,0,0|2,0,0]=4 16539 B13R1.149 Cc1nccc(n1)CNC[C@H](C)O 8a9871c5efab93005960f4884acdfb0c [0,2,0,0,0,0|2,0,0]=4 16540 B13R1.149 Cc1nccc(n1)COCC(C)C e9fb72c1f07aa4576c5becfec373f6bf [0,2,0,0,0,0|2,0,0]=4 16541 B13R1.149 Cc1nccc(n1)NCCC(C)C de2a68db36fef89d19d42d48fb4c3d03 [0,2,0,0,0,0|2,0,0]=4 16542 B13R1.149 Cc1nccc(n1)NCCC(C)O fc3aa14a7af97f86935b848598e48bc5 [0,2,0,0,0,0|2,0,0]=4 16543 B13R1.149 Cc1nccc(n1)NCC[C@@H](C)O c4088291959d0b2a02bf640114559bad [0,2,0,0,0,0|2,0,0]=4 16544 B13R1.149 Cc1nccc(n1)NCC[C@H](C)O 4254f70f7f9de851a74bd3b5c793555e [0,2,0,0,0,0|2,0,0]=4 16545 B13R1.149 Cc1nccc(n1)OCCC(C)C fa9ca051302d3014cc4fc465e8046621 [0,2,0,0,0,0|2,0,0]=4 16546 B13R1.149 FC(F)CNCc1cc(ccn1)Br cf4f99b62cb5c6717e84044914080629 [0,2,0,0,0,0|2,0,0]=4 16547 B13R1.149 FC(F)CNCc1cc(ccn1)Cl d24696be3192d1db434db4f0cfa803a6 [0,2,0,0,0,0|2,0,0]=4 16548 B13R1.149 FC(F)CNCc1cccc(n1)Br 4827dc5497f1750e05b63014f1560b52 [0,2,0,0,0,0|2,0,0]=4 16549 B13R1.149 FC(F)CNCc1cccc(n1)Cl d4b660dd343db7d74ba6f04142718733 [0,2,0,0,0,0|2,0,0]=4 16550 B13R1.149 FC(F)COCc1cc(ccn1)Br 36d7bd6d5f632e6f481da4e374f6fd9e [0,2,0,0,0,0|2,0,0]=4 16551 B13R1.149 FC(F)COCc1cc(ccn1)Cl 664399b55579cd208f3a01cad96633a6 [0,2,0,0,0,0|2,0,0]=4 16552 B13R1.149 FC(F)COCc1cc(ccn1)I 471da8ab99eef0d650a08541ee4e400a [0,2,0,0,0,0|2,0,0]=4 16553 B13R1.149 FC(F)COCc1cccc(n1)Br 14e92e5d659be28a184e0ec05699670e [0,2,0,0,0,0|2,0,0]=4 16554 B13R1.149 FC(F)COCc1cccc(n1)Cl a3adc8e3a0396972971f1bc8f5ef9836 [0,2,0,0,0,0|2,0,0]=4 16555 B13R1.149 FC(F)COCc1cccc(n1)I f75b83d330a74c4eef4e1d85b647854d [0,2,0,0,0,0|2,0,0]=4 16556 B13R1.149 Fc1cccc(n1)CNCC(F)F a3bd2717c99dd36e9ffc545b13125795 [0,2,0,0,0,0|2,0,0]=4 16557 B13R1.149 Fc1cccc(n1)COCC(F)F 0815b1f448b4f0ff906995be77a93047 [0,2,0,0,0,0|2,0,0]=4 16558 B13R1.149 Fc1ccnc(c1)COCC(F)F b6c77cfb16ff6a46593b6c240015b578 [0,2,0,0,0,0|2,0,0]=4 16559 B13R1.656 BrCCNCc1nc(ccc1Br)Br 0a556a0b6b5a290d950c837af0c231b2 [0,2,0,0,0,0|2,0,0]=4 16560 B13R1.656 Brc1ccc(c(n1)CNCCI)Br 2c7603d8a5e9345c61c63b0df3cb0c24 [0,2,0,0,0,0|2,0,0]=4 16561 B13R1.656 CCCCNc1cc(=O)ccn1C 51d88ca0e063960b695c3f5083a5aafa [0,2,0,0,0,0|1,0,1]=4 16562 B13R1.656 CCCCNc1cc(ccc1Br)Cl 938993b2e5900baf3e59e5f5d567be27 [0,2,0,0,0,0|2,0,0]=4 16563 B13R1.656 CCCCNc1cc(ccc1Br)F fc65e67be06cd99d64d6f107c78d1210 [0,2,0,0,0,0|2,0,0]=4 16564 B13R1.656 CCCCNc1cc(ccc1C)C 38a4813e65804208344803abdbc35d97 [0,2,0,0,0,0|2,0,0]=4 16565 B13R1.656 CCCCNc1cc(ccc1C)Cl ac4e1bfb72f8f2d3627ddba952102ee1 [0,2,0,0,0,0|2,0,0]=4 16566 B13R1.656 CCCCNc1cc(ccc1C)F 531be2f9d9d4a06ca0db93146c5680c6 [0,2,0,0,0,0|2,0,0]=4 16567 B13R1.656 CCCCNc1cc(ccc1C)I f5b311cabc7b54028fd1c023ecc7c7cf [0,2,0,0,0,0|2,0,0]=4 16568 B13R1.656 CCCCNc1cc(ccc1C)O 1e851276aade4af2ef9cfe8af5549ee5 [0,2,0,0,0,0|2,0,0]=4 16569 B13R1.656 CCCCNc1cc(ccc1Cl)Br 9e01852e2ba973f12af383e43acc1a1e [0,2,0,0,0,0|2,0,0]=4 16570 B13R1.656 CCCCNc1cc(ccc1Cl)C e7bc1d0101b9cb01dff5ecd288ce1376 [0,2,0,0,0,0|2,0,0]=4 16571 B13R1.656 CCCCNc1cc(ccc1Cl)Cl dffa6e478765549113bdc9c7e05f75b6 [0,2,0,0,0,0|2,0,0]=4 16572 B13R1.656 CCCCNc1cc(ccc1Cl)F 09003992213d82f35eddc26d45e7215e [0,2,0,0,0,0|2,0,0]=4 16573 B13R1.656 CCCCNc1cc(ccc1Cl)I 66b8eee579677442c185990675969edd [0,2,0,0,0,0|2,0,0]=4 16574 B13R1.656 CCCCNc1cc(ccc1F)Br fee48654052b305e6ec1c557fccb256d [0,2,0,0,0,0|2,0,0]=4 16575 B13R1.656 CCCCNc1cc(ccc1F)C b63dedd733fae223483ffff31334bc6f [0,2,0,0,0,0|2,0,0]=4 16576 B13R1.656 CCCCNc1cc(ccc1F)Cl 92f5c91a7b80faabebc7c038a51f362e [0,2,0,0,0,0|2,0,0]=4 16577 B13R1.656 CCCCNc1cc(ccc1F)F 85fef0deeeaf7e2445e6127a8309ce22 [0,2,0,0,0,0|2,0,0]=4 16578 B13R1.656 CCCCNc1cc(ccc1F)I 96a43528a5eb3f8270612b5ddcd654c4 [0,2,0,0,0,0|2,0,0]=4 16579 B13R1.656 CCCCNc1cc(ccc1I)Br 11db4d94d69192a3e4d45e87725217a4 [0,2,0,0,0,0|2,0,0]=4 16580 B13R1.656 CCCCNc1cc(ccc1I)C 57e74fbcc43d63abfdeabb212a12f059 [0,2,0,0,0,0|2,0,0]=4 16581 B13R1.656 CCCCNc1cc(ccc1I)Cl 4d172e461b6d152941cd971851f2eb58 [0,2,0,0,0,0|2,0,0]=4 16582 B13R1.656 CCCCNc1cc(ccc1I)F 50b63ea3663a86ef22f9b79865bf4da3 [0,2,0,0,0,0|2,0,0]=4 16583 B13R1.656 CCCCNc1cc(ccc1N)N 1c51d9c479f7c24e053ef8040eea2e35 [0,2,0,0,0,0|2,0,0]=4 16584 B13R1.656 CCCCNc1cc(ccc1S)Br 58ef273275e86445a0f7a53c60a59611 [0,2,0,0,0,0|2,0,0]=4 16585 B13R1.656 CCCCNc1cc(ccc1S)Cl 7741a1219cb0b70bd7dbd546f4434d6a [0,2,0,0,0,0|2,0,0]=4 16586 B13R1.656 CCCCNc1cc(ccc1S)F 235edf4e9d39fff7da9bcb9bffa2b925 [0,2,0,0,0,0|2,0,0]=4 16587 B13R1.656 CCCCNc1nc(=O)[nH]cc1Br c99daba941f5dc054d7a294ed0b95d16 [0,2,0,0,0,0|2,0,0]=4 16588 B13R1.656 CCCCNc1nc(=O)[nH]cc1C b39ce167743262a2f87ed8c5068f7ecb [0,2,0,0,0,0|2,0,0]=4 16589 B13R1.656 CCCCNc1nc(=O)[nH]cc1Cl 0fdc38b3e4f0ec669955219a0e7e683a [0,2,0,0,0,0|2,0,0]=4 16590 B13R1.656 CCCCNc1nc(=O)[nH]cc1F 7969bb3540bf59b205c195b51f284b2c [0,2,0,0,0,0|2,0,0]=4 16591 B13R1.656 CCCCNc1nc(=O)[nH]cc1I 46525658823fd069684737083fb49e11 [0,2,0,0,0,0|2,0,0]=4 16592 B13R1.656 CCCCNc1nc(c[nH]c1=O)C 5b9622d0540e50bd8c611429b54b9ec4 [0,2,0,0,0,0|2,0,0]=4 16593 B13R1.656 CCCCNc1nc(ccc1Br)Br 52ac51156a42c34345ee4ddc27bbbd52 [0,2,0,0,0,0|1,0,0]=3 16594 B13R1.656 CCCCNc1nc(ccc1Br)C 999746ddc32d8aa850f07f95e7b33194 [0,2,0,0,0,0|1,0,0]=3 16595 B13R1.656 CCCCNc1nc(ccc1Br)F 9eb9d43c95582f9a705e72201c85720f [0,2,0,0,0,0|1,0,0]=3 16596 B13R1.656 CCCCNc1nc(ccc1Br)I ae065a865d91e4f51ce9df715ae4cbae [0,2,0,0,0,0|1,0,0]=3 16597 B13R1.656 CCCCNc1nc(ccc1C)Br b3f97d2627435fbc2e68f09cc7c405d5 [0,2,0,0,0,0|1,0,0]=3 16598 B13R1.656 CCCCNc1nc(ccc1C)C ab878958ad1dd5af7a25d29fc6a8f8f9 [0,2,0,0,0,0|1,0,0]=3 16599 B13R1.656 CCCCNc1nc(ccc1C)Cl 045e50fd011ba6b378537dcafda590e9 [0,2,0,0,0,0|1,0,0]=3 16600 B13R1.656 CCCCNc1nc(ccc1Cl)Br 94a83c487b6b2712e80600028941bc20 [0,2,0,0,0,0|1,0,0]=3 16601 B13R1.656 CCCCNc1nc(ccc1Cl)Cl 970f80cf59c98b8aa896707437912669 [0,2,0,0,0,0|1,0,0]=3 16602 B13R1.656 CCCCNc1nc(ccc1F)Br 030af9189150628076644adcf8898dc3 [0,2,0,0,0,0|1,0,0]=3 16603 B13R1.656 CCCCNc1nc(ccc1F)C 98714d88b3072f8e0259dc2d0894328c [0,2,0,0,0,0|1,0,0]=3 16604 B13R1.656 CCCCNc1nc(ccc1F)Cl c2ff6c3a58181d3f535d8b8999b58e29 [0,2,0,0,0,0|1,0,0]=3 16605 B13R1.656 CCCCNc1nc(ccc1F)F cd576b88f5a2af8ff79935311fb0ff1d [0,2,0,0,0,0|1,0,0]=3 16606 B13R1.656 CCCCNc1nc(ccc1I)Br 9549e42ae20e36c02813f54fa9dd6a5b [0,2,0,0,0,0|1,0,0]=3 16607 B13R1.656 CCCCNc1nc(ccc1I)C 6ebfd9c22dbbd5a422e42278da0efdcd [0,2,0,0,0,0|1,0,0]=3 16608 B13R1.656 CCCCNc1nc(ccc1I)Cl c8b549313c6f986952f5e54cdf641dfc [0,2,0,0,0,0|1,0,0]=3 16609 B13R1.656 CCCCNc1nc(ccc1N)N 28fabbeace637f3f5d14044748a1f677 [0,2,0,0,0,0|1,0,0]=3 16610 B13R1.656 CCCCNc1nc(cnc1Br)Br d1f6b933c90aefcc2b76c2cef45ec729 [0,2,0,0,0,0|2,0,0]=4 16611 B13R1.656 CCCCNc1nc(cnc1Br)Cl 1cf3f36b205339a18365fae0be887db4 [0,2,0,0,0,0|2,0,0]=4 16612 B13R1.656 CCCCNc1nc(cnc1C)C 57a34adfbaa591fd58cc7b164b6c39c1 [0,2,0,0,0,0|2,0,0]=4 16613 B13R1.656 CCCCNc1nc(cnc1C)Cl 682d322819cd1b4650793f87aa2c1cb8 [0,2,0,0,0,0|2,0,0]=4 16614 B13R1.656 CCCCNc1nc(cnc1Cl)Br a373dc344cb6632a719d9139430ead9b [0,2,0,0,0,0|2,0,0]=4 16615 B13R1.656 CCCCNc1nc(cnc1Cl)C 7c464437aedd459dd0d20dfd8e0f9431 [0,2,0,0,0,0|2,0,0]=4 16616 B13R1.656 CCCCNc1nc(cnc1Cl)Cl c24f3ace934a433d0215bf7409428162 [0,2,0,0,0,0|2,0,0]=4 16617 B13R1.656 CCCCNc1nc(cnc1I)C 09af2647d4dfa636c9fce2c53f50a640 [0,2,0,0,0,0|2,0,0]=4 16618 B13R1.656 CCCCNc1nc(cnc1I)Cl 5604216f11d3e280104112e536a9bae9 [0,2,0,0,0,0|2,0,0]=4 16619 B13R1.656 CCCCNc1nc(cnc1S)Cl 72425b2bb2bce199b26101705d3705c0 [0,2,0,0,0,0|2,0,0]=4 16620 B13R1.656 CCCCNc1nc(ncc1Br)C ffdf39470e342eff3534c6d6a160b428 [0,2,0,0,0,0|2,0,0]=4 16621 B13R1.656 CCCCNc1nc(ncc1Br)Cl a17693a6aeda4f583ad1ff357cfaa952 [0,2,0,0,0,0|2,0,0]=4 16622 B13R1.656 CCCCNc1nc(ncc1C)Br 4de343750ff7231434923ef3a1cee173 [0,2,0,0,0,0|2,0,0]=4 16623 B13R1.656 CCCCNc1nc(ncc1C)C c4b3f82b075b0fdd64d263678d92f850 [0,2,0,0,0,0|2,0,0]=4 16624 B13R1.656 CCCCNc1nc(ncc1C)Cl aca4f647c45856c44dfabe01628ea6e4 [0,2,0,0,0,0|2,0,0]=4 16625 B13R1.656 CCCCNc1nc(ncc1Cl)C a2fa892e35837d07bbc3e3529197040e [0,2,0,0,0,0|2,0,0]=4 16626 B13R1.656 CCCCNc1nc(ncc1Cl)Cl e0b7ae11b2b54339b090dee4c9ec1fa6 [0,2,0,0,0,0|2,0,0]=4 16627 B13R1.656 CCCCNc1nc(ncc1F)C e35dcb5a2ed0c8b8865a99ff6a1277b6 [0,2,0,0,0,0|2,0,0]=4 16628 B13R1.656 CCCCNc1nc(ncc1F)Cl d11d66f392076ebfdd76c034036a4989 [0,2,0,0,0,0|2,0,0]=4 16629 B13R1.656 CCCCNc1nc(ncc1I)Cl dd9d86abd3be488ee8536b8fb4f057b3 [0,2,0,0,0,0|2,0,0]=4 16630 B13R1.656 CCCCOc1cc(ccc1Br)Cl 45f09be276693f4fba294670484ba28d [0,2,0,0,0,0|2,0,0]=4 16631 B13R1.656 CCCCOc1cc(ccc1Br)F 7de8f01fabebc63d2cb966d101834d5e [0,2,0,0,0,0|2,0,0]=4 16632 B13R1.656 CCCCOc1cc(ccc1Br)I a92d1dc6fd2baef376e2d14c19ad8d63 [0,2,0,0,0,0|2,0,0]=4 16633 B13R1.656 CCCCOc1cc(ccc1C)Br b18faff1a535047774ca3d20794c5aaa [0,2,0,0,0,0|2,0,0]=4 16634 B13R1.656 CCCCOc1cc(ccc1C)C 0e851e4a29e34a242f00c81cbd4cf05a [0,2,0,0,0,0|2,0,0]=4 16635 B13R1.656 CCCCOc1cc(ccc1C)Cl 35fc40ac32794e16be4a83dfdc0ab3fe [0,2,0,0,0,0|2,0,0]=4 16636 B13R1.656 CCCCOc1cc(ccc1C)F 4c215112c4409dd0882704807389f29b [0,2,0,0,0,0|2,0,0]=4 16637 B13R1.656 CCCCOc1cc(ccc1C)I 5d42a751c66f7e7e14574d934209960e [0,2,0,0,0,0|2,0,0]=4 16638 B13R1.656 CCCCOc1cc(ccc1Cl)Br 26531166c570e1197c0b0bc744946c7c [0,2,0,0,0,0|2,0,0]=4 16639 B13R1.656 CCCCOc1cc(ccc1Cl)C a52ccd61f7dc468c8eb2e9ade5a3bd3d [0,2,0,0,0,0|2,0,0]=4 16640 B13R1.656 CCCCOc1cc(ccc1Cl)Cl 44db7a3a8a63688bae0f4eebc447223c [0,2,0,0,0,0|2,0,0]=4 16641 B13R1.656 CCCCOc1cc(ccc1Cl)F febde6b97668599fcfb610c076d58b44 [0,2,0,0,0,0|2,0,0]=4 16642 B13R1.656 CCCCOc1cc(ccc1Cl)I f2b5da7a22b36fcc8671de42df39bde6 [0,2,0,0,0,0|2,0,0]=4 16643 B13R1.656 CCCCOc1cc(ccc1F)Br 70ace628ec53d3eba0392ae5748fcba7 [0,2,0,0,0,0|2,0,0]=4 16644 B13R1.656 CCCCOc1cc(ccc1F)C e5b8567000735b7c17091b977e1f79da [0,2,0,0,0,0|2,0,0]=4 16645 B13R1.656 CCCCOc1cc(ccc1F)Cl 9361f3deb79c968284d0765e901ce74e [0,2,0,0,0,0|2,0,0]=4 16646 B13R1.656 CCCCOc1cc(ccc1F)F c8a0579f539d6312926213b99d2df8d2 [0,2,0,0,0,0|2,0,0]=4 16647 B13R1.656 CCCCOc1cc(ccc1F)I d4b98eca252b7c1d4f80b2b99cdab612 [0,2,0,0,0,0|2,0,0]=4 16648 B13R1.656 CCCCOc1cc(ccc1I)Br d5114e90a85aed4968600c25f9085828 [0,2,0,0,0,0|2,0,0]=4 16649 B13R1.656 CCCCOc1cc(ccc1I)C c0ca059dacf0958093699db266526fa8 [0,2,0,0,0,0|2,0,0]=4 16650 B13R1.656 CCCCOc1cc(ccc1I)Cl 39ade1f72967e0b9062b29cb951ba8a5 [0,2,0,0,0,0|2,0,0]=4 16651 B13R1.656 CCCCOc1cc(ccc1I)F 7c80381fbc0e46781d4ffc7927d0ad62 [0,2,0,0,0,0|2,0,0]=4 16652 B13R1.656 CCCCOc1nc(ccc1Br)Br d36deb2f2dd69eed79f9c029ebcb9d18 [0,2,0,0,0,0|1,0,0]=3 16653 B13R1.656 CCCCOc1nc(ccc1Br)C 0e96e68ec53192f5e52111c067c6780c [0,2,0,0,0,0|1,0,0]=3 16654 B13R1.656 CCCCOc1nc(ccc1Cl)Br d078520c7e3ad0b9e242b762a0489204 [0,2,0,0,0,0|1,0,0]=3 16655 B13R1.656 CCCCOc1nc(ccc1Cl)Cl 6960538d0ad10b16e5c143be2c21f261 [0,2,0,0,0,0|1,0,0]=3 16656 B13R1.656 CCCCOc1nc(ccc1F)Cl f0fd3f45bc35ebca806750e34b11d9f8 [0,2,0,0,0,0|1,0,0]=3 16657 B13R1.656 CCCCOc1nc(ccc1I)Br 14ac240e56288a77d9b26f04378c403b [0,2,0,0,0,0|1,0,0]=3 16658 B13R1.656 CCCCOc1nc(ccc1I)C 5da5d075765da579fdacaf22bc74849b [0,2,0,0,0,0|1,0,0]=3 16659 B13R1.656 CCCCOc1nc(ccc1I)Cl 2544757c9d1b9911ce3afb3e9d0b78b8 [0,2,0,0,0,0|1,0,0]=3 16660 B13R1.656 CCCCOc1nc(ncc1Br)C 01ba7c9fa63380a45fe27a2371e7523b [0,2,0,0,0,0|2,0,0]=4 16661 B13R1.656 CCCCOc1nc(ncc1Br)Cl 0ee50e5da03607159b357bef13750a92 [0,2,0,0,0,0|2,0,0]=4 16662 B13R1.656 CCCCOc1nc(ncc1C)C 9afaa185bf89dbf943508f647265d65f [0,2,0,0,0,0|2,0,0]=4 16663 B13R1.656 CCCCOc1nc(ncc1C)Cl 59bd93de00b121167ec4eb7af53f0d91 [0,2,0,0,0,0|2,0,0]=4 16664 B13R1.656 CCCCOc1nc(ncc1Cl)Cl f06df90f9e0d68fc798ee58554cb881e [0,2,0,0,0,0|2,0,0]=4 16665 B13R1.656 CCCCOc1nc(ncc1F)C c43d087b3a52c1c5647630c6f88fd4ee [0,2,0,0,0,0|2,0,0]=4 16666 B13R1.656 CCCCOc1nc(ncc1I)C 9e613b14a133e7278590abffdef1c3de [0,2,0,0,0,0|2,0,0]=4 16667 B13R1.656 CCCNCc1cc(ccc1Br)Cl 3bcbae688485f4c522d3e326bc64e915 [0,2,0,0,0,0|2,0,0]=4 16668 B13R1.656 CCCNCc1cc(ccc1Br)F 39ab56752c83db3a156f43a27d292d06 [0,2,0,0,0,0|2,0,0]=4 16669 B13R1.656 CCCNCc1cc(ccc1Br)I 629f3a8ddb618f208ed55b84c703edf3 [0,2,0,0,0,0|2,0,0]=4 16670 B13R1.656 CCCNCc1cc(ccc1C)C b17c2c74679d114072aee7dda7af1fef [0,2,0,0,0,0|2,0,0]=4 16671 B13R1.656 CCCNCc1cc(ccc1C)Cl 75cc4e2e67f37036fa6d176f68c55d78 [0,2,0,0,0,0|2,0,0]=4 16672 B13R1.656 CCCNCc1cc(ccc1C)F 50ab2b18fdfcff31182b17bf5107ee95 [0,2,0,0,0,0|2,0,0]=4 16673 B13R1.656 CCCNCc1cc(ccc1C)I 79421dcd33e0dd92c8f91852e2677197 [0,2,0,0,0,0|2,0,0]=4 16674 B13R1.656 CCCNCc1cc(ccc1Cl)Br 823273b94ccac5aa520cde14499e202a [0,2,0,0,0,0|2,0,0]=4 16675 B13R1.656 CCCNCc1cc(ccc1Cl)C d9db2c442f76475a3d8c0298d18d6a81 [0,2,0,0,0,0|2,0,0]=4 16676 B13R1.656 CCCNCc1cc(ccc1Cl)Cl 6dbe69df655f37b7d36939ec6cfb476b [0,2,0,0,0,0|2,0,0]=4 16677 B13R1.656 CCCNCc1cc(ccc1Cl)F a0e0bb927f4437a614b62b413a002b1e [0,2,0,0,0,0|2,0,0]=4 16678 B13R1.656 CCCNCc1cc(ccc1Cl)I 4e74407b7663bf1731d5ca4ccbcdeae3 [0,2,0,0,0,0|2,0,0]=4 16679 B13R1.656 CCCNCc1cc(ccc1F)Br 1333a1787dd3eed927e848f94d2ddac9 [0,2,0,0,0,0|2,0,0]=4 16680 B13R1.656 CCCNCc1cc(ccc1F)C 83a5488fb96c20bb1015840ccfd58a63 [0,2,0,0,0,0|2,0,0]=4 16681 B13R1.656 CCCNCc1cc(ccc1F)Cl 13e0abe5470da63873bb3c7ecb7f04f5 [0,2,0,0,0,0|2,0,0]=4 16682 B13R1.656 CCCNCc1cc(ccc1F)F 57a5f102c7ac673947cf4f13a862e89b [0,2,0,0,0,0|2,0,0]=4 16683 B13R1.656 CCCNCc1cc(ccc1F)I 6168d37216f9b8500e4a39b194500e20 [0,2,0,0,0,0|2,0,0]=4 16684 B13R1.656 CCCNCc1cc(ccc1I)Br afaa373a7a1c5abd759246e4f29ad8fd [0,2,0,0,0,0|2,0,0]=4 16685 B13R1.656 CCCNCc1cc(ccc1I)C 5266b8ae8f11fac2312e14d089138b09 [0,2,0,0,0,0|2,0,0]=4 16686 B13R1.656 CCCNCc1cc(ccc1I)Cl da3c7fd679f591ce56e48409c770ab15 [0,2,0,0,0,0|2,0,0]=4 16687 B13R1.656 CCCNCc1cc(ccc1I)F 9dc590847e1b800e36d9c37c0d495c7e [0,2,0,0,0,0|2,0,0]=4 16688 B13R1.656 CCCNCc1nc(ccc1Br)Br 3c775bd1a88b0c82bddc97be88bbbdd7 [0,2,0,0,0,0|1,0,0]=3 16689 B13R1.656 CCCNCc1nc(ccc1Br)Cl b2ea9f6e7d162cddc240ff2edcd7b6c1 [0,2,0,0,0,0|1,0,0]=3 16690 B13R1.656 CCCNCc1nc(ccc1Br)F 384dce8a38c68f9afc6e9b1412e6d2b1 [0,2,0,0,0,0|1,0,0]=3 16691 B13R1.656 CCCNCc1nc(ccc1F)Br a390f8e043074c6c8ee33de7faf710a6 [0,2,0,0,0,0|1,0,0]=3 16692 B13R1.656 CCCNCc1nc(ccc1F)Cl 5af01e95d5f31e7c3edba512df28c285 [0,2,0,0,0,0|1,0,0]=3 16693 B13R1.656 CCCOCC1=CC(=O)C=CC1=O d4413647c51d53d7698156bbe88c24ef [0,2,0,0,0,0|2,0,0]=4 16694 B13R1.656 CCCOCc1cc(ccc1Br)Cl 38a29218c6de3a7d850d91695bffa66b [0,2,0,0,0,0|2,0,0]=4 16695 B13R1.656 CCCOCc1cc(ccc1Br)F 4904886b79cf7b5a1abeed29a903b64d [0,2,0,0,0,0|2,0,0]=4 16696 B13R1.656 CCCOCc1cc(ccc1Br)I 28fd00f372a21fbe4ad06a3143e48c69 [0,2,0,0,0,0|2,0,0]=4 16697 B13R1.656 CCCOCc1cc(ccc1C)C 4d8e2954b005526e4250414c01d6e4a8 [0,2,0,0,0,0|2,0,0]=4 16698 B13R1.656 CCCOCc1cc(ccc1C)Cl ef8957b320dcebdfc7d0c1238457a0fd [0,2,0,0,0,0|2,0,0]=4 16699 B13R1.656 CCCOCc1cc(ccc1C)F ec071452121e6b0d7d801b3770cde41c [0,2,0,0,0,0|2,0,0]=4 16700 B13R1.656 CCCOCc1cc(ccc1C)I d23df2491505cc89b8ea68b6754f1f57 [0,2,0,0,0,0|2,0,0]=4 16701 B13R1.656 CCCOCc1cc(ccc1Cl)Br 901b676fa216c9da1a6daee24dfc898c [0,2,0,0,0,0|2,0,0]=4 16702 B13R1.656 CCCOCc1cc(ccc1Cl)C 464095003b3ff59049d8d53eb6979b70 [0,2,0,0,0,0|2,0,0]=4 16703 B13R1.656 CCCOCc1cc(ccc1Cl)Cl 669a80cd698ba440ca85a9e476b59835 [0,2,0,0,0,0|2,0,0]=4 16704 B13R1.656 CCCOCc1cc(ccc1Cl)F ed046f484603ed560f75a6f5c825b156 [0,2,0,0,0,0|2,0,0]=4 16705 B13R1.656 CCCOCc1cc(ccc1Cl)I 8719be0c3488372833ac23c5d36bfec1 [0,2,0,0,0,0|2,0,0]=4 16706 B13R1.656 CCCOCc1cc(ccc1F)Br c8eafb67c75d7f9f84fedffa7dfc38b6 [0,2,0,0,0,0|2,0,0]=4 16707 B13R1.656 CCCOCc1cc(ccc1F)C d616bd99806f0550d6a4f7e53d750b17 [0,2,0,0,0,0|2,0,0]=4 16708 B13R1.656 CCCOCc1cc(ccc1F)Cl 2652bac7318d338dd6873df98ff00bce [0,2,0,0,0,0|2,0,0]=4 16709 B13R1.656 CCCOCc1cc(ccc1F)F 6c4687d82c3b0fe81f4b9c431dd7a2ae [0,2,0,0,0,0|2,0,0]=4 16710 B13R1.656 CCCOCc1cc(ccc1F)I fb2cd1f723f895f603d7655a1b3dd02b [0,2,0,0,0,0|2,0,0]=4 16711 B13R1.656 CCCOCc1cc(ccc1I)Br d8b9397abafebe5416c945813ee3b23d [0,2,0,0,0,0|2,0,0]=4 16712 B13R1.656 CCCOCc1cc(ccc1I)C 7ccf58284a85c39a5b81e494e5bc7a98 [0,2,0,0,0,0|2,0,0]=4 16713 B13R1.656 CCCOCc1cc(ccc1I)Cl cc53fc8013649603d80f46e2555fd127 [0,2,0,0,0,0|2,0,0]=4 16714 B13R1.656 CCCOCc1cc(ccc1I)F 4ca654d6181a8b02364bf69eec512beb [0,2,0,0,0,0|2,0,0]=4 16715 B13R1.656 CCCOCc1nc(ccc1Br)Br 02f58d7e42aad8e99734b7467ca1a5db [0,2,0,0,0,0|1,0,0]=3 16716 B13R1.656 CCCOCc1nc(ccc1Br)F 98d28daf87649f23f79d66c60f8fdec9 [0,2,0,0,0,0|1,0,0]=3 16717 B13R1.656 CCCOCc1nc(ccc1C)C b988d7f5d59f130096f9ecede0abcd9c [0,2,0,0,0,0|1,0,0]=3 16718 B13R1.656 CCCOCc1nc(ccc1Cl)Br f745fe52c3000b6e3bdc3cb725f41a4e [0,2,0,0,0,0|1,0,0]=3 16719 B13R1.656 CCCOCc1nc(ccc1Cl)Cl aa5593c374a0a2e389de98b619d2a351 [0,2,0,0,0,0|1,0,0]=3 16720 B13R1.656 CCCOCc1nc(ccc1F)Br c798e57663f86508e304e71c4314a7fc [0,2,0,0,0,0|1,0,0]=3 16721 B13R1.656 CCCOCc1nc(ccc1F)Cl f3a3818534281ef2573aebdf426ab51b [0,2,0,0,0,0|1,0,0]=3 16722 B13R1.656 CCCOCc1nc(ncc1F)Cl 93989d5ebd2e21681b1b0b6a4335cac9 [0,2,0,0,0,0|2,0,0]=4 16723 B13R1.656 CCNCCc1cc(ccc1Cl)Cl db3d88767632c941d2734aef5a11932f [0,2,0,0,0,0|2,0,0]=4 16724 B13R1.656 CCNCCc1cc(ccc1F)Cl dcc972fdd099c8c46894d3ed7b48315e [0,2,0,0,0,0|2,0,0]=4 16725 B13R1.656 CCOCCc1cc(ccc1C)C a63a7ca1fd9f5ce11bb26ee7dedc228e [0,2,0,0,0,0|2,0,0]=4 16726 B13R1.656 CCOCCc1cc(ccc1Cl)Cl ad8ba7b1eb4d253470d19682ffba3bab [0,2,0,0,0,0|2,0,0]=4 16727 B13R1.656 CCOCCc1cc(ccc1F)Br 9453fe5f4bf59c46a9b9accc0a6917b0 [0,2,0,0,0,0|2,0,0]=4 16728 B13R1.656 CCOCCc1cc(ccc1F)F 91d5e721296c94b2179b3e6cf9584ef7 [0,2,0,0,0,0|2,0,0]=4 16729 B13R1.656 CCOCNc1nc(ccc1C)Br 9a12a85dee1eab3c102a664e7e89ae1e [0,2,0,0,0,0|2,0,0]=4 16730 B13R1.656 CCOCNc1nc(ccc1C)C e5c70b19eaf619d1196ea37810795d02 [0,2,0,0,0,0|2,0,0]=4 16731 B13R1.656 CCOCNc1nc(ccc1Cl)Br 73b35e747868489e3797763a526cb246 [0,2,0,0,0,0|2,0,0]=4 16732 B13R1.656 CCOCNc1nc(ccc1I)Br c181a4cb439dbf8a07680bc4b268a922 [0,2,0,0,0,0|2,0,0]=4 16733 B13R1.656 CCOCNc1nc(ccc1I)C 48d5e62947ae918e83a3380a79124d12 [0,2,0,0,0,0|2,0,0]=4 16734 B13R1.656 CCOCOc1nc(ccc1Br)C 299b9be315d23bd803406023766c549a [0,2,0,0,0,0|2,0,0]=4 16735 B13R1.656 CCOCOc1nc(ccc1F)Cl d1ad35fcf9277a530dc9e52706cda24d [0,2,0,0,0,0|2,0,0]=4 16736 B13R1.656 CCOCOc1nc(ccc1I)Br aa5d87a80df77b018fab305861a95b51 [0,2,0,0,0,0|2,0,0]=4 16737 B13R1.656 CCOCOc1nc(ccc1I)C 1a26c2d89369a0e3b46aa690b6dcd8f9 [0,2,0,0,0,0|2,0,0]=4 16738 B13R1.656 COCCNc1nc(ccc1Br)Br a27f3a9ad93c5ace7c7cc2f276443496 [0,2,0,0,0,0|2,0,0]=4 16739 B13R1.656 COCCNc1nc(ccc1Br)C 42be2dbeffd5e27be64e08154da9e03f [0,2,0,0,0,0|2,0,0]=4 16740 B13R1.656 COCCNc1nc(ccc1Br)Cl d2842204f0fb1b6d40f69cf515e379b2 [0,2,0,0,0,0|2,0,0]=4 16741 B13R1.656 COCCNc1nc(ccc1Br)F 6287a2fe2bff622204c2018079318e91 [0,2,0,0,0,0|2,0,0]=4 16742 B13R1.656 COCCNc1nc(ccc1Br)I 68686573a929f3e14529205ec9be3ada [0,2,0,0,0,0|2,0,0]=4 16743 B13R1.656 COCCNc1nc(ccc1C)Br afa680254cafa31ebb27e24a58074514 [0,2,0,0,0,0|2,0,0]=4 16744 B13R1.656 COCCNc1nc(ccc1C)C 4befcb1b3899b64c1c4c4441e1053b38 [0,2,0,0,0,0|2,0,0]=4 16745 B13R1.656 COCCNc1nc(ccc1C)Cl d678ad4823c3c280508341ccc81fc415 [0,2,0,0,0,0|2,0,0]=4 16746 B13R1.656 COCCNc1nc(ccc1C)F 3de647dce60e23863ab05f3070d97888 [0,2,0,0,0,0|2,0,0]=4 16747 B13R1.656 COCCNc1nc(ccc1Cl)Br f6b3edda00edd229ebcad2f45bf80e4b [0,2,0,0,0,0|2,0,0]=4 16748 B13R1.656 COCCNc1nc(ccc1Cl)Cl cb5093e6c0fe765af85bedbd26bb5543 [0,2,0,0,0,0|2,0,0]=4 16749 B13R1.656 COCCNc1nc(ccc1F)Br af428536e9afc1c7fe7e6c8afbb9b94e [0,2,0,0,0,0|2,0,0]=4 16750 B13R1.656 COCCNc1nc(ccc1F)C 399e5d254dcc20b396fb6ae5014d3709 [0,2,0,0,0,0|2,0,0]=4 16751 B13R1.656 COCCNc1nc(ccc1F)Cl 33525047c1c7979655ffbf3e8041e6cc [0,2,0,0,0,0|2,0,0]=4 16752 B13R1.656 COCCNc1nc(ccc1F)F b9681a273237426a6504e4579a23aa3c [0,2,0,0,0,0|2,0,0]=4 16753 B13R1.656 COCCNc1nc(ccc1I)Br e3a00e69ca0485940bc6a1cade065e40 [0,2,0,0,0,0|2,0,0]=4 16754 B13R1.656 COCCNc1nc(ccc1I)C 5dea7ee00c5f75cd401f9ef5da56444d [0,2,0,0,0,0|2,0,0]=4 16755 B13R1.656 COCCNc1nc(ccc1I)Cl 19ef00f783137b9905d96618e4a1111b [0,2,0,0,0,0|2,0,0]=4 16756 B13R1.656 COCCNc1nc(ccc1N)N b1f0d3b68a8bd1caf372eca693f2b5d8 [0,2,0,0,0,0|2,0,0]=4 16757 B13R1.656 COCCOc1nc(ccc1Br)Br aaad6001af6f5af9a5ed66f6dc3deac8 [0,2,0,0,0,0|2,0,0]=4 16758 B13R1.656 COCCOc1nc(ccc1Br)C c7f920ca8ddcb7eed2dc5839af404e7c [0,2,0,0,0,0|2,0,0]=4 16759 B13R1.656 COCCOc1nc(ccc1Br)Cl 2e39c364d0b7e5c188cb405e85a1b9ea [0,2,0,0,0,0|2,0,0]=4 16760 B13R1.656 COCCOc1nc(ccc1Cl)Br 86b0139d1b6a093dfadbea4d33c26433 [0,2,0,0,0,0|2,0,0]=4 16761 B13R1.656 COCCOc1nc(ccc1Cl)Cl 22578e3b10ebebe5fc1af5b76d5b5b4e [0,2,0,0,0,0|2,0,0]=4 16762 B13R1.656 COCCOc1nc(ccc1F)Cl 745865c4b377220af67b43d498eaf730 [0,2,0,0,0,0|2,0,0]=4 16763 B13R1.656 COCCOc1nc(ccc1I)Br eecfe20eb7395f4fbf4733a26de1a9b3 [0,2,0,0,0,0|2,0,0]=4 16764 B13R1.656 COCCOc1nc(ccc1I)C 790b999bc7a9085a95ff0ba56da139f5 [0,2,0,0,0,0|2,0,0]=4 16765 B13R1.656 COCCOc1nc(ccc1I)Cl e129b496b654778b3671e8fc17786acd [0,2,0,0,0,0|2,0,0]=4 16766 B13R1.656 COCNCc1nc(ccc1Br)Cl 7c8eb3257302621bbdfc0748da69230c [0,2,0,0,0,0|2,0,0]=4 16767 B13R1.656 COCNCc1nc(ccc1F)Cl 1f4f9c7ccb33d859be2c43763ddced67 [0,2,0,0,0,0|2,0,0]=4 16768 B13R1.656 COCOCc1nc(ccc1Br)Br 6ea031a083cc9e932d297908a1b32e2b [0,2,0,0,0,0|2,0,0]=4 16769 B13R1.656 COCOCc1nc(ccc1Br)C dc7ee5c2f1683f86d7ad5202e82fb9df [0,2,0,0,0,0|2,0,0]=4 16770 B13R1.656 COCOCc1nc(ccc1Br)F 0af5f17444271ab6e5465c4f7b5e1d1f [0,2,0,0,0,0|2,0,0]=4 16771 B13R1.656 COCOCc1nc(ccc1C)C 13ef3738056a782fa782b87282af83a0 [0,2,0,0,0,0|2,0,0]=4 16772 B13R1.656 COCOCc1nc(ccc1Cl)Br 7ba02e9fd8aa36a42afcec3f8595cb61 [0,2,0,0,0,0|2,0,0]=4 16773 B13R1.656 COCOCc1nc(ccc1Cl)Cl 0c167fdb79d57f9a9e60f233ffe38f49 [0,2,0,0,0,0|2,0,0]=4 16774 B13R1.656 COCOCc1nc(ccc1F)Br 03b8bdbd75f94f6f13be2665b7e41aeb [0,2,0,0,0,0|2,0,0]=4 16775 B13R1.656 COCOCc1nc(ccc1F)Cl 461d49457fbaef4658d0ea6b2eef4b1d [0,2,0,0,0,0|2,0,0]=4 16776 B13R1.656 CSCCNc1nc(ccc1Br)Br 366e835b3692ab84ac6631b7a96e720c [0,2,0,0,0,0|2,0,0]=4 16777 B13R1.656 CSCCNc1nc(ccc1Br)C 11af358305bf6ec1e9cd2fe0e1367f55 [0,2,0,0,0,0|2,0,0]=4 16778 B13R1.656 CSCCNc1nc(ccc1Br)Cl c03fd3977e2f66dc9b789cd936b844fe [0,2,0,0,0,0|2,0,0]=4 16779 B13R1.656 CSCCNc1nc(ccc1Br)F b058398b58ecb1645af637b62d187ac2 [0,2,0,0,0,0|2,0,0]=4 16780 B13R1.656 CSCCNc1nc(ccc1Br)I 767c1a0d44b5274fe52f435066c8be9c [0,2,0,0,0,0|2,0,0]=4 16781 B13R1.656 CSCCNc1nc(ccc1C)Br f119e3171d972333cdfae37a305ee2b7 [0,2,0,0,0,0|2,0,0]=4 16782 B13R1.656 CSCCNc1nc(ccc1C)C 7e74ad2f9efef05cb78ac217b08b2109 [0,2,0,0,0,0|2,0,0]=4 16783 B13R1.656 CSCCNc1nc(ccc1C)Cl 4dac5090d7b919593f1ed6a049917e90 [0,2,0,0,0,0|2,0,0]=4 16784 B13R1.656 CSCCNc1nc(ccc1Cl)Br fe3ef07d8039376491446703dc33e12d [0,2,0,0,0,0|2,0,0]=4 16785 B13R1.656 CSCCNc1nc(ccc1Cl)Cl 8ca5a1207a6d960c1d1d40aa1b54bf22 [0,2,0,0,0,0|2,0,0]=4 16786 B13R1.656 CSCCNc1nc(ccc1F)Br 64fb0f18078285a735b298941c2356a8 [0,2,0,0,0,0|2,0,0]=4 16787 B13R1.656 CSCCNc1nc(ccc1F)C 1b77d4cb8ae3df1ffff30f8af8794e22 [0,2,0,0,0,0|2,0,0]=4 16788 B13R1.656 CSCCNc1nc(ccc1F)Cl f78fbe49c1c20cf5644aa6a07fd3060a [0,2,0,0,0,0|2,0,0]=4 16789 B13R1.656 CSCCNc1nc(ccc1F)F bf4867a889ed127154fbe44bb6315633 [0,2,0,0,0,0|2,0,0]=4 16790 B13R1.656 CSCCNc1nc(ccc1I)Br d7be646eb1ee81cf70a1f47a38f54973 [0,2,0,0,0,0|2,0,0]=4 16791 B13R1.656 CSCCNc1nc(ccc1I)C 7c37d247c3237a2c3a7050be7838721f [0,2,0,0,0,0|2,0,0]=4 16792 B13R1.656 CSCCNc1nc(ccc1I)Cl 9645fc618a25de1514f31bb13dcc8002 [0,2,0,0,0,0|2,0,0]=4 16793 B13R1.656 CSCCNc1nc(ccc1N)N 4c222b124b8f6c522e5db677f0a09dd8 [0,2,0,0,0,0|2,0,0]=4 16794 B13R1.656 CSCCOc1nc(ccc1Br)Br 6471a7448730605784f68a98ef93187f [0,2,0,0,0,0|2,0,0]=4 16795 B13R1.656 CSCCOc1nc(ccc1Br)C e8e82b8a9bda2872d5b9213cd7d75b9a [0,2,0,0,0,0|2,0,0]=4 16796 B13R1.656 CSCCOc1nc(ccc1Br)Cl 5aeae49365e9c5fa865a12e8ff3ac78d [0,2,0,0,0,0|2,0,0]=4 16797 B13R1.656 CSCCOc1nc(ccc1Cl)Br 27180418a15c51f2ebe8f54c3209261a [0,2,0,0,0,0|2,0,0]=4 16798 B13R1.656 CSCCOc1nc(ccc1Cl)Cl 57a3a4b90a6449664b85b0811a206181 [0,2,0,0,0,0|2,0,0]=4 16799 B13R1.656 CSCCOc1nc(ccc1F)Cl d1bf54875872f7ee33b958d2e93e8603 [0,2,0,0,0,0|2,0,0]=4 16800 B13R1.656 CSCCOc1nc(ccc1I)Br ce8f59a1459a5b21272a0231d491dd01 [0,2,0,0,0,0|2,0,0]=4 16801 B13R1.656 CSCCOc1nc(ccc1I)C 99bdd9c8c09ab608e0380a7c28a952bb [0,2,0,0,0,0|2,0,0]=4 16802 B13R1.656 CSCCOc1nc(ccc1I)Cl 4e7e60c2ec19cfc01c569e93d3c58c59 [0,2,0,0,0,0|2,0,0]=4 16803 B13R1.656 CSCNCc1nc(ccc1F)Cl c67ab0c9bc84a1a77c7a07ed3dd37b09 [0,2,0,0,0,0|2,0,0]=4 16804 B13R1.656 CSCOCc1nc(ccc1Br)F 13d942e96a6a3410fb9c971c712c4a69 [0,2,0,0,0,0|2,0,0]=4 16805 B13R1.656 CSCOCc1nc(ccc1C)C 1eefeda39a3fa7918b8eec0ad82c30be [0,2,0,0,0,0|2,0,0]=4 16806 B13R1.656 CSCOCc1nc(ccc1Cl)Br 6364c7426ae610d5c0246d546080a02f [0,2,0,0,0,0|2,0,0]=4 16807 B13R1.656 CSCOCc1nc(ccc1Cl)Cl 4f4e268b96f851e877f135b581128cdf [0,2,0,0,0,0|2,0,0]=4 16808 B13R1.656 CSCOCc1nc(ccc1F)Br 058886908876404294bc007230d00ee1 [0,2,0,0,0,0|2,0,0]=4 16809 B13R1.656 CSCOCc1nc(ccc1F)Cl 6a628de43f84ca8c5580d7be4984feba [0,2,0,0,0,0|2,0,0]=4 16810 B13R1.656 Cc1ccc(c(n1)CNCCBr)Cl afc168d00f4ea598ab45c8718b93ed32 [0,2,0,0,0,0|2,0,0]=4 16811 B13R1.656 Cc1ccc(c(n1)CNCCF)Cl 89c5fe98e2a4f42296c8ab21fa599a6d [0,2,0,0,0,0|2,0,0]=4 16812 B13R1.656 Cc1ccc(c(n1)COCCF)Br 648c69ea1e42cad0e4f56d93da60e43c [0,2,0,0,0,0|2,0,0]=4 16813 B13R1.656 Cc1ccc(c(n1)COCCF)C 1395d3530bad19ec001b4ae9adb23a6a [0,2,0,0,0,0|2,0,0]=4 16814 B13R1.656 Cc1ccc(c(n1)COCCS)Br 05ddd8e17cb2169905c9891f2d18efb7 [0,2,0,0,0,0|2,0,0]=4 16815 B13R1.656 Cc1ccc(c(n1)COCCS)C f2f1f3de6060b4b9402c5a2a5fc5308f [0,2,0,0,0,0|2,0,0]=4 16816 B13R1.656 Cc1ccc(c(n1)NCCCCl)C 70858ff37d47082d2b7e3e4ca7155580 [0,2,0,0,0,0|2,0,0]=4 16817 B13R1.656 Cc1ccc(c(n1)NCCCCl)F 95c8917f71907478b8fe429b26f4d34c [0,2,0,0,0,0|2,0,0]=4 16818 B13R1.656 Cc1ccc(c(n1)NCCCF)Br 3c59e7476e2966709af8b12d5e6d93ca [0,2,0,0,0,0|2,0,0]=4 16819 B13R1.656 Cc1ccc(c(n1)NCCCF)C 401cb7d49801fb5342a4da234f39ceba [0,2,0,0,0,0|2,0,0]=4 16820 B13R1.656 Cc1ccc(c(n1)NCCCF)F 375ca1c586556880bba2a34fa6e63215 [0,2,0,0,0,0|2,0,0]=4 16821 B13R1.656 Cc1ccc(c(n1)NCCCF)I 66a17b84686400bf7200532de93f0887 [0,2,0,0,0,0|2,0,0]=4 16822 B13R1.656 Cc1ccc(c(n1)NCCCO)C 1dde9fea0e73e9f7770b56d6f56c8146 [0,2,0,0,0,0|2,0,0]=4 16823 B13R1.656 Cc1ccc(c(n1)NCCCO)F 524c10c689495125e2c4fa84279c1ab7 [0,2,0,0,0,0|2,0,0]=4 16824 B13R1.656 Cc1ccc(c(n1)NCCCO)I e60a25d3d7f57ed8048e1639a947e44f [0,2,0,0,0,0|2,0,0]=4 16825 B13R1.656 Cc1ccc(c(n1)NCCCS)Br 4682139dd095ee774ac0acdb683e61ca [0,2,0,0,0,0|2,0,0]=4 16826 B13R1.656 Cc1ccc(c(n1)NCCCS)C 451c3bdc5ca9ba073836cb3aa9ba125e [0,2,0,0,0,0|2,0,0]=4 16827 B13R1.656 Cc1ccc(c(n1)NCCCS)F 920f5455480cfe977c81b9bec505f2db [0,2,0,0,0,0|2,0,0]=4 16828 B13R1.656 Cc1ccc(c(n1)NCCCS)I 583f432eec631cafe70d1e456f886e33 [0,2,0,0,0,0|2,0,0]=4 16829 B13R1.656 Cc1ccc(c(n1)OCCCF)Br abfb8319a839f40a13806d2b622e2577 [0,2,0,0,0,0|2,0,0]=4 16830 B13R1.656 Cc1ccc(c(n1)OCCCF)I ff38878cc4882847b6f8a1a202dd22c9 [0,2,0,0,0,0|2,0,0]=4 16831 B13R1.656 Cc1ccc(c(n1)OCCCS)Br ff28d6764b0fe502bf70888d127b8fca [0,2,0,0,0,0|2,0,0]=4 16832 B13R1.656 Cc1ccc(c(n1)OCCCS)I 96d6a0b12f4150369e0289bcb6b43f9b [0,2,0,0,0,0|2,0,0]=4 16833 B13R1.656 Cc1ccc(nc1NCCCF)Br 560f9d5c8ac1eadd57df3a0ff3783c00 [0,2,0,0,0,0|2,0,0]=4 16834 B13R1.656 Cc1ccc(nc1NCCCF)Cl 55d46a96ee44e02517d5ac6b0b932a01 [0,2,0,0,0,0|2,0,0]=4 16835 B13R1.656 Cc1ccc(nc1NCCCO)Br 6356c0ec23f8054f74a2da77c571d086 [0,2,0,0,0,0|2,0,0]=4 16836 B13R1.656 Cc1ccc(nc1NCCCO)Cl 6e29a8c38413c1625e23048c860f21c2 [0,2,0,0,0,0|2,0,0]=4 16837 B13R1.656 Cc1ccc(nc1NCCCS)Br 7fada6339c99d8b1ff5d0643a0ac61f4 [0,2,0,0,0,0|2,0,0]=4 16838 B13R1.656 Cc1ccc(nc1NCCCS)Cl be2cb1949d18d704ba40ecf99de425af [0,2,0,0,0,0|2,0,0]=4 16839 B13R1.656 FCCCNc1nc(ccc1Br)Br 62a32175e095552d33e5563a3b039a72 [0,2,0,0,0,0|2,0,0]=4 16840 B13R1.656 FCCCNc1nc(ccc1Br)Cl 83ab72fa267a8b52e84dc32737e47ff6 [0,2,0,0,0,0|2,0,0]=4 16841 B13R1.656 FCCCNc1nc(ccc1Br)F 1b4ac076f4bd0a034604ab17aff92fdc [0,2,0,0,0,0|2,0,0]=4 16842 B13R1.656 FCCCNc1nc(ccc1Br)I f214ce9c78e1dfea562dba6b5e8687c6 [0,2,0,0,0,0|2,0,0]=4 16843 B13R1.656 FCCCNc1nc(ccc1Cl)Br b919ac7d3bec164cff861f891db04717 [0,2,0,0,0,0|2,0,0]=4 16844 B13R1.656 FCCCNc1nc(ccc1Cl)Cl 88de4ad2b94acf57a30fe21f91ee8e55 [0,2,0,0,0,0|2,0,0]=4 16845 B13R1.656 FCCCNc1nc(ccc1F)Br 641a78176f88ddcec6a5e53d59ac8e0a [0,2,0,0,0,0|2,0,0]=4 16846 B13R1.656 FCCCNc1nc(ccc1F)Cl 2c61ab12d3f3e487e8997373541890c1 [0,2,0,0,0,0|2,0,0]=4 16847 B13R1.656 FCCCNc1nc(ccc1F)F 38f5714bcc5235c09fc01d5abf219603 [0,2,0,0,0,0|2,0,0]=4 16848 B13R1.656 FCCCNc1nc(ccc1I)Br e20b733f4df293dcca941b6b258642e0 [0,2,0,0,0,0|2,0,0]=4 16849 B13R1.656 FCCCNc1nc(ccc1I)Cl b60a78eee305a1b780150144fd5734c1 [0,2,0,0,0,0|2,0,0]=4 16850 B13R1.656 FCCCOc1nc(ccc1Br)Br 1213e23a53c2c8c7a3d34d345fb5c83d [0,2,0,0,0,0|2,0,0]=4 16851 B13R1.656 FCCCOc1nc(ccc1Br)Cl c04794e96745c8694d19b946dd76aaad [0,2,0,0,0,0|2,0,0]=4 16852 B13R1.656 FCCCOc1nc(ccc1Cl)Br 0f7767b1a01443afcde756c794255ef8 [0,2,0,0,0,0|2,0,0]=4 16853 B13R1.656 FCCCOc1nc(ccc1Cl)Cl c3b24ca8e274b1a51b0cccc887721ef9 [0,2,0,0,0,0|2,0,0]=4 16854 B13R1.656 FCCCOc1nc(ccc1F)Cl 76dc26e09517ab1224bc123d5f650e01 [0,2,0,0,0,0|2,0,0]=4 16855 B13R1.656 FCCCOc1nc(ccc1I)Br 029aed9bb3e269c616516122f13b5c92 [0,2,0,0,0,0|2,0,0]=4 16856 B13R1.656 FCCCOc1nc(ccc1I)Cl 5c5c09f4f013da17ca88fcd9b147dbc7 [0,2,0,0,0,0|2,0,0]=4 16857 B13R1.656 FCCNCc1nc(ccc1Br)Br c8280962718672f7481b3be4f3f87131 [0,2,0,0,0,0|2,0,0]=4 16858 B13R1.656 FCCNCc1nc(ccc1Br)Cl cf5535da8d2b86ffd7731da50a531b4f [0,2,0,0,0,0|2,0,0]=4 16859 B13R1.656 FCCNCc1nc(ccc1Br)F 3a5cd1ab68a9bca7b6119ddd36dacbb0 [0,2,0,0,0,0|2,0,0]=4 16860 B13R1.656 FCCNCc1nc(ccc1F)Br 885e3311d5be75765bce35406e7e8101 [0,2,0,0,0,0|2,0,0]=4 16861 B13R1.656 FCCNCc1nc(ccc1F)Cl b41dbdd76b3f780234951c2f412426df [0,2,0,0,0,0|2,0,0]=4 16862 B13R1.656 FCCOCc1nc(ccc1Br)Br caa6618181a11215d2f216d3cb051171 [0,2,0,0,0,0|2,0,0]=4 16863 B13R1.656 FCCOCc1nc(ccc1Br)Cl 7716e8f48be51cac246591a91597ae4d [0,2,0,0,0,0|2,0,0]=4 16864 B13R1.656 FCCOCc1nc(ccc1Br)F 088933db599ca0827431dc269803af76 [0,2,0,0,0,0|2,0,0]=4 16865 B13R1.656 FCCOCc1nc(ccc1Cl)Br 689fedab2da806c5b0a62ff7155bd43b [0,2,0,0,0,0|2,0,0]=4 16866 B13R1.656 FCCOCc1nc(ccc1Cl)Cl eeec9240a4d753d6439f89202620bc5c [0,2,0,0,0,0|2,0,0]=4 16867 B13R1.656 FCCOCc1nc(ccc1F)Br f40f506e3db762548ab60836cd9997f8 [0,2,0,0,0,0|2,0,0]=4 16868 B13R1.656 FCCOCc1nc(ccc1F)Cl e2767afcbfada9409ead5c7403b0ea04 [0,2,0,0,0,0|2,0,0]=4 16869 B13R1.656 Fc1ccc(c(n1)CNCCBr)Br 0179c782772c6c2b55fdf4fe6a2a3f49 [0,2,0,0,0,0|2,0,0]=4 16870 B13R1.656 Fc1ccc(c(n1)CNCCI)Br 1316004a1d654e16101979f8a4f904a0 [0,2,0,0,0,0|2,0,0]=4 16871 B13R1.656 Fc1ccc(c(n1)CNCCS)Br f05217b3083de7a08d3a70b3b63e8bd2 [0,2,0,0,0,0|2,0,0]=4 16872 B13R1.656 Fc1ccc(c(n1)COCCS)Br 4c049c410771506643e00f42e000e42d [0,2,0,0,0,0|2,0,0]=4 16873 B13R1.656 Fc1ccc(c(n1)NCCCS)Br fb904b01493176df001ca73f9f976fb4 [0,2,0,0,0,0|2,0,0]=4 16874 B13R1.656 Fc1ccc(c(n1)NCCCS)F cca698576956217bb073697c3c6823c2 [0,2,0,0,0,0|2,0,0]=4 16875 B13R1.656 Fc1ccc(nc1CNCCBr)Br d083dc116966ca2231e8874356f289a4 [0,2,0,0,0,0|2,0,0]=4 16876 B13R1.656 Fc1ccc(nc1CNCCBr)Cl 3ee4bc6ab5c0e0149bdef46f5d004aaf [0,2,0,0,0,0|2,0,0]=4 16877 B13R1.656 Fc1ccc(nc1CNCCI)Br d04af1d04f81379bce036be00f78ce2e [0,2,0,0,0,0|2,0,0]=4 16878 B13R1.656 Fc1ccc(nc1CNCCI)Cl 0abed8d71463c475e0969e1be3fa3b97 [0,2,0,0,0,0|2,0,0]=4 16879 B13R1.656 Fc1ccc(nc1CNCCS)Br cc0a44e5fa72c2695d924fbc17d814f0 [0,2,0,0,0,0|2,0,0]=4 16880 B13R1.656 Fc1ccc(nc1CNCCS)Cl 9ee72274bf583251d603d23df3c89549 [0,2,0,0,0,0|2,0,0]=4 16881 B13R1.656 Fc1ccc(nc1COCCS)Br 3e80592df6a4a8fe8929d505e28889a8 [0,2,0,0,0,0|2,0,0]=4 16882 B13R1.656 Fc1ccc(nc1COCCS)Cl 8df71b38e538a127d837c4e89a69a27b [0,2,0,0,0,0|2,0,0]=4 16883 B13R1.656 Fc1ccc(nc1NCCCS)Br 19fde2cb9908f54cdbd5326aded64095 [0,2,0,0,0,0|2,0,0]=4 16884 B13R1.656 Fc1ccc(nc1NCCCS)Cl 9f5bf4114d42453997e51804c9d8a15d [0,2,0,0,0,0|2,0,0]=4 16885 B13R1.656 Fc1ccc(nc1OCCCS)Cl 3ad779e83a0cbd350120d0a745c803d0 [0,2,0,0,0,0|2,0,0]=4 16886 B13R1.656 Nc1ccc(c(n1)NCCCCl)N c2daadfeffe7c9f1be22a5202107e0d4 [0,2,0,0,0,0|2,0,0]=4 16887 B13R1.656 Nc1ccc(c(n1)NCCCO)N 4861e8b63ec420f908c7d6985a27f573 [0,2,0,0,0,0|2,0,0]=4 16888 B13R1.656 OCCCNc1nc(ccc1Br)I 6f7f314fd8af0e16a9833a01b3fd7b5f [0,2,0,0,0,0|2,0,0]=4 16889 B13R1.656 OCCCNc1nc(ccc1Cl)Br b3e34ff73ae6a7eaa2750879bac05d53 [0,2,0,0,0,0|2,0,0]=4 16890 B13R1.656 OCCCNc1nc(ccc1Cl)Cl 2b56af7c1452ece85d2078aef1889347 [0,2,0,0,0,0|2,0,0]=4 16891 B13R1.656 OCCCNc1nc(ccc1F)Br 17701831cbfe9035324b15473a19dc10 [0,2,0,0,0,0|2,0,0]=4 16892 B13R1.656 OCCCNc1nc(ccc1F)Cl 0e1b8cab0c4cc54da562835f1b48c204 [0,2,0,0,0,0|2,0,0]=4 16893 B13R1.656 OCCCNc1nc(ccc1F)F ed80be1d61769a6f9145ba5a36f3c990 [0,2,0,0,0,0|2,0,0]=4 16894 B13R1.656 OCCCNc1nc(ccc1I)Br fca2c0d5a7dd99294d4d2808a5c2bca8 [0,2,0,0,0,0|2,0,0]=4 16895 B13R1.656 OCCCNc1nc(ccc1I)Cl 379c336c494875f357675be23a138fcf [0,2,0,0,0,0|2,0,0]=4 16896 B13R1.656 OCCNCc1nc(ccc1Br)Br efa19faca6bddb70b1ac310e6a887be8 [0,2,0,0,0,0|2,0,0]=4 16897 B13R1.656 OCCNCc1nc(ccc1Br)Cl 7b425da73763977cbf4c0baeccfd2930 [0,2,0,0,0,0|2,0,0]=4 16898 B13R1.656 OCCNCc1nc(ccc1Br)F b693b4b06bec12e688d57aadc03b7c92 [0,2,0,0,0,0|2,0,0]=4 16899 B13R1.656 OCCNCc1nc(ccc1F)Br 1b440273b2b6f62918293fb9f18a5188 [0,2,0,0,0,0|2,0,0]=4 16900 B13R1.656 OCCNCc1nc(ccc1F)Cl aab3fa8cccf98faf47e997f84dbc1e7b [0,2,0,0,0,0|2,0,0]=4 16901 B13R1.656 SCCCNc1nc(ccc1Br)Br 86f26cf2289e52c7d849dfc709b19f59 [0,2,0,0,0,0|2,0,0]=4 16902 B13R1.656 SCCCNc1nc(ccc1Br)Cl 0f811991be39c84d77cb8431589c0dcb [0,2,0,0,0,0|2,0,0]=4 16903 B13R1.656 SCCCNc1nc(ccc1Br)I e2f9dab40a476404e2f6969a26f4ce91 [0,2,0,0,0,0|2,0,0]=4 16904 B13R1.656 SCCCNc1nc(ccc1Cl)Br c08133dcc28aa357c07e7add839d3b53 [0,2,0,0,0,0|2,0,0]=4 16905 B13R1.656 SCCCNc1nc(ccc1Cl)Cl 76204900ea99da9e17a8271f4bf9b259 [0,2,0,0,0,0|2,0,0]=4 16906 B13R1.656 SCCCNc1nc(ccc1I)Br b93d42b1d702bddd00af90ef9d347183 [0,2,0,0,0,0|2,0,0]=4 16907 B13R1.656 SCCCNc1nc(ccc1I)Cl e605cf83ddc0f9467bec174998be5ac1 [0,2,0,0,0,0|2,0,0]=4 16908 B13R1.656 SCCCOc1nc(ccc1Cl)Br c1951543d2c44589b240f07978078bbf [0,2,0,0,0,0|2,0,0]=4 16909 B13R1.656 SCCCOc1nc(ccc1Cl)Cl 93a1401d55800150795484f6c4edbdc6 [0,2,0,0,0,0|2,0,0]=4 16910 B13R1.656 SCCCOc1nc(ccc1I)Br 00b9e03879a04d5887c717b78224118d [0,2,0,0,0,0|2,0,0]=4 16911 B13R1.656 SCCCOc1nc(ccc1I)Cl 17c7470910d0357ebc861bcde37f19dc [0,2,0,0,0,0|2,0,0]=4 16912 B13R1.656 SCCNCc1nc(ccc1Br)Br 79210106a609a4eda07f3c51c844d888 [0,2,0,0,0,0|2,0,0]=4 16913 B13R1.656 SCCNCc1nc(ccc1Br)Cl ac9bf254591c631bc918e71c54bf0e9c [0,2,0,0,0,0|2,0,0]=4 16914 B13R1.656 SCCOCc1nc(ccc1Br)Br 5be7ac7b6dcec1999340a7e6466422ec [0,2,0,0,0,0|2,0,0]=4 16915 B13R1.656 SCCOCc1nc(ccc1Br)Cl 855d2846fa72f30527a71245ac218067 [0,2,0,0,0,0|2,0,0]=4 16916 B13R1.656 SCCOCc1nc(ccc1Cl)Br 0b2601dc6c4f2d8b79be6883b454cecf [0,2,0,0,0,0|2,0,0]=4 16917 B13R1.656 SCCOCc1nc(ccc1Cl)Cl a0ff248e4a514db1a043e04d9adef102 [0,2,0,0,0,0|2,0,0]=4 16918 B13R1.666 C#Cc1cccc(c1)CNCCC ef7312c7c9293b15ae855be6acea950c [0,2,0,0,0,0|2,0,0]=4 16919 B13R1.666 C#Cc1cccc(c1)COCCC ac7eafc10227c6eddc9ad2d570e949e4 [0,2,0,0,0,0|2,0,0]=4 16920 B13R1.666 C#Cc1cccc(c1)NCCCC 3075f961d475248eea7df707551078d5 [0,2,0,0,0,0|2,0,0]=4 16921 B13R1.666 C#Cc1cccc(c1)OCCCC 4be23e3e0dcddd30d08f31cbbe30304c [0,2,0,0,0,0|2,0,0]=4 16922 B13R1.666 C#Cc1cccc(n1)COCCC dd97a7eda644a505958cfb1a1240e44c [0,2,0,0,0,0|1,0,0]=3 16923 B13R1.666 C#Cc1cccc(n1)COCCF 70cfaff7057a3810c1ce187729b662db [0,2,0,0,0,0|2,0,0]=4 16924 B13R1.666 C#Cc1cccc(n1)COCCS 5976538d3b2462dcaa97aca25aef785c [0,2,0,0,0,0|2,0,0]=4 16925 B13R1.666 C#Cc1cccc(n1)COCOC 3e38e9aa445e339f291bd6417a7b12ba [0,2,0,0,0,0|2,0,0]=4 16926 B13R1.666 C#Cc1cccc(n1)COCSC 063f0dea8e58ce6d787f1632072bacb3 [0,2,0,0,0,0|2,0,0]=4 16927 B13R1.666 C#Cc1cccc(n1)NCCCC 83d024445e656d96b00ce6f2d2ddeb50 [0,2,0,0,0,0|1,0,0]=3 16928 B13R1.666 C#Cc1cccc(n1)NCCCF b1dfd987c5c74945051585344e6b2f26 [0,2,0,0,0,0|2,0,0]=4 16929 B13R1.666 C#Cc1cccc(n1)NCCCO 6de673ba912323f1822f79d5fa9b418c [0,2,0,0,0,0|2,0,0]=4 16930 B13R1.666 C#Cc1cccc(n1)NCCCS 8a3e13df2b349bf7887893a08472ce8c [0,2,0,0,0,0|2,0,0]=4 16931 B13R1.666 C#Cc1cccc(n1)NCCOC 2a5a91b8ecfd3be64b523cc5ddebf532 [0,2,0,0,0,0|2,0,0]=4 16932 B13R1.666 C#Cc1cccc(n1)NCCSC e2b99602f1c99d7e18bc2487f41eb6a2 [0,2,0,0,0,0|2,0,0]=4 16933 B13R1.666 C#Cc1cccc(n1)NCOCC 37893c17552624433d2e5c8ee915fdbc [0,2,0,0,0,0|2,0,0]=4 16934 B13R1.666 C#Cc1ccnc(c1)NCCCC e79206944d786bae660b2227681f652f [0,2,0,0,0,0|1,0,0]=3 16935 B13R1.666 C#Cc1ccnc(c1)NCCCF ca4b6da0214bd4bad21fddecbf140dd2 [0,2,0,0,0,0|2,0,0]=4 16936 B13R1.666 C#Cc1ccnc(c1)NCCCO ead4f166986afa7999ec8fc7b0bfed4c [0,2,0,0,0,0|2,0,0]=4 16937 B13R1.666 C#Cc1ccnc(c1)NCCCS 0575274d5cb839543a47a2e1bf13c7b0 [0,2,0,0,0,0|2,0,0]=4 16938 B13R1.666 C#Cc1ccnc(c1)NCCOC 919b79270f42e3521858f71708715b98 [0,2,0,0,0,0|2,0,0]=4 16939 B13R1.666 C#Cc1ccnc(c1)NCCSC 2aad0365219caf01cf809198d8114af6 [0,2,0,0,0,0|2,0,0]=4 16940 B13R1.666 C#Cc1ccnc(c1)NCOCC 801b1caf9f2ba2b5d434c849921acaf7 [0,2,0,0,0,0|2,0,0]=4 16941 B13R1.666 C#Cc1ccnc(n1)NCCCC 15c865cbb368a2669d97c633450f3780 [0,2,0,0,0,0|2,0,0]=4 16942 B13R1.666 C=Cc1cccc(c1)CNCCC e3bcddae7c49109d4a7a0a7ea881d50e [0,2,0,0,0,0|2,0,0]=4 16943 B13R1.666 C=Cc1cccc(c1)COCCC 607de5b0ad0c1e25dee91c8ce2504dc0 [0,2,0,0,0,0|2,0,0]=4 16944 B13R1.666 C=Cc1cccc(c1)NCCCC f5e28ebbe0764c89d359998ee9ea94bb [0,2,0,0,0,0|2,0,0]=4 16945 B13R1.666 C=Cc1cccc(c1)OCCCC 4319a77a7ea9cbf5dc3f378b28b0cd73 [0,2,0,0,0,0|2,0,0]=4 16946 B13R1.666 C=Cc1cccc(n1)NCCCC 83e3a5deb2d52cb59db4ad154211a731 [0,2,0,0,0,0|1,0,0]=3 16947 B13R1.666 C=Cc1cccc(n1)NCCCCl 1471b6238f28ddd5456dbeb1a3c7952d [0,2,0,0,0,0|2,0,0]=4 16948 B13R1.666 C=Cc1cccc(n1)NCCCO 42829cfd2bec86c231bef0ae69360ef1 [0,2,0,0,0,0|2,0,0]=4 16949 B13R1.666 C=Cc1cccc(n1)NCCOC 4ff9aebbc3801f8df29de708a365055b [0,2,0,0,0,0|2,0,0]=4 16950 B13R1.666 C=Cc1cccc(n1)NCCSC 443c1705945fef322a1b73c03fba17d9 [0,2,0,0,0,0|2,0,0]=4 16951 B13R1.666 C=Cc1ccnc(c1)NCCCC 985247188da9b59a97900c24d52901b0 [0,2,0,0,0,0|1,0,0]=3 16952 B13R1.666 C=Cc1ccnc(c1)NCCCCl d21711ef08b29c79dbdddc1b35c5548c [0,2,0,0,0,0|2,0,0]=4 16953 B13R1.666 C=Cc1ccnc(c1)NCCCO 27a174b56b5a7b5e6aaae8f778755c10 [0,2,0,0,0,0|2,0,0]=4 16954 B13R1.666 C=Cc1ccnc(c1)NCCOC 167bd9d9b690d1c97de7426a76737d96 [0,2,0,0,0,0|2,0,0]=4 16955 B13R1.666 C=Cc1ccnc(c1)NCCSC bd4c3f402713757c7e2791da56ad72c2 [0,2,0,0,0,0|2,0,0]=4 16956 B13R1.666 C=Cc1ccnc(n1)NCCCC 0521f1e7a263a7d399f6a72d6adb035b [0,2,0,0,0,0|2,0,0]=4 16957 B13R1.666 C=Cc1nccc(n1)NCCCC 4d42635b6228651cb0c801c5f53d5d62 [0,2,0,0,0,0|2,0,0]=4 16958 B13R1.666 CCCCNc1cc(ccn1)C#N 3aad6eac053b11fe3f6f69a179655f9d [0,2,0,0,0,0|1,0,0]=3 16959 B13R1.666 CCCCNc1cc(ccn1)C=O 993d6f4131b833c15cbb0975025ebd70 [0,2,0,0,0,0|1,0,0]=3 16960 B13R1.666 CCCCNc1cc(ccn1)CC b8cc05b639c96caa46f6eff59e6fd85d [0,2,0,0,0,0|1,0,0]=3 16961 B13R1.666 CCCCNc1cc(ccn1)CCl f7aaf99ff2dac31d88f9f66fc8800861 [0,2,0,0,0,0|1,0,0]=3 16962 B13R1.666 CCCCNc1cc(ccn1)CF db58bd2d7ecd0821bef2907fe766880b [0,2,0,0,0,0|1,0,0]=3 16963 B13R1.666 CCCCNc1cc(ccn1)CO 58b3dc7e35c2dd1a4edfb2f45a318845 [0,2,0,0,0,0|1,0,0]=3 16964 B13R1.666 CCCCNc1cc(ccn1)OC 3f0f93d2f23db06c3e110cc6e93d3af3 [0,2,0,0,0,0|1,0,0]=3 16965 B13R1.666 CCCCNc1cc(cnn1)OC 466c575cc3b94b3c8f3d9bdded668ea2 [0,2,0,0,0,0|2,0,0]=4 16966 B13R1.666 CCCCNc1cc(ncn1)CC 6688716a8510672111f0f648349a51a7 [0,2,0,0,0,0|2,0,0]=4 16967 B13R1.666 CCCCNc1cc(ncn1)OC 00ecd25610b2a62c4d40c3b2efe4bf9c [0,2,0,0,0,0|2,0,0]=4 16968 B13R1.666 CCCCNc1cc(ncn1)SC 388893535fc5af1730cc38a3963c32ee [0,2,0,0,0,0|2,0,0]=4 16969 B13R1.666 CCCCNc1cccc(c1)C#N 5dfa07aab2534b74e96597c189f8b476 [0,2,0,0,0,0|2,0,0]=4 16970 B13R1.666 CCCCNc1cccc(c1)C=O 93e918b9329f78e7cab3ac1f5cdb17b9 [0,2,0,0,0,0|2,0,0]=4 16971 B13R1.666 CCCCNc1cccc(c1)CBr 750560bbac37b248ded8faffb9fab087 [0,2,0,0,0,0|2,0,0]=4 16972 B13R1.666 CCCCNc1cccc(c1)CC be69c4d703affe6e459bfeb7dd862b61 [0,2,0,0,0,0|2,0,0]=4 16973 B13R1.666 CCCCNc1cccc(c1)CF 1529faf16257b361f4509e7db008581a [0,2,0,0,0,0|2,0,0]=4 16974 B13R1.666 CCCCNc1cccc(c1)CO 852ae46d3129eb063115b214d4f7e04c [0,2,0,0,0,0|2,0,0]=4 16975 B13R1.666 CCCCNc1cccc(c1)CS 5b2dc73328eba204a87ebe796f7ef5f7 [0,2,0,0,0,0|2,0,0]=4 16976 B13R1.666 CCCCNc1cccc(c1)OC 5e20843da980b14fd16128951aa46082 [0,2,0,0,0,0|2,0,0]=4 16977 B13R1.666 CCCCNc1cccc(c1)ON 3891952be870afd59a534b3fb067923e [0,2,0,0,0,0|2,0,0]=4 16978 B13R1.666 CCCCNc1cccc(c1)SC 22c3653148060a476c415128b379cc9d [0,2,0,0,0,0|2,0,0]=4 16979 B13R1.666 CCCCNc1cccc(n1)C#N 2c1c3a332545f34e3fcaae3aa4b0b51e [0,2,0,0,0,0|1,0,0]=3 16980 B13R1.666 CCCCNc1cccc(n1)C=O 2f1f69d1e4bd4a49591fbe9d40152529 [0,2,0,0,0,0|1,0,0]=3 16981 B13R1.666 CCCCNc1cccc(n1)CC 85b1fe0d30d0b89152359ad33a83c0a9 [0,2,0,0,0,0|1,0,0]=3 16982 B13R1.666 CCCCNc1cccc(n1)CO d2dd36502259fa7440b47a52fc2865b0 [0,2,0,0,0,0|1,0,0]=3 16983 B13R1.666 CCCCNc1cccc(n1)OC 52f603a5455a515c6e2437f66096da00 [0,2,0,0,0,0|1,0,0]=3 16984 B13R1.666 CCCCNc1cccc(n1)SC f3ac132fc1366f06a8af164788674a28 [0,2,0,0,0,0|1,0,0]=3 16985 B13R1.666 CCCCNc1ccnc(n1)C#N 686a09066658b76891e0b2188ae9d91c [0,2,0,0,0,0|2,0,0]=4 16986 B13R1.666 CCCCNc1ccnc(n1)C=O bb3bb1ed0091cb46de66e746466181bb [0,2,0,0,0,0|2,0,0]=4 16987 B13R1.666 CCCCNc1ccnc(n1)CC 48096caef8b5e7a60b2421136120f575 [0,2,0,0,0,0|2,0,0]=4 16988 B13R1.666 CCCCNc1ccnc(n1)CCl 81b12e6ac3776c45d8dfc9a29590e1cb [0,2,0,0,0,0|2,0,0]=4 16989 B13R1.666 CCCCNc1ccnc(n1)OC 2f62e6149af8aff8e6060a147fc738c7 [0,2,0,0,0,0|2,0,0]=4 16990 B13R1.666 CCCCNc1ccnc(n1)SC 2a0cd2a5c03fd36ef2212ec7df25c9c5 [0,2,0,0,0,0|2,0,0]=4 16991 B13R1.666 CCCCNc1cncc(n1)C#N 689a8e30fcbdb7e18a1b0e45f8640a76 [0,2,0,0,0,0|2,0,0]=4 16992 B13R1.666 CCCCNc1cncc(n1)C=O 6fd4786b669d05e29a6b242e109d0726 [0,2,0,0,0,0|2,0,0]=4 16993 B13R1.666 CCCCNc1cncc(n1)CC 10b80da4d4c96e02ce1cf8dff155f2c1 [0,2,0,0,0,0|2,0,0]=4 16994 B13R1.666 CCCCNc1cncc(n1)CO d191e5de16fd3f58fdb7fb7cafdd9b8b [0,2,0,0,0,0|2,0,0]=4 16995 B13R1.666 CCCCNc1cncc(n1)OC 837fc70990c9ad7317f523340bb16adf [0,2,0,0,0,0|2,0,0]=4 16996 B13R1.666 CCCCNc1cncc(n1)SC b7aa5850b4bd8a598f00e72bfd6edb7c [0,2,0,0,0,0|2,0,0]=4 16997 B13R1.666 CCCCNc1nccc(n1)C#N f9cd300b7c3c496f708543e58974b8b9 [0,2,0,0,0,0|2,0,0]=4 16998 B13R1.666 CCCCNc1nccc(n1)C=O b126f92fc3f0c0cd35134ee876cce332 [0,2,0,0,0,0|2,0,0]=4 16999 B13R1.666 CCCCNc1nccc(n1)CC ad3090d117a921e40f03c2e77fd4d902 [0,2,0,0,0,0|2,0,0]=4 17000 B13R1.666 CCCCNc1nccc(n1)CO bc9056b1b2af676be91dac309012da42 [0,2,0,0,0,0|2,0,0]=4 17001 B13R1.666 CCCCNc1nccc(n1)OC d6105b12c44f4fa86a2f786054ab9f1b [0,2,0,0,0,0|2,0,0]=4 17002 B13R1.666 CCCCNc1nccc(n1)SC a6f02c72dc8b7f281918f08dc6a6d0bb [0,2,0,0,0,0|2,0,0]=4 17003 B13R1.666 CCCCOc1cc(ccn1)C#N da15a9efefea639c91b47b50cb4f286f [0,2,0,0,0,0|1,0,0]=3 17004 B13R1.666 CCCCOc1cc(ccn1)C=O 48fc4868f4360f4f533c8992ae7204a3 [0,2,0,0,0,0|1,0,0]=3 17005 B13R1.666 CCCCOc1cc(ccn1)OC 1b7114c9c4a8ac3f9bd7aecb1a6c3c08 [0,2,0,0,0,0|1,0,0]=3 17006 B13R1.666 CCCCOc1cc(cnn1)CC ca10bae7e4c1b932746c64e766060463 [0,2,0,0,0,0|2,0,0]=4 17007 B13R1.666 CCCCOc1cc(ncn1)C=O 8627b0f53d0ff9315c033c8a943cccc7 [0,2,0,0,0,0|2,0,0]=4 17008 B13R1.666 CCCCOc1cc(ncn1)CC c765b745fe3573a932df21e8f7c7bc7f [0,2,0,0,0,0|2,0,0]=4 17009 B13R1.666 CCCCOc1cc(ncn1)OC c0bef06b5132c17d0f3bf9457b072c4f [0,2,0,0,0,0|2,0,0]=4 17010 B13R1.666 CCCCOc1cccc(c1)C#N 25bb59e1d24a5469bd30e94165a462e0 [0,2,0,0,0,0|2,0,0]=4 17011 B13R1.666 CCCCOc1cccc(c1)C=O 2ec166b3a201ad4220badf4889ccc1c4 [0,2,0,0,0,0|2,0,0]=4 17012 B13R1.666 CCCCOc1cccc(c1)CC 818884388baed47e5d8526a863443ca0 [0,2,0,0,0,0|2,0,0]=4 17013 B13R1.666 CCCCOc1cccc(c1)OC 2d1779b5e8286faa7f7dd0f84a35491a [0,2,0,0,0,0|2,0,0]=4 17014 B13R1.666 CCCCOc1cccc(c1)SC dc0d7fd11b7cef3c53b48878f4134876 [0,2,0,0,0,0|2,0,0]=4 17015 B13R1.666 CCCCOc1cccc(n1)C#N 2035fac8a2b47e98336643a5b03c26ed [0,2,0,0,0,0|1,0,0]=3 17016 B13R1.666 CCCCOc1ccnc(n1)CC 5468fa3cbb67af4c5c14e5e81f5f914f [0,2,0,0,0,0|2,0,0]=4 17017 B13R1.666 CCCCOc1ccnc(n1)OC 57732271a18ae2d975c0439c5a2c429c [0,2,0,0,0,0|2,0,0]=4 17018 B13R1.666 CCCCOc1cncc(n1)CC bac627302d9cd33b3700fab224f8718a [0,2,0,0,0,0|2,0,0]=4 17019 B13R1.666 CCCNCc1cc(ccn1)OC 1aaff02b320788e76508d4015cebcb5e [0,2,0,0,0,0|1,0,0]=3 17020 B13R1.666 CCCNCc1cc(ncn1)OC f9eecb8614dc5b252a0db36e4943f309 [0,2,0,0,0,0|2,0,0]=4 17021 B13R1.666 CCCNCc1cccc(c1)C#N b7873827c148adc7de27b5e43e50c308 [0,2,0,0,0,0|2,0,0]=4 17022 B13R1.666 CCCNCc1cccc(c1)C=O e0a9dda831498003f47c95337c9dd2fc [0,2,0,0,0,0|2,0,0]=4 17023 B13R1.666 CCCNCc1cccc(c1)CC 0307efcd0afd268f158d795feb560f39 [0,2,0,0,0,0|2,0,0]=4 17024 B13R1.666 CCCNCc1cccc(c1)CO 3a9c2193b1e87de984abcca951ecc56f [0,2,0,0,0,0|2,0,0]=4 17025 B13R1.666 CCCNCc1cccc(c1)OC ef15f933c8d7d8405aa3d6300197ef63 [0,2,0,0,0,0|2,0,0]=4 17026 B13R1.666 CCCNCc1cccc(c1)SC 50868a59a568419c8ca78d1ce415022c [0,2,0,0,0,0|2,0,0]=4 17027 B13R1.666 CCCNCc1cccc(n1)C#N c6caf593db8bdbc97d85ffefd3769d8f [0,2,0,0,0,0|1,0,0]=3 17028 B13R1.666 CCCNCc1cccc(n1)CO a093684d9710b4545298945458bd4b5e [0,2,0,0,0,0|1,0,0]=3 17029 B13R1.666 CCCNCc1cccc(n1)OC 95b5ab1b9693201283afa127d4e6d440 [0,2,0,0,0,0|1,0,0]=3 17030 B13R1.666 CCCNCc1ccnc(n1)OC 07e3b3667890ad86f33d4561ee9618aa [0,2,0,0,0,0|2,0,0]=4 17031 B13R1.666 CCCNCc1ccnc(n1)SC b9e8c5522952fe8a9a2d0aef0667f08c [0,2,0,0,0,0|2,0,0]=4 17032 B13R1.666 CCCNCc1nccc(n1)OC e04965d230f40254e907ace402f14597 [0,2,0,0,0,0|2,0,0]=4 17033 B13R1.666 CCCOCc1cc(ccn1)C#N 05d811e21f83a900527e4deb27f770a7 [0,2,0,0,0,0|1,0,0]=3 17034 B13R1.666 CCCOCc1cc(ccn1)C=O e654154a922babc4a46a8a85873d6b8c [0,2,0,0,0,0|1,0,0]=3 17035 B13R1.666 CCCOCc1cc(ccn1)OC ae7f3721f875aab035866e7f9b62e050 [0,2,0,0,0,0|1,0,0]=3 17036 B13R1.666 CCCOCc1cc(cnn1)OC ffbdc1cb4a94a8873f23a37293213b85 [0,2,0,0,0,0|2,0,0]=4 17037 B13R1.666 CCCOCc1cc(ncn1)OC 05c6465f330a09db8dd4a52cbff79169 [0,2,0,0,0,0|2,0,0]=4 17038 B13R1.666 CCCOCc1cccc(c1)C#N 66858c53366be020fcb2e7120ce0b8a6 [0,2,0,0,0,0|2,0,0]=4 17039 B13R1.666 CCCOCc1cccc(c1)C=O 9e2354e89b71f8619017514f72a1b2ae [0,2,0,0,0,0|2,0,0]=4 17040 B13R1.666 CCCOCc1cccc(c1)CC 4e319087841a43059815e0ac51037ebb [0,2,0,0,0,0|2,0,0]=4 17041 B13R1.666 CCCOCc1cccc(c1)OC b8cb5d7bfac9ea05233b4ffde559c582 [0,2,0,0,0,0|2,0,0]=4 17042 B13R1.666 CCCOCc1cccc(c1)SC b63c3a413ca765d2124442d9ce05ba0b [0,2,0,0,0,0|2,0,0]=4 17043 B13R1.666 CCCOCc1cccc(n1)C#N a86c9a75314042e2a2411e30abc2964f [0,2,0,0,0,0|1,0,0]=3 17044 B13R1.666 CCCOCc1cccc(n1)C=O 925ad116637b4177e5203fea80c0e07b [0,2,0,0,0,0|1,0,0]=3 17045 B13R1.666 CCCOCc1cccc(n1)CC c2a47f909d8565dd813e077d6ffc6cf9 [0,2,0,0,0,0|1,0,0]=3 17046 B13R1.666 CCCOCc1cccc(n1)CF 771e931f95050e95ce7f4a5707debfab [0,2,0,0,0,0|1,0,0]=3 17047 B13R1.666 CCCOCc1cccc(n1)OC 77019a67c1cec4f6fc0c1442dd7e3bc9 [0,2,0,0,0,0|1,0,0]=3 17048 B13R1.666 CCCOCc1ccnc(n1)CC e9ed8bc86252953050c99fe8c9d9bc0a [0,2,0,0,0,0|2,0,0]=4 17049 B13R1.666 CCCOCc1ccnc(n1)OC 2076bcc2215524e40f1bd3a341033b9d [0,2,0,0,0,0|2,0,0]=4 17050 B13R1.666 CCCOCc1ccnc(n1)SC a6a054ffddcf351416bda912e45d1090 [0,2,0,0,0,0|2,0,0]=4 17051 B13R1.666 CCNCCc1cccc(c1)CO 92db78b0788d660a686f16c4522a9f2a [0,2,0,0,0,0|2,0,0]=4 17052 B13R1.666 CCNCCc1cccc(c1)OC d9e32e5103f4bc76e84d17df06414e87 [0,2,0,0,0,0|2,0,0]=4 17053 B13R1.666 CCOCCc1cc(ccn1)C#N 0fe2e47dfc17ecdf2519b4fa48b06b4e [0,2,0,0,0,0|1,0,0]=3 17054 B13R1.666 CCOCCc1cccc(c1)C#N ce154aebd8f7b7d61379b790c83fa1ae [0,2,0,0,0,0|2,0,0]=4 17055 B13R1.666 CCOCCc1cccc(c1)C=O 735efefe0b96cc8182b0492dc6179331 [0,2,0,0,0,0|2,0,0]=4 17056 B13R1.666 CCOCCc1cccc(c1)OC d93ce30239d314e160d5e367bcf018d6 [0,2,0,0,0,0|2,0,0]=4 17057 B13R1.666 CCOCCc1cccc(n1)OC 870185bf3495f8da02529a7b3279d782 [0,2,0,0,0,0|1,0,0]=3 17058 B13R1.666 CCOCNc1cc(ccn1)C#N 9f6c96c8f584f1525be224a13da245a2 [0,2,0,0,0,0|2,0,0]=4 17059 B13R1.666 CCOCNc1cc(ccn1)CC 3111c8f098e5a65ae50c2eee7e21e384 [0,2,0,0,0,0|2,0,0]=4 17060 B13R1.666 CCOCNc1cc(ccn1)CCl fad27cbee8e190ec1896613dd7ad66ba [0,2,0,0,0,0|2,0,0]=4 17061 B13R1.666 CCOCNc1cc(ccn1)CO aefd5d32d4f763b4752b827b09f313d1 [0,2,0,0,0,0|2,0,0]=4 17062 B13R1.666 CCOCNc1cc(ccn1)OC 26e159eaafe1b94dc51f911bd4c9e8d7 [0,2,0,0,0,0|2,0,0]=4 17063 B13R1.666 CCOCNc1cccc(n1)C#N 7a754d7e612c863cf465bbc57fdbe8c3 [0,2,0,0,0,0|2,0,0]=4 17064 B13R1.666 CCOCNc1cccc(n1)C=O 56937e33737e481810bbf26f6a7388c0 [0,2,0,0,0,0|2,0,0]=4 17065 B13R1.666 CCOCNc1cccc(n1)CC 3370b9d3606ffa585d29ecdd811a9277 [0,2,0,0,0,0|2,0,0]=4 17066 B13R1.666 CCOCNc1cccc(n1)CO da0d201ec5fcd8abc2311d6c76a51a8d [0,2,0,0,0,0|2,0,0]=4 17067 B13R1.666 CCOCNc1cccc(n1)OC fe4a1bf073dbadd1e46a4a992a37bd4e [0,2,0,0,0,0|2,0,0]=4 17068 B13R1.666 CCOCOc1cc(ccn1)C#N e94fe9fea050c43c7a67e2af12d2a316 [0,2,0,0,0,0|2,0,0]=4 17069 B13R1.666 CCOCOc1cc(ccn1)C=O 043653ccea02c7632836dc1cfbf73d95 [0,2,0,0,0,0|2,0,0]=4 17070 B13R1.666 CCOCOc1cc(ccn1)OC 4ade22b4b9adba8a2a414d02843d2249 [0,2,0,0,0,0|2,0,0]=4 17071 B13R1.666 CCOCOc1cccc(n1)C#N 65d68622d3239d33882e3179fbd534a6 [0,2,0,0,0,0|2,0,0]=4 17072 B13R1.666 CCc1cccc(n1)COCCF 9f7db5531977265ef7547ce9e3628af2 [0,2,0,0,0,0|2,0,0]=4 17073 B13R1.666 CCc1cccc(n1)COCCS 4858d42e2b1331ca922472c21a6af6ab [0,2,0,0,0,0|2,0,0]=4 17074 B13R1.666 CCc1cccc(n1)COCOC 7446626f98a3caa3456aa77a15a36a29 [0,2,0,0,0,0|2,0,0]=4 17075 B13R1.666 CCc1cccc(n1)COCSC d3bdc04fbff1d333d1daea3586122cdf [0,2,0,0,0,0|2,0,0]=4 17076 B13R1.666 CCc1cccc(n1)NCCCCl c8766d4dbb45ee43362dc421e019382e [0,2,0,0,0,0|2,0,0]=4 17077 B13R1.666 CCc1cccc(n1)NCCCF 4e2d729127944ee2e4d023f947dc1f94 [0,2,0,0,0,0|2,0,0]=4 17078 B13R1.666 CCc1cccc(n1)NCCCO 64695a6d8eea345c6745f7e055a51f1e [0,2,0,0,0,0|2,0,0]=4 17079 B13R1.666 CCc1cccc(n1)NCCCS 77038c5f75f1e0bb342806bd6bda09f5 [0,2,0,0,0,0|2,0,0]=4 17080 B13R1.666 CCc1cccc(n1)NCCOC 047c0abda3a10741631ccf102e08da11 [0,2,0,0,0,0|2,0,0]=4 17081 B13R1.666 CCc1cccc(n1)NCCSC a45682bea1ce1bc2baaddf48934abb9b [0,2,0,0,0,0|2,0,0]=4 17082 B13R1.666 CCc1ccnc(c1)NCCCCl 7402d34d96110feede7e5f0c3b3087f7 [0,2,0,0,0,0|2,0,0]=4 17083 B13R1.666 CCc1ccnc(c1)NCCCF 228c51ab6a54a477c3367cad2594665c [0,2,0,0,0,0|2,0,0]=4 17084 B13R1.666 CCc1ccnc(c1)NCCCO e7c530a37fe0b2b6e8b3f3f7c8bc788b [0,2,0,0,0,0|2,0,0]=4 17085 B13R1.666 CCc1ccnc(c1)NCCCS 736b965b1d8ead3c018c79d812028004 [0,2,0,0,0,0|2,0,0]=4 17086 B13R1.666 CCc1ccnc(c1)NCCOC 5ad479fd9fdcea4283e4dc7dee445a67 [0,2,0,0,0,0|2,0,0]=4 17087 B13R1.666 CCc1ccnc(c1)NCCSC f1b475464138892744072779fffbef14 [0,2,0,0,0,0|2,0,0]=4 17088 B13R1.666 COCCNc1cc(ccn1)C#N 23222c93a9395874394954bf209f7f75 [0,2,0,0,0,0|2,0,0]=4 17089 B13R1.666 COCCNc1cc(ccn1)C=O 9fc30b0b856f6825aebfb47402ad7fbd [0,2,0,0,0,0|2,0,0]=4 17090 B13R1.666 COCCNc1cc(ccn1)CCl 7fc96acd683feaf5c85199523be9e52d [0,2,0,0,0,0|2,0,0]=4 17091 B13R1.666 COCCNc1cc(ccn1)CF 27d51781f1d6988141e4f6509c91c646 [0,2,0,0,0,0|2,0,0]=4 17092 B13R1.666 COCCNc1cc(ccn1)CO b68897e15a186aadeeb84d5107ffe4f6 [0,2,0,0,0,0|2,0,0]=4 17093 B13R1.666 COCCNc1cc(ccn1)OC aa1547b1b9a13de9190b5a1ba343c800 [0,2,0,0,0,0|2,0,0]=4 17094 B13R1.666 COCCNc1cc(ccn1)SC 263775c27b06c6f7c36f7892e0d9f4b9 [0,2,0,0,0,0|2,0,0]=4 17095 B13R1.666 COCCNc1cccc(n1)C#N 1b25474e3a505d6dffb0e1d529180685 [0,2,0,0,0,0|2,0,0]=4 17096 B13R1.666 COCCNc1cccc(n1)C=O 7da0ca8f40b2ffac26031fffe66de4a2 [0,2,0,0,0,0|2,0,0]=4 17097 B13R1.666 COCCNc1cccc(n1)CO 762b3a0957de0923313339bdb5148aa9 [0,2,0,0,0,0|2,0,0]=4 17098 B13R1.666 COCCNc1cccc(n1)OC 5ef368b938d184f26c2ad8f3e00a8701 [0,2,0,0,0,0|2,0,0]=4 17099 B13R1.666 COCCNc1cccc(n1)SC 2c43245465e5682e06bc3ec04e156867 [0,2,0,0,0,0|2,0,0]=4 17100 B13R1.666 COCCOc1cc(ccn1)C#N 510d9d914b5c698e41b19aaeb75a81a5 [0,2,0,0,0,0|2,0,0]=4 17101 B13R1.666 COCCOc1cc(ccn1)C=O ba4a8a3ec481984229ad52065be1bc6c [0,2,0,0,0,0|2,0,0]=4 17102 B13R1.666 COCCOc1cc(ccn1)OC 468cee568921886d36ff3284d04fb816 [0,2,0,0,0,0|2,0,0]=4 17103 B13R1.666 COCCOc1cccc(n1)C#N cd5d5fe50062706333c31943f5ba42fb [0,2,0,0,0,0|2,0,0]=4 17104 B13R1.666 COCNCc1cc(ccn1)OC 066d8a28e4f664e36197e6d7cd7b8d77 [0,2,0,0,0,0|2,0,0]=4 17105 B13R1.666 COCNCc1cccc(n1)CO 2db2609858b9fd7c94477830c4534edd [0,2,0,0,0,0|2,0,0]=4 17106 B13R1.666 COCNCc1cccc(n1)OC b93ca76f415a62ac1b54e32ce928d853 [0,2,0,0,0,0|2,0,0]=4 17107 B13R1.666 COCOCc1cc(ccn1)C#N 012d7c1f425194f954641fe8d060922f [0,2,0,0,0,0|2,0,0]=4 17108 B13R1.666 COCOCc1cc(ccn1)C=O 9f3bc6e6cab1aa6c5be3f3a9d522c61b [0,2,0,0,0,0|2,0,0]=4 17109 B13R1.666 COCOCc1cc(ccn1)OC 69089d8622652d1009893d6c73e970c3 [0,2,0,0,0,0|2,0,0]=4 17110 B13R1.666 COCOCc1cccc(n1)C#N cb2cf90e7272ef489cf7683902baa5a6 [0,2,0,0,0,0|2,0,0]=4 17111 B13R1.666 COCOCc1cccc(n1)C=O 958cee849d22a4b908aaafbd356d65c9 [0,2,0,0,0,0|2,0,0]=4 17112 B13R1.666 COCOCc1cccc(n1)CF 75efc78a048c5077fda51e68ae50b32c [0,2,0,0,0,0|2,0,0]=4 17113 B13R1.666 COCOCc1cccc(n1)OC ea24340b603c887c879a6b5315e1b186 [0,2,0,0,0,0|2,0,0]=4 17114 B13R1.666 COc1cccc(n1)CCOCF e46f6e2fd57f605b8ec93edb78edaba7 [0,2,0,0,0,0|2,0,0]=4 17115 B13R1.666 COc1cccc(n1)CNCCBr 212ad319f4f85a3e712589abb606bfe2 [0,2,0,0,0,0|2,0,0]=4 17116 B13R1.666 COc1cccc(n1)CNCCF 922d7806f95fba896e82caf6e6503cc4 [0,2,0,0,0,0|2,0,0]=4 17117 B13R1.666 COc1cccc(n1)CNCCI b5c8a0d11aea6bb5b5dde8604ede1aa9 [0,2,0,0,0,0|2,0,0]=4 17118 B13R1.666 COc1cccc(n1)CNCCO 2a97987170bdbbff9cb41bd28e38ba7a [0,2,0,0,0,0|2,0,0]=4 17119 B13R1.666 COc1cccc(n1)CNCCS 24ce12c6c5d88a4f6f6d6eac9b9ce44b [0,2,0,0,0,0|2,0,0]=4 17120 B13R1.666 COc1cccc(n1)CNCSC 20e4026ac9f68f2434b72681fa870cb0 [0,2,0,0,0,0|2,0,0]=4 17121 B13R1.666 COc1cccc(n1)COCCF b34050421ea413084b10106a35b81c29 [0,2,0,0,0,0|2,0,0]=4 17122 B13R1.666 COc1cccc(n1)COCCS f7c2075ae1ba38a7f2438656f46c69f2 [0,2,0,0,0,0|2,0,0]=4 17123 B13R1.666 COc1cccc(n1)COCSC 7726bf52b5f89632a850ece533c7f35b [0,2,0,0,0,0|2,0,0]=4 17124 B13R1.666 COc1cccc(n1)NCCCCl 7fd17488725b9bcd2c1167b4dbd9cb0c [0,2,0,0,0,0|2,0,0]=4 17125 B13R1.666 COc1cccc(n1)NCCCF 85f2f0f59cdfcd5c0a498fa1fc24df5a [0,2,0,0,0,0|2,0,0]=4 17126 B13R1.666 COc1cccc(n1)NCCCO 0b95cffb647922f9e548bf83c7e5c8a1 [0,2,0,0,0,0|2,0,0]=4 17127 B13R1.666 COc1cccc(n1)NCCCS fc04710269d352235410367e9cdacaba [0,2,0,0,0,0|2,0,0]=4 17128 B13R1.666 COc1cccc(n1)NCCSC fb4a9fd2c8e1954b97e0ae3b9f5c85c4 [0,2,0,0,0,0|2,0,0]=4 17129 B13R1.666 COc1ccnc(c1)CNCCBr 66c815752f29ed43601a7c8ffee429ba [0,2,0,0,0,0|2,0,0]=4 17130 B13R1.666 COc1ccnc(c1)CNCCF 6b6f90c7dd41cab1c288cfa53391b007 [0,2,0,0,0,0|2,0,0]=4 17131 B13R1.666 COc1ccnc(c1)CNCCI 34b70461d5e0e0233c7f2d205e2a3a33 [0,2,0,0,0,0|2,0,0]=4 17132 B13R1.666 COc1ccnc(c1)CNCCO 297138cae6bdb3962bfa00b46f56b0e4 [0,2,0,0,0,0|2,0,0]=4 17133 B13R1.666 COc1ccnc(c1)CNCCS b35010e04f56983965addf20530f58d2 [0,2,0,0,0,0|2,0,0]=4 17134 B13R1.666 COc1ccnc(c1)CNCSC 77f98d36fe2ceb4eba5a92499a3bab26 [0,2,0,0,0,0|2,0,0]=4 17135 B13R1.666 COc1ccnc(c1)COCCF e4284c12a5820dd973cc6d25f5e2dba1 [0,2,0,0,0,0|2,0,0]=4 17136 B13R1.666 COc1ccnc(c1)COCCS 1bf08fac09281da80d5e48bdeb2c1264 [0,2,0,0,0,0|2,0,0]=4 17137 B13R1.666 COc1ccnc(c1)COCSC 2a92df9aa993fbc7ee144040c465a0d8 [0,2,0,0,0,0|2,0,0]=4 17138 B13R1.666 COc1ccnc(c1)NCCCF d0a8dadbbfa1c0a4a32870a310e89754 [0,2,0,0,0,0|2,0,0]=4 17139 B13R1.666 COc1ccnc(c1)NCCCO 723d2126d2dde407c1ca3f4f649a476e [0,2,0,0,0,0|2,0,0]=4 17140 B13R1.666 COc1ccnc(c1)NCCCS 8d50567331e7efe804a65d6f28491cc0 [0,2,0,0,0,0|2,0,0]=4 17141 B13R1.666 COc1ccnc(c1)NCCSC 5b2d6d46f9a6b40aa99e164fbcab38d9 [0,2,0,0,0,0|2,0,0]=4 17142 B13R1.666 COc1ccnc(c1)OCCCF 10750bbc6db621ebdc435bc2b094599a [0,2,0,0,0,0|2,0,0]=4 17143 B13R1.666 COc1ccnc(c1)OCCCS 60f118d462bcbfe34e21d5f75b7c50bf [0,2,0,0,0,0|2,0,0]=4 17144 B13R1.666 COc1ccnc(c1)OCCSC b779a823f403a1d4c24a643a7623466b [0,2,0,0,0,0|2,0,0]=4 17145 B13R1.666 CSCCNc1cc(ccn1)C#N 76c29853436d799861eace8b44a44603 [0,2,0,0,0,0|2,0,0]=4 17146 B13R1.666 CSCCNc1cc(ccn1)C=O 10a7c04e09888d3fd5c9f02184fcb434 [0,2,0,0,0,0|2,0,0]=4 17147 B13R1.666 CSCCNc1cc(ccn1)CCl eb26f245c2fabbcbdcb5f8039d45953b [0,2,0,0,0,0|2,0,0]=4 17148 B13R1.666 CSCCNc1cc(ccn1)CF f74bb31a797dc0547edcaf230c728d39 [0,2,0,0,0,0|2,0,0]=4 17149 B13R1.666 CSCCNc1cc(ccn1)CO b3425f6ccf6ecd61c5ee19de8497942b [0,2,0,0,0,0|2,0,0]=4 17150 B13R1.666 CSCCNc1cccc(n1)C#N 3092c9cefed52a979913d61f73affeb3 [0,2,0,0,0,0|2,0,0]=4 17151 B13R1.666 CSCCNc1cccc(n1)C=O caeb69b3ef5e5d3304054924e437ad1a [0,2,0,0,0,0|2,0,0]=4 17152 B13R1.666 CSCCNc1cccc(n1)CO 321d959829275749079d1e11a3ee4ea6 [0,2,0,0,0,0|2,0,0]=4 17153 B13R1.666 CSCCNc1cccc(n1)SC 44f8266df0d11fe9f4740505782bd531 [0,2,0,0,0,0|2,0,0]=4 17154 B13R1.666 CSCCOc1cc(ccn1)C#N 4e576bfb1baa3f1eaf5b2114d6b97709 [0,2,0,0,0,0|2,0,0]=4 17155 B13R1.666 CSCCOc1cc(ccn1)C=O f31fe19cc2e9496a1e970a252969f9f7 [0,2,0,0,0,0|2,0,0]=4 17156 B13R1.666 CSCCOc1cccc(n1)C#N b3ad66aaa34a791706fa73c73729c34f [0,2,0,0,0,0|2,0,0]=4 17157 B13R1.666 CSCNCc1cccc(n1)CO 956734a1ec6d022a467915fed67db63b [0,2,0,0,0,0|2,0,0]=4 17158 B13R1.666 CSCOCc1cc(ccn1)C#N fccca5bd0e34e7fbf46513c568f67520 [0,2,0,0,0,0|2,0,0]=4 17159 B13R1.666 CSCOCc1cc(ccn1)C=O ce58c1c4c0d1e6398e79332b9f2cbc57 [0,2,0,0,0,0|2,0,0]=4 17160 B13R1.666 CSCOCc1cccc(n1)C#N 575b50d88a3b597dd2e89669d0963468 [0,2,0,0,0,0|2,0,0]=4 17161 B13R1.666 CSCOCc1cccc(n1)C=O 26362d120e269c8a8cffdcfd5f80affe [0,2,0,0,0,0|2,0,0]=4 17162 B13R1.666 CSCOCc1cccc(n1)CF f44c3888df3c869485d8bb3d5c0afd73 [0,2,0,0,0,0|2,0,0]=4 17163 B13R1.666 CSc1cccc(n1)NCCCF d23ab3007911111035a78fe538392417 [0,2,0,0,0,0|2,0,0]=4 17164 B13R1.666 CSc1cccc(n1)NCCCO d308e7b87474512ac0f8f5a0a1e0cd86 [0,2,0,0,0,0|2,0,0]=4 17165 B13R1.666 CSc1cccc(n1)NCCCS a648f72b1c84c4cbfc7535498f4fd08e [0,2,0,0,0,0|2,0,0]=4 17166 B13R1.666 CSc1ccnc(c1)NCCCCl c6a7a9def3517ffb8ee7dab028a2568e [0,2,0,0,0,0|2,0,0]=4 17167 B13R1.666 CSc1ccnc(c1)NCCCO 3c9a7a25579abc5d91f93ee692de264f [0,2,0,0,0,0|2,0,0]=4 17168 B13R1.666 FCCCNc1cc(ccn1)CCl b4a28035f02dd393ec214896336e16c6 [0,2,0,0,0,0|2,0,0]=4 17169 B13R1.666 FCCOCc1cccc(n1)CF feb2699144dba3fdb25257a0b25b4524 [0,2,0,0,0,0|2,0,0]=4 17170 B13R1.666 FCc1cccc(n1)COCCS 37422beade8503bb9354dfde5b57f02b [0,2,0,0,0,0|2,0,0]=4 17171 B13R1.666 FCc1ccnc(c1)NCCCCl 36ae1e1c7f05881cc1c7869c1a682e80 [0,2,0,0,0,0|2,0,0]=4 17172 B13R1.666 N#Cc1cccc(n1)CNCCBr 1e65f983ec85607c35fa5478c2f9f5fc [0,2,0,0,0,0|2,0,0]=4 17173 B13R1.666 N#Cc1cccc(n1)CNCCF 2fcd4c2592da85b30021aaed879da809 [0,2,0,0,0,0|2,0,0]=4 17174 B13R1.666 N#Cc1cccc(n1)CNCCI 68f2f6c26a06d3e18ed6f405ff18605d [0,2,0,0,0,0|2,0,0]=4 17175 B13R1.666 N#Cc1cccc(n1)CNCCO c9488079edca48a6cf3ee0edd985ce4d [0,2,0,0,0,0|2,0,0]=4 17176 B13R1.666 N#Cc1cccc(n1)CNCCS d50ca83a8ba0ed5a2272c98a83a7c6a4 [0,2,0,0,0,0|2,0,0]=4 17177 B13R1.666 N#Cc1cccc(n1)COCCF f6f40e622f2b6a41cd1add0227650a53 [0,2,0,0,0,0|2,0,0]=4 17178 B13R1.666 N#Cc1cccc(n1)COCCS 1a64c65b4ac5f36e55bc6e8da37f2fa2 [0,2,0,0,0,0|2,0,0]=4 17179 B13R1.666 N#Cc1cccc(n1)NCCCCl f12cc54f5b6f9a2495e78e56ae9182ab [0,2,0,0,0,0|2,0,0]=4 17180 B13R1.666 N#Cc1cccc(n1)NCCCF ac544c3ee5ce0d30853317954e8519ec [0,2,0,0,0,0|2,0,0]=4 17181 B13R1.666 N#Cc1cccc(n1)NCCCO ecd191f550706833c612b37b0fe91235 [0,2,0,0,0,0|2,0,0]=4 17182 B13R1.666 N#Cc1cccc(n1)NCCCS 25a0f00c571fd7f3fd9451094a3b1452 [0,2,0,0,0,0|2,0,0]=4 17183 B13R1.666 N#Cc1cccc(n1)OCCCF 12138878731080338a0b3f56475517a6 [0,2,0,0,0,0|2,0,0]=4 17184 B13R1.666 N#Cc1cccc(n1)OCCCS edb810ea772075a2b11b9ba2d5b483c1 [0,2,0,0,0,0|2,0,0]=4 17185 B13R1.666 N#Cc1ccnc(c1)CCOCF 5640eceb5578586d3e0e08419db3a1b0 [0,2,0,0,0,0|2,0,0]=4 17186 B13R1.666 N#Cc1ccnc(c1)COCCF 6ab61548739b727ef470e1772d9d45bd [0,2,0,0,0,0|2,0,0]=4 17187 B13R1.666 N#Cc1ccnc(c1)COCCS 633ba4d8458a02657a7b9e53dd2464c6 [0,2,0,0,0,0|2,0,0]=4 17188 B13R1.666 N#Cc1ccnc(c1)NCCCCl 0d2c9768405429efeadc592edf974201 [0,2,0,0,0,0|2,0,0]=4 17189 B13R1.666 N#Cc1ccnc(c1)NCCCF f6b257741d84002c1c85416266b202f2 [0,2,0,0,0,0|2,0,0]=4 17190 B13R1.666 N#Cc1ccnc(c1)NCCCO 8d7a2ad97a6cc4f19b40ea1b17611b29 [0,2,0,0,0,0|2,0,0]=4 17191 B13R1.666 N#Cc1ccnc(c1)NCCCS 576e7f27689146f44e4977220b315f08 [0,2,0,0,0,0|2,0,0]=4 17192 B13R1.666 N#Cc1ccnc(c1)OCCCF 26f3bacf2b0a04778f008bf4140ec488 [0,2,0,0,0,0|2,0,0]=4 17193 B13R1.666 N#Cc1ccnc(c1)OCCCS 1175c4bc3ea6245c407ecd67bda99458 [0,2,0,0,0,0|2,0,0]=4 17194 B13R1.666 O=Cc1cccc(n1)COCCF 7616fde1ce7fa63f5d73b1b418d76971 [0,2,0,0,0,0|2,0,0]=4 17195 B13R1.666 O=Cc1cccc(n1)COCCS 422897dbf4e23f4edced36eeca1c3ae9 [0,2,0,0,0,0|2,0,0]=4 17196 B13R1.666 O=Cc1cccc(n1)NCCCCl 9769b129bb17885033c0f37d336d9275 [0,2,0,0,0,0|2,0,0]=4 17197 B13R1.666 O=Cc1cccc(n1)NCCCF 22362a22403643762ce27758ab033765 [0,2,0,0,0,0|2,0,0]=4 17198 B13R1.666 O=Cc1cccc(n1)NCCCO 70e570cbc2ce4bd64d010db83cb08b8c [0,2,0,0,0,0|2,0,0]=4 17199 B13R1.666 O=Cc1cccc(n1)NCCCS fc9851f6458ef0f8a1dce9f0d98a4688 [0,2,0,0,0,0|2,0,0]=4 17200 B13R1.666 O=Cc1ccnc(c1)COCCF 6522cefc7b8df0de8bef5e484b7f1af9 [0,2,0,0,0,0|2,0,0]=4 17201 B13R1.666 O=Cc1ccnc(c1)COCCS c0b977072e3fabfdf03c0bb44fdee05b [0,2,0,0,0,0|2,0,0]=4 17202 B13R1.666 O=Cc1ccnc(c1)NCCCCl fc50f6119034d590daaa60cfb3a1cef0 [0,2,0,0,0,0|2,0,0]=4 17203 B13R1.666 O=Cc1ccnc(c1)NCCCO 078261fadce554b0a9d50db080db2df2 [0,2,0,0,0,0|2,0,0]=4 17204 B13R1.666 O=Cc1ccnc(c1)OCCCF 9c9eeabe2cc70625aadcf4fcf45edc14 [0,2,0,0,0,0|2,0,0]=4 17205 B13R1.666 O=Cc1ccnc(c1)OCCCS a61e363afe1878f50f14c8e2c2b44bfb [0,2,0,0,0,0|2,0,0]=4 17206 B13R1.666 OCCCNc1cc(ccn1)CCl 521d4dc7e62807632daef9526f234672 [0,2,0,0,0,0|2,0,0]=4 17207 B13R1.666 OCCCNc1cc(ccn1)CF 8fb3500b4dc9cc65cbdefec60f37859b [0,2,0,0,0,0|2,0,0]=4 17208 B13R1.666 OCCCNc1cc(ccn1)CO 28d003aa8ce2a11dcc4f154947dd651d [0,2,0,0,0,0|2,0,0]=4 17209 B13R1.666 OCCCNc1cccc(n1)CO a739d99d1d3f870ec9788cdc340cc857 [0,2,0,0,0,0|2,0,0]=4 17210 B13R1.666 OCCNCc1cccc(n1)CO 110054d31431fd7642ea8da1b3a00033 [0,2,0,0,0,0|2,0,0]=4 17211 B13R1.666 OCc1cccc(n1)CNCCBr acbf9c377a3697d8cc6c1103bef2e54a [0,2,0,0,0,0|2,0,0]=4 17212 B13R1.666 OCc1cccc(n1)CNCCF a140accd5c882b71cb71ef9264ec7f2c [0,2,0,0,0,0|2,0,0]=4 17213 B13R1.666 OCc1cccc(n1)CNCCI 948d8aa55328899e046d77706384929f [0,2,0,0,0,0|2,0,0]=4 17214 B13R1.666 OCc1cccc(n1)CNCCS 2086929ab244cce75a8f4637f5918adb [0,2,0,0,0,0|2,0,0]=4 17215 B13R1.666 OCc1cccc(n1)NCCCCl 87c44189316b052e970e8d7aee8e1311 [0,2,0,0,0,0|2,0,0]=4 17216 B13R1.666 OCc1cccc(n1)NCCCF 4d4dd01743deff84c7b1a22a01bafbb3 [0,2,0,0,0,0|2,0,0]=4 17217 B13R1.666 OCc1cccc(n1)NCCCS 94961092f35c2e49914142aac1bf2a77 [0,2,0,0,0,0|2,0,0]=4 17218 B13R1.666 OCc1ccnc(c1)NCCCCl 14b3ac25c3a4407c1f81da58636d6754 [0,2,0,0,0,0|2,0,0]=4 17219 B13R1.666 OCc1ccnc(c1)NCCCF e969b9415dfdd578c5c2487c22c63964 [0,2,0,0,0,0|2,0,0]=4 17220 B13R1.666 OCc1ccnc(c1)NCCCS b8fd333b6cc07689b426de16840fa21d [0,2,0,0,0,0|2,0,0]=4 17221 B13R1.666 SCCCNc1cc(ccn1)CCl 6046972fe9eb60709d3de77bac265dd7 [0,2,0,0,0,0|2,0,0]=4 17222 B13R1.26 C#CC(OCCC)c1ccccc1 dcc288e8d190b4f2b3075024bd10290b [0,2,0,0,0,0|2,0,0]=4 17223 B13R1.26 C#CC(OCCC)c1ccccn1 dd9c2e6c135313a13b28986aac8b9b62 [0,2,0,0,0,0|1,0,0]=3 17224 B13R1.26 C#CC(OCCF)c1ccccn1 ebc41df59b04aa799fbc12e2295b9665 [0,2,0,0,0,0|2,0,0]=4 17225 B13R1.26 C#CC(OCCS)c1ccccn1 75658ed115e4806dfee2a61399d86892 [0,2,0,0,0,0|2,0,0]=4 17226 B13R1.26 C#CC(OCOC)c1ccccn1 d98c929b24c2b2ea5f3947dc2b751dae [0,2,0,0,0,0|2,0,0]=4 17227 B13R1.26 C#CC(OCSC)c1ccccn1 3371e1f7a88bdca3084fc5d308b5ae35 [0,2,0,0,0,0|2,0,0]=4 17228 B13R1.26 C#C[C@@H](OCCC)c1ccccc1 1273ce1ca3c01032ab728f040e8552b8 [0,2,0,0,0,0|2,0,0]=4 17229 B13R1.26 C#C[C@H](OCCC)c1ccccc1 d74d2dc3bc00f68b8403823299532818 [0,2,0,0,0,0|2,0,0]=4 17230 B13R1.26 C=CC(NCCC)c1ccccc1 89435b3ec542c74f4618410d873c93db [0,2,0,0,0,0|2,0,0]=4 17231 B13R1.26 C=CC(OCCC)c1ccccc1 e2fdf572fe68a7b77d24fc77ef0e2376 [0,2,0,0,0,0|2,0,0]=4 17232 B13R1.26 C=C[C@@H](NCCC)c1ccccc1 4367550e004d9c40a227c61d5e4e5c49 [0,2,0,0,0,0|2,0,0]=4 17233 B13R1.26 C=C[C@H](NCCC)c1ccccc1 eb913afa2642a7dc634e95bf525336e7 [0,2,0,0,0,0|2,0,0]=4 17234 B13R1.26 CCC(COCF)c1ccccn1 d142a7df0a40c64834f31ced3e9d5453 [0,2,0,0,0,0|2,0,0]=4 17235 B13R1.26 CCC(NCCF)c1ccccn1 f54341ff23170fd2d5ed41dd287b1b2e [0,2,0,0,0,0|2,0,0]=4 17236 B13R1.26 CCC(NCCO)c1ccccn1 b52bc50a80dc95fe4d91f535c9cebb02 [0,2,0,0,0,0|2,0,0]=4 17237 B13R1.26 CCC(NCCS)c1ccccn1 0a0a92a9efafea9549c9a4906e6098af [0,2,0,0,0,0|2,0,0]=4 17238 B13R1.26 CCC(NCOC)c1ccccn1 50ea25fb4b9ed83f99697ead78b45126 [0,2,0,0,0,0|2,0,0]=4 17239 B13R1.26 CCC(NCSC)c1ccccn1 e3a7ff6f10481d479ffddb75dfba6cf5 [0,2,0,0,0,0|2,0,0]=4 17240 B13R1.26 CCCCN(C#N)c1ccccc1 2455021188b8f1c832c5e396070fc8f3 [0,2,0,0,0,0|2,0,0]=4 17241 B13R1.26 CCCCN(C=O)c1ccccc1 3f4748206aeba81d0167a4b2cec011f1 [0,2,0,0,0,0|2,0,0]=4 17242 B13R1.26 CCCCN(CC)c1ccccn1 38e6e8aeb5384800965fb26b6a230aa9 [0,2,0,0,0,0|1,0,0]=3 17243 B13R1.26 CCCCN(CC)c1cccnn1 ad97825abb84a27efb6de0c848f3f76f [0,2,0,0,0,0|2,0,0]=4 17244 B13R1.26 CCCCN(CC)c1cnccn1 36bd18ec6662ff30492500006b2be565 [0,2,0,0,0,0|2,0,0]=4 17245 B13R1.26 CCCCN(CC)c1ncccn1 aa033e21eb04ba1b957e9c159d169bb6 [0,2,0,0,0,0|2,0,0]=4 17246 B13R1.26 CCCCN(CF)c1ccccc1 4f220eafb9855256bba452cfb2d0b92c [0,2,0,0,0,0|2,0,0]=4 17247 B13R1.26 CCCNC(C#N)c1ccccc1 2b7ca7a6be4e13b883575a6f67491374 [0,2,0,0,0,0|2,0,0]=4 17248 B13R1.26 CCCNC(C=O)c1ccccc1 a9d865eede21a251ca86aba62b2c978e [0,2,0,0,0,0|2,0,0]=4 17249 B13R1.26 CCCNC(CC)c1ccccc1 57b82492286db168151e193d20f7132d [0,2,0,0,0,0|2,0,0]=4 17250 B13R1.26 CCCNC(CC)c1ccccn1 2f7422dff4aabf7298320c423f331dd6 [0,2,0,0,0,0|1,0,0]=3 17251 B13R1.26 CCCNC(CC)c1cnccn1 7a326e8969441bf5f87ca2d122d97be4 [0,2,0,0,0,0|2,0,0]=4 17252 B13R1.26 CCCNC(CC)c1ncccn1 7ff0439b0eb9fb9aa84a2fb678d21f3c [0,2,0,0,0,0|2,0,0]=4 17253 B13R1.26 CCCNC(CO)c1ccccc1 117ad37e3d581441e43789c848e8c34d [0,2,0,0,0,0|2,0,0]=4 17254 B13R1.26 CCCNC(CO)c1ccccn1 7bcdd048ad431762bfa3a490d34aff80 [0,2,0,0,0,0|1,0,0]=3 17255 B13R1.26 CCCN[C@@H](CC)c1ccccc1 b6f2cf87f587029f64d67b4f4bbd957c [0,2,0,0,0,0|2,0,0]=4 17256 B13R1.26 CCCN[C@@H](CC)c1ccccn1 103bc52cffca69305928c6a2d9d18c9e [0,2,0,0,0,0|1,0,0]=3 17257 B13R1.26 CCCN[C@@H](CF)c1ccccc1 c8bb9c003f1e82021556cab9f8bbec34 [0,2,0,0,0,0|2,0,0]=4 17258 B13R1.26 CCCN[C@@H](CO)c1ccccc1 b58d20706c65aab2d0af6149b8724974 [0,2,0,0,0,0|2,0,0]=4 17259 B13R1.26 CCCN[C@H](CC)c1ccccc1 b5dfa6c7f63b627d52458b08bd2cf253 [0,2,0,0,0,0|2,0,0]=4 17260 B13R1.26 CCCN[C@H](CC)c1ccccn1 509bf16319e6d065d265cff005af9eae [0,2,0,0,0,0|1,0,0]=3 17261 B13R1.26 CCCN[C@H](CO)c1ccccc1 da6248e2b95c39b8cd16562af1391178 [0,2,0,0,0,0|2,0,0]=4 17262 B13R1.26 CCCOC(C#N)c1ccccc1 d5acd267bdbb34561413331016f8aa92 [0,2,0,0,0,0|2,0,0]=4 17263 B13R1.26 CCCOC(CC)c1ccccc1 386e882a562a78a36cb1f7db4b9582fe [0,2,0,0,0,0|2,0,0]=4 17264 B13R1.26 CCCOC(CF)c1ccccc1 778fa439d34b8cf619166518cbc4be13 [0,2,0,0,0,0|2,0,0]=4 17265 B13R1.26 CCCO[C@@H](C#N)c1ccccc1 1de7e66b61bda39f65b117aa9042d733 [0,2,0,0,0,0|2,0,0]=4 17266 B13R1.26 CCCO[C@@H](CC)c1ccccc1 d141b7596330092af1578ccdeb86f1c9 [0,2,0,0,0,0|2,0,0]=4 17267 B13R1.26 CCCO[C@H](CC)c1ccccc1 2d89d74041ebd27623bd5bbb107e0a8b [0,2,0,0,0,0|2,0,0]=4 17268 B13R1.26 CCCO[C@H](CF)c1ccccc1 95b4751da110bf096d4694ac905ea12a [0,2,0,0,0,0|2,0,0]=4 17269 B13R1.26 CCN(CCCF)c1ccccn1 89038432459dc29a02c2a02c332c119b [0,2,0,0,0,0|2,0,0]=4 17270 B13R1.26 CCN(CCCO)c1ccccn1 473df1a571d64077a904a55c1d018b1c [0,2,0,0,0,0|2,0,0]=4 17271 B13R1.26 CCN(CCOC)c1ccccn1 f36d266f565001b0dbc06b6b314abf4f [0,2,0,0,0,0|2,0,0]=4 17272 B13R1.26 CCNCC(CO)c1ccccc1 08e41d1a29205978ead522b72d7c83cc [0,2,0,0,0,0|2,0,0]=4 17273 B13R1.26 CCOCC(C#N)c1ccccc1 b8d6824b68de6c7bd4674c9dd20b24bc [0,2,0,0,0,0|2,0,0]=4 17274 B13R1.26 CCOCC(CC)c1ccccc1 bbe4e3553f9e2e9733717aa13f476854 [0,2,0,0,0,0|2,0,0]=4 17275 B13R1.26 CCOCC(CC)c1ccccn1 5466e9a0490487ca7280fc5da4a3dcd8 [0,2,0,0,0,0|1,0,0]=3 17276 B13R1.26 CCOCC(OC)c1ccccc1 c58305f87ed21f5c0d8dc203586fba37 [0,2,0,0,0,0|2,0,0]=4 17277 B13R1.26 CCOC[C@H](OC)c1ccccc1 990c6077184864a7e47e982f06ad42df [0,2,0,0,0,0|2,0,0]=4 17278 B13R1.26 CC[C@@H](NCCF)c1ccccn1 a4a507c765ecec394951bae985024073 [0,2,0,0,0,0|2,0,0]=4 17279 B13R1.26 CC[C@@H](NCCO)c1ccccn1 30830f236497c3a8181852ebd3886af3 [0,2,0,0,0,0|2,0,0]=4 17280 B13R1.26 CC[C@@H](NCCS)c1ccccn1 070c823ba73cf34b1de3d270e88a6f9c [0,2,0,0,0,0|2,0,0]=4 17281 B13R1.26 CC[C@@H](NCOC)c1ccccn1 86f58128c2b85426cfe87f539fc9047e [0,2,0,0,0,0|2,0,0]=4 17282 B13R1.26 CC[C@@H](NCSC)c1ccccn1 b247407e2544f7281150933847064b9b [0,2,0,0,0,0|2,0,0]=4 17283 B13R1.26 CC[C@H](NCCF)c1ccccn1 ef0f88c5dd21962248e0377e0921a66c [0,2,0,0,0,0|2,0,0]=4 17284 B13R1.26 CC[C@H](NCCO)c1ccccn1 3a423fb187fa799aa19a2ab896ab3526 [0,2,0,0,0,0|2,0,0]=4 17285 B13R1.26 CC[C@H](NCCS)c1ccccn1 8d7562dcfae8a2566fc33e729848fa56 [0,2,0,0,0,0|2,0,0]=4 17286 B13R1.26 CC[C@H](NCOC)c1ccccn1 9572c1c24ab533fa5af7e192936be7ab [0,2,0,0,0,0|2,0,0]=4 17287 B13R1.26 CC[C@H](NCSC)c1ccccn1 f16164c99da0fb3490bf210d37826cfc [0,2,0,0,0,0|2,0,0]=4 17288 B13R1.26 COCCN(C=O)c1ccccn1 677bcbaf077be9c7a903d70629cf3332 [0,2,0,0,0,0|2,0,0]=4 17289 B13R1.26 COCNC(CO)c1ccccn1 84bd74e8810319890cfc78d8e3527447 [0,2,0,0,0,0|2,0,0]=4 17290 B13R1.26 CSCNC(CO)c1ccccn1 eb41aa1ffa36bf79f23a99481f04c7a3 [0,2,0,0,0,0|2,0,0]=4 17291 B13R1.26 OCC(NCCF)c1ccccn1 2f9c61a44cee6c68a3559310fe1447f8 [0,2,0,0,0,0|2,0,0]=4 17292 B13R1.26 OCC(NCCS)c1ccccn1 287fdff7b4c150cce705437b7e3f2be4 [0,2,0,0,0,0|2,0,0]=4 17293 B13R1.26 OCCNC(CO)c1ccccn1 42a7fd649f1d7e56aa6a331c9053a2f1 [0,2,0,0,0,0|2,0,0]=4 17294 B13R1.45 C=C(C)CCN(C)c1ccccn1 4f3ec83fd628b69409c823513ad10421 [0,2,0,0,0,0|1,0,1]=4 17295 B13R1.45 C=C(C)CNC(C)c1ccccn1 0a6615accd775fc021800fb0551990d8 [0,2,0,0,0,0|1,0,1]=4 17296 B13R1.45 C=C(C)CN[C@@H](C)c1ccccn1 304bede64ee3902429c0f874cc8df5b2 [0,2,0,0,0,0|1,0,1]=4 17297 B13R1.45 C=C(C)CN[C@H](C)c1ccccn1 381b1e13e5a24cd47ec5a5be87471d48 [0,2,0,0,0,0|1,0,1]=4 17298 B13R1.45 C=C(C)COC(C)c1ccccn1 5717be43b59d26fdd99aa1bedf55dc3b [0,2,0,0,0,0|1,0,1]=4 17299 B13R1.45 C=C(C)CO[C@@H](C)c1ccccn1 f93916f1be3b576f5e2ff414e2e7b4d7 [0,2,0,0,0,0|1,0,1]=4 17300 B13R1.45 C=C(C)CO[C@H](C)c1ccccn1 70334158ca8aa6f13773e49fa7a5ce16 [0,2,0,0,0,0|1,0,1]=4 17301 B13R1.45 C=C(COC(C)C)c1ccccn1 8bb0ad4e46a78ab019e0af242ea6e922 [0,2,0,0,0,0|1,0,1]=4 17302 B13R1.45 CC(=O)CNC(C)c1ccccn1 38c58e1441a04c877db17fab9306c43f [0,2,0,0,0,0|1,0,1]=4 17303 B13R1.45 CC(=O)NCC(O)c1ccccn1 c375421136f21f2463522a716f5ae893 [0,2,0,0,0,0|1,0,1]=4 17304 B13R1.45 CC(C)CCN(C)c1ccccc1 ee25433740b2055fca5a498af1d6b40b [0,2,0,0,0,0|2,0,0]=4 17305 B13R1.45 CC(C)CCN(C)c1ccccn1 1e8fc883dee4bd43a48709e0440afe70 [0,2,0,0,0,0|1,0,0]=3 17306 B13R1.45 CC(C)CCN(C)c1cccnn1 fba452cfc70d4b1e6b3c1e1b76263a65 [0,2,0,0,0,0|2,0,0]=4 17307 B13R1.45 CC(C)CCN(C)c1ccncn1 9be2d6850c98d1a07623520386726282 [0,2,0,0,0,0|2,0,0]=4 17308 B13R1.45 CC(C)CCN(C)c1cnccn1 7c735068c4597320aad677ce4ce36762 [0,2,0,0,0,0|2,0,0]=4 17309 B13R1.45 CC(C)CCN(C)c1ncccn1 4b89fddd21ed3d0d119c81af23c5c875 [0,2,0,0,0,0|2,0,0]=4 17310 B13R1.45 CC(C)CNC(=O)c1ccccn1 627ac570d4ba0e558d4fdfedf4d085a5 [0,2,0,0,0,0|1,0,1]=4 17311 B13R1.45 CC(C)CNC(C)c1ccccc1 1a8ed7a47c47c28fcbae58c50dcc8cfb [0,2,0,0,0,0|2,0,0]=4 17312 B13R1.45 CC(C)CNC(C)c1ccccn1 b9b473423ccb43dda9cac20952f57ebd [0,2,0,0,0,0|1,0,0]=3 17313 B13R1.45 CC(C)CNC(C)c1cccnn1 6553414bab6a836fa0f5d75b79bc7bcf [0,2,0,0,0,0|2,0,0]=4 17314 B13R1.45 CC(C)CNC(C)c1ccncn1 8e71c3c70f6fbdf851736d7c28d5a38b [0,2,0,0,0,0|2,0,0]=4 17315 B13R1.45 CC(C)CNC(C)c1cnccn1 9e3e6b199d0ecd481cd2290dad99e8af [0,2,0,0,0,0|2,0,0]=4 17316 B13R1.45 CC(C)CNC(C)c1ncccn1 7c13c596eba0a41a178f85a8052b8774 [0,2,0,0,0,0|2,0,0]=4 17317 B13R1.45 CC(C)CN[C@@H](C)c1ccccc1 0e1d1975e0dee5224fe5ca3cbd45c906 [0,2,0,0,0,0|2,0,0]=4 17318 B13R1.45 CC(C)CN[C@@H](C)c1ccccn1 5967780310b6920d3779f1a80363a7ca [0,2,0,0,0,0|1,0,0]=3 17319 B13R1.45 CC(C)CN[C@H](C)c1ccccc1 3b8e4ab918a68755a3dd66398362cf93 [0,2,0,0,0,0|2,0,0]=4 17320 B13R1.45 CC(C)CN[C@H](C)c1ccccn1 4fb2ea94530cbeaffeb62e91d426522f [0,2,0,0,0,0|1,0,0]=3 17321 B13R1.45 CC(C)COC(C)c1ccccc1 a431719ff60ac10602452d9f6000ed98 [0,2,0,0,0,0|2,0,0]=4 17322 B13R1.45 CC(C)COC(C)c1ccccn1 59003c839906b252274a4700c77accc0 [0,2,0,0,0,0|1,0,0]=3 17323 B13R1.45 CC(C)COC(C)c1cccnn1 4bdfbbe820932950660d04ad89622d58 [0,2,0,0,0,0|2,0,0]=4 17324 B13R1.45 CC(C)COC(C)c1cnccn1 2c1d1f2838a2322350c3d07d63aa9abb [0,2,0,0,0,0|2,0,0]=4 17325 B13R1.45 CC(C)COC(C)c1ncccn1 838a706937b52437891e8dd4347f52ec [0,2,0,0,0,0|2,0,0]=4 17326 B13R1.45 CC(C)CO[C@@H](C)c1ccccc1 c918fde3f01335c4594a3cdd44a5c245 [0,2,0,0,0,0|2,0,0]=4 17327 B13R1.45 CC(C)CO[C@@H](C)c1ccccn1 22586d40f699e7b28a0e9b933e901462 [0,2,0,0,0,0|1,0,0]=3 17328 B13R1.45 CC(C)CO[C@@H](C)c1ccncn1 77e21ca828a3affd86406f586c2ce158 [0,2,0,0,0,0|2,0,0]=4 17329 B13R1.45 CC(C)CO[C@@H](C)c1cnccn1 18d9e632806366e6bfbef0ac76a1880a [0,2,0,0,0,0|2,0,0]=4 17330 B13R1.45 CC(C)CO[C@@H](C)c1ncccn1 4c87e169f334419a5ef22c091dbc18f4 [0,2,0,0,0,0|2,0,0]=4 17331 B13R1.45 CC(C)CO[C@H](C)c1ccccc1 76f93aeb672136c41969299f8af62234 [0,2,0,0,0,0|2,0,0]=4 17332 B13R1.45 CC(C)CO[C@H](C)c1ccccn1 8565820cc34943603f10b017d1e738f0 [0,2,0,0,0,0|1,0,0]=3 17333 B13R1.45 CC(C)CO[C@H](C)c1cccnn1 94858cff1c5b9171f0ae2b9bbbecaf9f [0,2,0,0,0,0|2,0,0]=4 17334 B13R1.45 CC(C)CO[C@H](C)c1cnccn1 31a1499119c66fde122b3422f520e6da [0,2,0,0,0,0|2,0,0]=4 17335 B13R1.45 CC(C)CO[C@H](C)c1ncccn1 14fb1486746d64a1833679b44d3377f1 [0,2,0,0,0,0|2,0,0]=4 17336 B13R1.45 CC(C)NCC(O)c1ccccn1 b8e7bb67a47895ae90dd5feb96033573 [0,2,0,0,0,0|1,0,0]=3 17337 B13R1.45 CC(C)OCC(=O)c1ccccn1 74c26af87c69a072f7a6a2c687982025 [0,2,0,0,0,0|1,0,1]=4 17338 B13R1.45 CC(C)OCC(C)c1ccccc1 ec931c631196ee710bfc24252b11b1e8 [0,2,0,0,0,0|2,0,0]=4 17339 B13R1.45 CC(C)OCC(C)c1ccccn1 ae638a71b222725299f4febcb292b4a2 [0,2,0,0,0,0|1,0,0]=3 17340 B13R1.45 CC(C)OCN(C)c1ccccn1 5e3bbada377976b684775e1239e05186 [0,2,0,0,0,0|2,0,0]=4 17341 B13R1.45 CC(C)OC[C@@H](C)c1ccccc1 dc86bab03a7acc808db6858717777ba4 [0,2,0,0,0,0|2,0,0]=4 17342 B13R1.45 CC(NCC(F)F)c1ccccn1 5c3ff0c1c2fd8aa9b04843d49dff09b9 [0,2,0,0,0,0|2,0,0]=4 17343 B13R1.45 CC(NCN(C)C)c1ccccn1 ac95649fb8bbf0f3ec015655008d3fe9 [0,2,0,0,0,0|2,0,0]=4 17344 B13R1.45 CC(NC[C@@H](C)O)c1ccccn1 45f7621c2933898635d0bea9ab5e9398 [0,2,0,0,0,0|1,0,0]=3 17345 B13R1.45 CC(NC[C@@H](C)O)c1ccncn1 1695abd99744820cb5a1db9bd7543440 [0,2,0,0,0,0|2,0,0]=4 17346 B13R1.45 CC(NC[C@@H](C)O)c1cnccn1 9eb882fb04dada17811c9a12bee3b779 [0,2,0,0,0,0|2,0,0]=4 17347 B13R1.45 CC(NC[C@@H](C)O)c1ncccn1 bfd2783b2cf5f847de75eb2cad82539c [0,2,0,0,0,0|2,0,0]=4 17348 B13R1.45 CC(NC[C@H](C)O)c1ccccc1 654fe78be9da3356fceacec64527fef5 [0,2,0,0,0,0|2,0,0]=4 17349 B13R1.45 CC(NC[C@H](C)O)c1ccccn1 509e94e47c7a67ce91aebeffe431ad06 [0,2,0,0,0,0|1,0,0]=3 17350 B13R1.45 CC(NC[C@H](C)O)c1cccnn1 059e37f47c50568cbab7b027c68cf00d [0,2,0,0,0,0|2,0,0]=4 17351 B13R1.45 CC(NC[C@H](C)O)c1ccncn1 540bbfd6e3e314ff0747abe3110e4b51 [0,2,0,0,0,0|2,0,0]=4 17352 B13R1.45 CC(NC[C@H](C)O)c1cnccn1 1e575d38548859e36bc828a77771fcf8 [0,2,0,0,0,0|2,0,0]=4 17353 B13R1.45 CC(NC[C@H](C)O)c1ncccn1 6bf5b45e2e5b4fa358205f4205473dc2 [0,2,0,0,0,0|2,0,0]=4 17354 B13R1.45 CC(O)CCN(C)c1ccccc1 67f8cb5e20b8e2eb9a338d1aa9237e41 [0,2,0,0,0,0|2,0,0]=4 17355 B13R1.45 CC(O)CCN(C)c1ccccn1 5602f79dc3b02c4743227f78f17dfb19 [0,2,0,0,0,0|1,0,0]=3 17356 B13R1.45 CC(O)CCN(C)c1cccnn1 f9318aac58c75f3b09f8aa1dbac9993a [0,2,0,0,0,0|2,0,0]=4 17357 B13R1.45 CC(O)CCN(C)c1ccncn1 2b57dd05ddf461a7cdacd9d3867201c3 [0,2,0,0,0,0|2,0,0]=4 17358 B13R1.45 CC(O)CCN(C)c1cnccn1 227466840c98047a7379798e0ff54df7 [0,2,0,0,0,0|2,0,0]=4 17359 B13R1.45 CC(O)CCN(C)c1ncccn1 9b24def23727f5cbf9a5266310cec32a [0,2,0,0,0,0|2,0,0]=4 17360 B13R1.45 CC(O)CNC(=O)c1ccccn1 f8123eccef02603d277cf8a0b8b2f312 [0,2,0,0,0,0|1,0,1]=4 17361 B13R1.45 CC(O)CNC(C)c1ccccc1 d9f0bebfc19dc692825c4559fb9aaa87 [0,2,0,0,0,0|2,0,0]=4 17362 B13R1.45 CC(O)CNC(C)c1ccccn1 96939f7b9b26d6397db9b2181611e4af [0,2,0,0,0,0|1,0,0]=3 17363 B13R1.45 CC(O)CNC(C)c1cccnn1 539f7a44926b3c82a46442ad057f1672 [0,2,0,0,0,0|2,0,0]=4 17364 B13R1.45 CC(O)CNC(C)c1ccncn1 7ce7055e97e1c1128d8e093a3a31d4b4 [0,2,0,0,0,0|2,0,0]=4 17365 B13R1.45 CC(O)CNC(C)c1cnccn1 776e18b5ad7195508399f60eb800635e [0,2,0,0,0,0|2,0,0]=4 17366 B13R1.45 CC(O)CNC(C)c1ncccn1 a4fcc2bcb2f99e4838161a4d84906618 [0,2,0,0,0,0|2,0,0]=4 17367 B13R1.45 CC(O)CN[C@@H](C)c1ccccc1 d44e88f4801ca53bc9b4acefbb4d6214 [0,2,0,0,0,0|2,0,0]=4 17368 B13R1.45 CC(O)CN[C@@H](C)c1ccccn1 eb7c6796fcfab5269977209e98811d90 [0,2,0,0,0,0|1,0,0]=3 17369 B13R1.45 CC(O)CN[C@H](C)c1ccccc1 7ddf90be408fb1d3293ac51ba0725863 [0,2,0,0,0,0|2,0,0]=4 17370 B13R1.45 CC(O)CN[C@H](C)c1ccccn1 d3cc2b2307f58a377135a74583264819 [0,2,0,0,0,0|1,0,0]=3 17371 B13R1.45 CC(OCC(F)F)c1ccccn1 3d45e28a93dcd8b230f6afb41cb9bb29 [0,2,0,0,0,0|2,0,0]=4 17372 B13R1.45 CC(OCN(C)C)c1ccccn1 8356abf38c6ab5d622fe088c0839a63c [0,2,0,0,0,0|2,0,0]=4 17373 B13R1.45 CN(C)CCN(C)c1ccccn1 5bc4c71b0a976f524dd88a006eb0cd13 [0,2,0,0,0,0|2,0,0]=4 17374 B13R1.45 CN(CCS(=O)C)c1ccccn1 b13f0db2010a5b2f195aa08d06823eaa [0,2,0,0,0,0|2,0,0]=4 17375 B13R1.45 C[C@@H](NCC(F)F)c1ccccn1 b5317dd659414942f81b9e5c5987f5c9 [0,2,0,0,0,0|2,0,0]=4 17376 B13R1.45 C[C@@H](NCN(C)C)c1ccccn1 6c46d9280935701369892fa2dae3607c [0,2,0,0,0,0|2,0,0]=4 17377 B13R1.45 C[C@@H](O)CNC(=O)c1ccccn1 680b684ff3760aefb6e8965f481f2328 [0,2,0,0,0,0|1,0,1]=4 17378 B13R1.45 C[C@@H](O)CN[C@H](C)c1ccccn1 c6b042514ddcdbc7d442f1a85d3df54a [0,2,0,0,0,0|1,0,0]=3 17379 B13R1.45 C[C@@H](OCC(F)F)c1ccccn1 8e17a8c2fb79ec70615c6e68648b09e8 [0,2,0,0,0,0|2,0,0]=4 17380 B13R1.45 C[C@@H](OCN(C)C)c1ccccn1 f902e5f82d28e73e555724560711fdec [0,2,0,0,0,0|2,0,0]=4 17381 B13R1.45 C[C@H](NCC(F)F)c1ccccn1 f5cd309695de05a6d7a8a4b418dc45ef [0,2,0,0,0,0|2,0,0]=4 17382 B13R1.45 C[C@H](NCN(C)C)c1ccccn1 ac21b399eadb99b66c511f538712d55b [0,2,0,0,0,0|2,0,0]=4 17383 B13R1.45 C[C@H](NC[C@@H](C)O)c1ccccn1 219667447845e4caa3cb2fd4615ed7ed [0,2,0,0,0,0|1,0,0]=3 17384 B13R1.45 C[C@H](O)CNC(=O)c1ccccn1 307f363213be1a66d9dcc7c1afe64983 [0,2,0,0,0,0|1,0,1]=4 17385 B13R1.45 C[C@H](O)CN[C@@H](C)c1ccccc1 8fabeb4c3dfe1b581cc19234d70d27b9 [0,2,0,0,0,0|2,0,0]=4 17386 B13R1.45 C[C@H](O)CN[C@@H](C)c1ccccn1 db69911a578dad99f8fc3c81818aa469 [0,2,0,0,0,0|1,0,0]=3 17387 B13R1.45 C[C@H](O)CN[C@H](C)c1ccccc1 ef252d9e63a8f57f8c20b7f73c95cbf4 [0,2,0,0,0,0|2,0,0]=4 17388 B13R1.45 C[C@H](O)CN[C@H](C)c1ccccn1 55c13f013b3734632c8fa44503860238 [0,2,0,0,0,0|1,0,0]=3 17389 B13R1.45 C[C@H](OCC(F)F)c1ccccn1 45f93db0359699d64c6deed63f186ca5 [0,2,0,0,0,0|2,0,0]=4 17390 B13R1.45 C[C@H](OCN(C)C)c1ccccn1 510075bc4f799456095871281e7b0b47 [0,2,0,0,0,0|2,0,0]=4 17391 B13R1.47 CC(CCO)N(C)c1ccccn1 8c666feac8c2e455b06e91723acf5519 [0,2,0,0,0,0|2,0,0]=4 17392 B13R1.47 CC(c1ccccn1)N(C)CCF 76878aa536f41e38bf3e339aa59589df [0,2,0,0,0,0|2,0,0]=4 17393 B13R1.47 CC(c1ccccn1)N(C)CCS 449fdef5648e05c1eee082a43a184df8 [0,2,0,0,0,0|2,0,0]=4 17394 B13R1.47 CCCC(=O)N(C)c1ccccn1 e9d8342e20adf834783ec2fb0ca7d4e6 [0,2,0,0,0,0|1,0,1]=4 17395 B13R1.47 CCCC(C)N(C)c1ccncn1 8e63bc2ee6c1ea03678f26ed899e7e91 [0,2,0,0,0,0|2,0,0]=4 17396 B13R1.47 CCCC(C)N(C)c1cnccn1 3b88bd1dd3eab8a00f2478924f39eff1 [0,2,0,0,0,0|2,0,0]=4 17397 B13R1.47 CCCC(C)N(C)c1ncccn1 6be5c3e4321c00a394da322b852bbff3 [0,2,0,0,0,0|2,0,0]=4 17398 B13R1.47 CCCN(C)C(=O)c1ccccn1 3dcd8b251b461cbafb203a08e455a01f [0,2,0,0,0,0|1,0,1]=4 17399 B13R1.47 CCCN(C)C(C)c1ccccn1 36d594dacd9fc57df30b5e41f8fab5cd [0,2,0,0,0,0|1,0,0]=3 17400 B13R1.47 CCCN(C)C(C)c1ccncn1 35c9c68cf9dde56888e276c53318ecae [0,2,0,0,0,0|2,0,0]=4 17401 B13R1.47 COCC(C)N(C)c1ccccn1 dd4afcf4036238f1e4101e08f3cbba8d [0,2,0,0,0,0|2,0,0]=4 17402 B13R1.47 COCN(C)C(C)c1ccccn1 f7578e27504d5e126ddf4f03d9443c5d [0,2,0,0,0,0|2,0,0]=4 17403 B13R1.47 CSCN(C)C(C)c1ccccn1 21dda18c793c97a87de63311256233f3 [0,2,0,0,0,0|2,0,0]=4 17404 B13R1.122 CC(C)(CNCF)c1ccccn1 c0b15748fdd1db656002f83bd84e9d1f [0,2,0,0,0,0|2,0,0]=4 17405 B13R1.122 CC(C)(CNCO)c1ccccn1 b77085b16ac3609565d2cfbe1a0944e8 [0,2,0,0,0,0|2,0,0]=4 17406 B13R1.122 CC(C)(NCCF)c1ccccn1 a1582d432ff0d51d67dc725986177003 [0,2,0,0,0,0|2,0,0]=4 17407 B13R1.122 CC(C)(NCCO)c1ccccn1 5e8a32a2e99711654ce6fc748d62ab9e [0,2,0,0,0,0|2,0,0]=4 17408 B13R1.122 CC(C)(NCCS)c1ccccn1 b6da938733ed6819e7f0e26f3326335e [0,2,0,0,0,0|2,0,0]=4 17409 B13R1.122 CC(C)(OCCF)c1ccccn1 629838aa40d2e974b0694cb9471382b3 [0,2,0,0,0,0|2,0,0]=4 17410 B13R1.122 CC(C)(OCCS)c1ccccn1 7845459f37edb6c2ea5bef6ac755927e [0,2,0,0,0,0|2,0,0]=4 17411 B13R1.122 CCCNC(C)(C)c1ccccc1 a6c4aeaec8f5bd90fdbaf4b075ca449b [0,2,0,0,0,0|2,0,0]=4 17412 B13R1.122 CCCNC(C)(C)c1ccccn1 285461c65242e922549ab572d66a9c2d [0,2,0,0,0,0|1,0,0]=3 17413 B13R1.122 CCCOC(C)(C)c1ccccc1 c000b7a92c399df823ae951993caedab [0,2,0,0,0,0|2,0,0]=4 17414 B13R1.122 CCCOC(C)(C)c1ccccn1 8d040de4e857c415500edad50078267f [0,2,0,0,0,0|1,0,0]=3 17415 B13R1.122 CCCOC(C)(C)c1ncccn1 7e27903772cc376113337cadd5053b8a [0,2,0,0,0,0|2,0,0]=4 17416 B13R1.122 CCNCC(C)(C)c1ccccn1 e0cf4870f9dbc768909c79e7b3109319 [0,2,0,0,0,0|1,0,0]=3 17417 B13R1.122 CCNCC(C)(O)c1ccccc1 5e995bce1c7ec0c94cd070bbf2e41d21 [0,2,0,0,0,0|2,0,0]=4 17418 B13R1.122 CCNCC(F)(F)c1ccccc1 ccd818b88bf408e4711bb41ceb66fa37 [0,2,0,0,0,0|2,0,0]=4 17419 B13R1.122 CCNCC(F)(F)c1ccccn1 5721061ec2934a7af82b5e7a29c1edc0 [0,2,0,0,0,0|1,0,0]=3 17420 B13R1.122 CCOCC(F)(F)c1ccccc1 0cfd996cdc4f0d33d5ca96cfaa5ee80b [0,2,0,0,0,0|2,0,0]=4 17421 B13R1.122 CCOCC(F)(F)c1ccccn1 03c7d94a7dd94c1a4767d1cfe9554b60 [0,2,0,0,0,0|1,0,0]=3 17422 B13R1.122 COCNC(C)(C)c1ccccn1 44a536b8087865803cbc2f59a47f9050 [0,2,0,0,0,0|2,0,0]=4 17423 B13R1.122 COCOC(C)(C)c1ccccn1 b22788e6bd80ebc2cf26253b7f659a1c [0,2,0,0,0,0|2,0,0]=4 17424 B13R1.122 CSCNC(C)(C)c1ccccn1 2a3a11a8c335d29b67731da902d86f16 [0,2,0,0,0,0|2,0,0]=4 17425 B13R1.122 CSCOC(C)(C)c1ccccn1 f74e244ce779dc133d96adee459eb4b7 [0,2,0,0,0,0|2,0,0]=4 17426 B13R1.122 FCNCC(F)(F)c1ccccn1 26c01845f8bd2b6a1797a38ff5bb4691 [0,2,0,0,0,0|2,0,0]=4 17427 B13R1.122 FCOCC(F)(F)c1ccccn1 53b0db8001aa588fc5e68c3eb0947458 [0,2,0,0,0,0|2,0,0]=4 17428 B13R1.122 OCNCC(F)(F)c1ccccn1 7deb4000de09a8cfa57b5fe5056812d6 [0,2,0,0,0,0|2,0,0]=4 17429 B13R1.674 CC(OCCF)c1ncccc1Cl 09cf3a6fbe9be71eb705382ef47bfaa8 [0,2,0,0,0,0|2,0,0]=4 17430 B13R1.674 CC(OCCF)c1ncccc1F b8393235d17a3285c795702d4561a627 [0,2,0,0,0,0|2,0,0]=4 17431 B13R1.674 CC(OCCS)c1ncccc1Br 8b937593475211de3700317405639374 [0,2,0,0,0,0|2,0,0]=4 17432 B13R1.674 CC(OCCS)c1ncccc1Cl c3e26812ccfb21aec4d871ed4b9da979 [0,2,0,0,0,0|2,0,0]=4 17433 B13R1.674 CC(OCCS)c1ncccc1F 5ecadd192fc89b9e3ebd5164d51f818d [0,2,0,0,0,0|2,0,0]=4 17434 B13R1.674 CCCCN(C)c1ccccc1C 7ed1035b8bfefd275129df1266bfe405 [0,2,0,0,0,0|2,0,0]=4 17435 B13R1.674 CCCCN(C)c1ccccc1Cl fa551463dbdfce838b6ac24928a509cb [0,2,0,0,0,0|2,0,0]=4 17436 B13R1.674 CCCCN(C)c1ccccc1F 4c62f809c3232d81dfeac9cbd8598465 [0,2,0,0,0,0|2,0,0]=4 17437 B13R1.674 CCCCN(C)c1ncccc1Br 68ac4a71364c90c2133abb8e9c239da0 [0,2,0,0,0,0|1,0,0]=3 17438 B13R1.674 CCCCN(C)c1ncccc1C 8f896260edfc43c2ee4a267206b8d5e9 [0,2,0,0,0,0|1,0,0]=3 17439 B13R1.674 CCCCN(C)c1ncccc1Cl efc915000a794df954c1c28edeeaca73 [0,2,0,0,0,0|1,0,0]=3 17440 B13R1.674 CCCCN(C)c1ncccc1F ba6a39ed485d87abd58b04e798a06a65 [0,2,0,0,0,0|1,0,0]=3 17441 B13R1.674 CCCCN(C)c1ncccc1I de738f0d04b2e9641a17ed293b67de69 [0,2,0,0,0,0|1,0,0]=3 17442 B13R1.674 CCCCN(C)c1nccnc1C f00c2ddeac0cd85c93dde078cc792b0c [0,2,0,0,0,0|2,0,0]=4 17443 B13R1.674 CCCCN(C)c1nccnc1Cl e6800ef68b8d8dd858efc9ce494229c7 [0,2,0,0,0,0|2,0,0]=4 17444 B13R1.674 CCCCN(C)c1ncncc1Br 3fc4245c619d86a62dc6c99df0ea4171 [0,2,0,0,0,0|2,0,0]=4 17445 B13R1.674 CCCCN(C)c1ncncc1Cl a757f53de2f89a8084146cf25a5d804c [0,2,0,0,0,0|2,0,0]=4 17446 B13R1.674 CCCCN(C)c1ncncc1F 4f2cd1e22fb501fcafc50c27e2a737e9 [0,2,0,0,0,0|2,0,0]=4 17447 B13R1.674 CCCCN(C)c1nnccc1Br 2bc8d6fc1e0ca4eba52e71deba1d34fc [0,2,0,0,0,0|2,0,0]=4 17448 B13R1.674 CCCNC(=O)c1ncccc1Br e8d4c63769fc07fceacd43071ca8f8a8 [0,2,0,0,0,0|1,0,1]=4 17449 B13R1.674 CCCNC(=O)c1ncccc1C bacc0f64f25f3d36482cf9d3b3885d96 [0,2,0,0,0,0|1,0,1]=4 17450 B13R1.674 CCCNC(=O)c1ncccc1Cl dc3688ee8e0f46748f3cd7c51ab21088 [0,2,0,0,0,0|1,0,1]=4 17451 B13R1.674 CCCNC(=O)c1ncccc1F b3df00c386674725ec088295e2c6b2bc [0,2,0,0,0,0|1,0,1]=4 17452 B13R1.674 CCCNC(=O)c1ncccc1I 17f4509918bbeed225c19550fad18958 [0,2,0,0,0,0|1,0,1]=4 17453 B13R1.674 CCCNC(=O)c1ncccc1O f9a00bd1d7e44eb90343ead7e8586729 [0,2,0,0,0,0|1,0,1]=4 17454 B13R1.674 CCCNC(C)c1ccccc1C 33be9baf117983aef9d9f283b2bb65aa [0,2,0,0,0,0|2,0,0]=4 17455 B13R1.674 CCCNC(C)c1ccccc1Cl 51b6e2e4caa050a3f4af22c4aad8ad4a [0,2,0,0,0,0|2,0,0]=4 17456 B13R1.674 CCCNC(C)c1ccccc1F ad53cf6edc8574870385edeac0402c5e [0,2,0,0,0,0|2,0,0]=4 17457 B13R1.674 CCCNC(C)c1ccccc1I 1942c3f92993619e019c7dd7bf2bf557 [0,2,0,0,0,0|2,0,0]=4 17458 B13R1.674 CCCNC(C)c1ncccc1C f31004dc8d14c059f9d76e86ff830638 [0,2,0,0,0,0|1,0,0]=3 17459 B13R1.674 CCCN[C@@H](C)c1ccccc1C 184cf262c2301a24c6a3d69fc55e5c71 [0,2,0,0,0,0|2,0,0]=4 17460 B13R1.674 CCCN[C@@H](C)c1ccccc1Cl cad4ff3f88b940d37ffeee0312024b32 [0,2,0,0,0,0|2,0,0]=4 17461 B13R1.674 CCCN[C@@H](C)c1ccccc1F d5fcc311568293252d00994f58c55de1 [0,2,0,0,0,0|2,0,0]=4 17462 B13R1.674 CCCN[C@H](C)c1ccccc1C 2d23bebb7c69be8a0d8a7d0b929d7702 [0,2,0,0,0,0|2,0,0]=4 17463 B13R1.674 CCCN[C@H](C)c1ccccc1Cl 0695c242817c943daba46f61739d2508 [0,2,0,0,0,0|2,0,0]=4 17464 B13R1.674 CCCN[C@H](C)c1ccccc1F d3f7e3e705fcf6266099722d18706cbe [0,2,0,0,0,0|2,0,0]=4 17465 B13R1.674 CCCN[C@H](C)c1ncccc1C 2435b086df8face1e01046294bd462ff [0,2,0,0,0,0|1,0,0]=3 17466 B13R1.674 CCCOC(C)c1ccccc1Cl ac031fed57db5710a77b7c003bedf8df [0,2,0,0,0,0|2,0,0]=4 17467 B13R1.674 CCCOC(C)c1ncccc1C c4b94fb2fee2273234b849d015a3208d [0,2,0,0,0,0|1,0,0]=3 17468 B13R1.674 CCCOC(C)c1ncccc1Cl 41e16e9bee4779c3ba6d98ec662142fe [0,2,0,0,0,0|1,0,0]=3 17469 B13R1.674 CCCOC(C)c1ncccc1F e70fd30933f3fbbbc7593f8412af0aef [0,2,0,0,0,0|1,0,0]=3 17470 B13R1.674 CCCO[C@@H](C)c1ccccc1Cl 5ef0ff26e3abb9fd84923805fbb57fd0 [0,2,0,0,0,0|2,0,0]=4 17471 B13R1.674 CCCO[C@H](C)c1ccccc1Cl 793412c1363e0e98eea4d3c00742ae78 [0,2,0,0,0,0|2,0,0]=4 17472 B13R1.674 CCCO[C@H](C)c1ncccc1C 8fc37a185ebed020831f444ad3eb0bcd [0,2,0,0,0,0|1,0,0]=3 17473 B13R1.674 CCCO[C@H](C)c1ncccc1F 4871f623e8f696b310c53677540f6ce3 [0,2,0,0,0,0|1,0,0]=3 17474 B13R1.674 CCNCC(O)c1ccccc1Cl f60d7bfbb2abb910194de4c0f8885531 [0,2,0,0,0,0|2,0,0]=4 17475 B13R1.674 CCOCN(C)c1ncccc1C b7282f3d1ad3f8d9dfb045faaf47d70b [0,2,0,0,0,0|2,0,0]=4 17476 B13R1.674 CN(CCCF)c1ncccc1Br 77984f11e47eb7096fb6e1d3508a5254 [0,2,0,0,0,0|2,0,0]=4 17477 B13R1.674 CN(CCCF)c1ncccc1Cl 752fdf8b60c00849c63a22a70a6d8547 [0,2,0,0,0,0|2,0,0]=4 17478 B13R1.674 CN(CCCF)c1ncccc1F b50c6224fd64c56c48bc2188a3795f58 [0,2,0,0,0,0|2,0,0]=4 17479 B13R1.674 CN(CCCF)c1ncccc1I 7c64924bcb1dcb21954c423aad4b45ca [0,2,0,0,0,0|2,0,0]=4 17480 B13R1.674 CN(CCCO)c1ncccc1Cl 7ca893f594198fe0400a867058e12e28 [0,2,0,0,0,0|2,0,0]=4 17481 B13R1.674 CN(CCCO)c1ncccc1F 3361fce544bb775ce6c0de782f760f32 [0,2,0,0,0,0|2,0,0]=4 17482 B13R1.674 CN(CCCO)c1ncccc1I 8214f730f295d85f8992605bec3f404d [0,2,0,0,0,0|2,0,0]=4 17483 B13R1.674 CN(CCCS)c1ncccc1Br 637b3fa58f5699aa0192f49f8952cd04 [0,2,0,0,0,0|2,0,0]=4 17484 B13R1.674 CN(CCCS)c1ncccc1Cl c62dadcfe226c0a8d097053513ac4b2c [0,2,0,0,0,0|2,0,0]=4 17485 B13R1.674 CN(CCCS)c1ncccc1F c78896b7747c59db0eec8c623e91b945 [0,2,0,0,0,0|2,0,0]=4 17486 B13R1.674 CN(CCCS)c1ncccc1I 7604a0aedd0f517a8d686cc01c6b17f8 [0,2,0,0,0,0|2,0,0]=4 17487 B13R1.674 COCCN(C)c1ncccc1Br 583540205efae589aaeebefa6d88ba5b [0,2,0,0,0,0|2,0,0]=4 17488 B13R1.674 COCCN(C)c1ncccc1C c6c861e85beeabb74bea1c5b05927eef [0,2,0,0,0,0|2,0,0]=4 17489 B13R1.674 COCCN(C)c1ncccc1Cl 17f03ee21d6902ead3c12cd46d0d3c80 [0,2,0,0,0,0|2,0,0]=4 17490 B13R1.674 COCCN(C)c1ncccc1F 461b1e4ecdb6403bdbc89a2c4d9abde6 [0,2,0,0,0,0|2,0,0]=4 17491 B13R1.674 COCCN(C)c1ncccc1I 0773bb01ede4c2cdb01278f33817c8c1 [0,2,0,0,0,0|2,0,0]=4 17492 B13R1.674 COCNC(C)c1ncccc1Br 9df4b4d680ffb0863e04688e9633570c [0,2,0,0,0,0|2,0,0]=4 17493 B13R1.674 COCNC(C)c1ncccc1C 09d0f46daeffdb9325049bc89838cb5d [0,2,0,0,0,0|2,0,0]=4 17494 B13R1.674 COCN[C@@H](C)c1ncccc1Br adfe5fb6f736f198807417691c80b6c1 [0,2,0,0,0,0|2,0,0]=4 17495 B13R1.674 COCN[C@H](C)c1ncccc1C 25787f64dca37191787ab6110cf7e209 [0,2,0,0,0,0|2,0,0]=4 17496 B13R1.674 COCOC(C)c1ncccc1Br 61fa2fad8e36404ec8de79417e158139 [0,2,0,0,0,0|2,0,0]=4 17497 B13R1.674 COCOC(C)c1ncccc1C ffef1f3fc7c722600bce21a76b5557c7 [0,2,0,0,0,0|2,0,0]=4 17498 B13R1.674 COCOC(C)c1ncccc1Cl a10be540f41f578d04c5be9abea29184 [0,2,0,0,0,0|2,0,0]=4 17499 B13R1.674 COCOC(C)c1ncccc1F 6b58a0a0fc9b70e2d5a1718c8d13abc8 [0,2,0,0,0,0|2,0,0]=4 17500 B13R1.674 COCO[C@@H](C)c1ncccc1Br f2ca99723757282bd09b6f73128a98e5 [0,2,0,0,0,0|2,0,0]=4 17501 B13R1.674 COCO[C@H](C)c1ncccc1C f1476ca19a3f99918350d7b51db402bf [0,2,0,0,0,0|2,0,0]=4 17502 B13R1.674 COCO[C@H](C)c1ncccc1F 579307104ca8bf057e6fa83c17afef4b [0,2,0,0,0,0|2,0,0]=4 17503 B13R1.674 CSCCN(C)c1ncccc1Br e8e6e10316e53e5ad946b69079a266d0 [0,2,0,0,0,0|2,0,0]=4 17504 B13R1.674 CSCCN(C)c1ncccc1C 38999ed54e49d307347dc5493af66351 [0,2,0,0,0,0|2,0,0]=4 17505 B13R1.674 CSCCN(C)c1ncccc1Cl 3da185ca516f0d0bec653da62dc1cddd [0,2,0,0,0,0|2,0,0]=4 17506 B13R1.674 CSCCN(C)c1ncccc1F 30b8e828973a99c19d57cae4a5706cb6 [0,2,0,0,0,0|2,0,0]=4 17507 B13R1.674 CSCCN(C)c1ncccc1I 915babc98b6ac3ea0af924a6676dc1af [0,2,0,0,0,0|2,0,0]=4 17508 B13R1.674 CSCNC(C)c1ncccc1C 776d4ded7844777fa70c60fae3d55ac9 [0,2,0,0,0,0|2,0,0]=4 17509 B13R1.674 CSCN[C@H](C)c1ncccc1C d193e00e5202473ed1c5bb28d56296b1 [0,2,0,0,0,0|2,0,0]=4 17510 B13R1.674 CSCOC(C)c1ncccc1Br 0c2b0b48b9f6f0b2357c4795d3ce29ed [0,2,0,0,0,0|2,0,0]=4 17511 B13R1.674 CSCOC(C)c1ncccc1C 5f72116a4147e974001ee545599d95cf [0,2,0,0,0,0|2,0,0]=4 17512 B13R1.674 CSCOC(C)c1ncccc1Cl ea3062d3b3f62066bdd6a9fc05d532a6 [0,2,0,0,0,0|2,0,0]=4 17513 B13R1.674 CSCOC(C)c1ncccc1F ad544cf30aba7513a6740a9e66ed4dcc [0,2,0,0,0,0|2,0,0]=4 17514 B13R1.674 CSCO[C@@H](C)c1ncccc1Br 915e22368599bd3ba12682ff0fa8c982 [0,2,0,0,0,0|2,0,0]=4 17515 B13R1.674 CSCO[C@H](C)c1ncccc1C 95b06177758f6bbaefa4a968d292aeaf [0,2,0,0,0,0|2,0,0]=4 17516 B13R1.674 CSCO[C@H](C)c1ncccc1F 38807dac788c561e77529d922b27d910 [0,2,0,0,0,0|2,0,0]=4 17517 B13R1.674 C[C@@H](OCCF)c1ncccc1F 04941d6ff10ab828f7f289ebe1083492 [0,2,0,0,0,0|2,0,0]=4 17518 B13R1.674 C[C@@H](OCCS)c1ncccc1F 36ac41c85510f2b2329a3a8f13c555d5 [0,2,0,0,0,0|2,0,0]=4 17519 B13R1.674 C[C@H](OCCS)c1ncccc1Br f00828c58c814fa2a4a1b3fa8f673391 [0,2,0,0,0,0|2,0,0]=4 17520 B13R1.674 Cc1cccnc1C(C)NCCF 89e4417ca350760211a2e74139727824 [0,2,0,0,0,0|2,0,0]=4 17521 B13R1.674 Cc1cccnc1C(C)NCCO ac49ed8ae22d42f2868f11eac5dbb0f7 [0,2,0,0,0,0|2,0,0]=4 17522 B13R1.674 Cc1cccnc1C(C)NCCS 03e06b71d2433b20855fbee7c82cc4ac [0,2,0,0,0,0|2,0,0]=4 17523 B13R1.674 Cc1cccnc1C(C)OCCF a885bbe432adf033f755a1ae2dc2f634 [0,2,0,0,0,0|2,0,0]=4 17524 B13R1.674 Cc1cccnc1C(C)OCCS 2b9fe3fa7ec2b3abd0e9013b2902e5d8 [0,2,0,0,0,0|2,0,0]=4 17525 B13R1.674 Cc1cccnc1N(C)CCCF 69cb6a8b01ed7d9c9b59e92b3171ff1c [0,2,0,0,0,0|2,0,0]=4 17526 B13R1.674 Cc1cccnc1N(C)CCCO 427c11edd00fd9b138cfcca3f0f339bc [0,2,0,0,0,0|2,0,0]=4 17527 B13R1.674 Cc1cccnc1N(C)CCCS 532cade0dc39f22705ff3a37601abf6b [0,2,0,0,0,0|2,0,0]=4 17528 B13R1.674 Cc1cccnc1[C@@H](C)NCCF 24e6ced112ff1ba026237ef3020dee8d [0,2,0,0,0,0|2,0,0]=4 17529 B13R1.674 Cc1cccnc1[C@@H](C)NCCO ec519bad142142edaf85dd7c041681f0 [0,2,0,0,0,0|2,0,0]=4 17530 B13R1.674 Cc1cccnc1[C@@H](C)NCCS 02db2f746bbaccbb56721dbe2d0d40c1 [0,2,0,0,0,0|2,0,0]=4 17531 B13R1.674 Cc1cccnc1[C@@H](C)OCCF 7b52d86adb57e663127704c68ff17715 [0,2,0,0,0,0|2,0,0]=4 17532 B13R1.674 Cc1cccnc1[C@@H](C)OCCS 7811a368c2f65e0280257ea70c6abf8d [0,2,0,0,0,0|2,0,0]=4 17533 B13R1.79 C#CC(Cc1ccccc1)OCC baba28c2f1d3738679598657e5199de8 [0,2,0,0,0,0|2,0,0]=4 17534 B13R1.79 CCC(Cc1ccccn1)OCF 6dbda7b3f76a20774c8d0ac7f636f023 [0,2,0,0,0,0|2,0,0]=4 17535 B13R1.79 CCCC(CC)Nc1ccccc1 6e61d1760ae1faff4fa5b3b1f6312d06 [0,2,0,0,0,0|2,0,0]=4 17536 B13R1.79 CCCC(CC)Nc1ccccn1 8d063ebfa2ab7d0e67518d5261ebd9fe [0,2,0,0,0,0|1,0,0]=3 17537 B13R1.79 CCCC(CC)Nc1cccnn1 73116f3624868c106302bee9b4a95896 [0,2,0,0,0,0|2,0,0]=4 17538 B13R1.79 CCCC(CC)Nc1ccncn1 9c509e7b7a5e9de2d592b8be7119f4f7 [0,2,0,0,0,0|2,0,0]=4 17539 B13R1.79 CCCC(CC)Nc1cnccn1 d9a7c351ed535a7523abf12f920fd52a [0,2,0,0,0,0|2,0,0]=4 17540 B13R1.79 CCCC(CC)Nc1ncccn1 a9004443fae88f1190219dc5d3ee7e76 [0,2,0,0,0,0|2,0,0]=4 17541 B13R1.79 CCCC(CC)Oc1ccccn1 27e61c310bab6689794d265684690a66 [0,2,0,0,0,0|1,0,0]=3 17542 B13R1.79 CCCC(CC)Oc1cnccn1 90c19e180f6cfae93e555cf9be5e7593 [0,2,0,0,0,0|2,0,0]=4 17543 B13R1.79 CCCC(CC)Oc1ncccn1 a6539116cf8057cc2da7cf079208ab48 [0,2,0,0,0,0|2,0,0]=4 17544 B13R1.79 CCCC(CO)Nc1ccccc1 3c8acc478494a93b6f0d5ff0c66368a4 [0,2,0,0,0,0|2,0,0]=4 17545 B13R1.79 CCCC(CO)Nc1cccnn1 94a1c442ff3e59de8047b3dd65335e8b [0,2,0,0,0,0|2,0,0]=4 17546 B13R1.79 CCCC(CO)Nc1ccncn1 ff709ed921575733fc68d5eb305ba347 [0,2,0,0,0,0|2,0,0]=4 17547 B13R1.79 CCCN(C=O)Cc1ccccc1 04c3429c9ded9bdd8050a0febdf2a8ae [0,2,0,0,0,0|2,0,0]=4 17548 B13R1.79 CCCN(C=O)Cc1ccccn1 a10069bd9d855789e2563ba7459e3d78 [0,2,0,0,0,0|1,0,0]=3 17549 B13R1.79 CCCN(CC)Cc1ccccc1 e11a6c3680184c63309529a3f100619e [0,2,0,0,0,0|2,0,0]=4 17550 B13R1.79 CCCN(CC)Cc1ccccn1 29eb0242558f8509d2a0f02f50ac4fda [0,2,0,0,0,0|1,0,0]=3 17551 B13R1.79 CCCN(CC)Cc1cccnn1 d229b97e97f0caf23c82b87b2a641e6e [0,2,0,0,0,0|2,0,0]=4 17552 B13R1.79 CCCN(CC)Cc1ccncn1 271fda87212b967147576130e28fc02b [0,2,0,0,0,0|2,0,0]=4 17553 B13R1.79 CCCN(CC)Cc1ncccn1 23b6f5a0efc2278af299f34b4a11e5e4 [0,2,0,0,0,0|2,0,0]=4 17554 B13R1.79 CCCN(CF)Cc1ccccc1 ce22b1a7da529b92039156b8e7fab674 [0,2,0,0,0,0|2,0,0]=4 17555 B13R1.79 CCCN(CF)Cc1ccccn1 a651aacaadfca3119123f3514cf102c6 [0,2,0,0,0,0|1,0,0]=3 17556 B13R1.79 CCCN(CO)Cc1ccccc1 6c918f661462d63cbb620db917ad3142 [0,2,0,0,0,0|2,0,0]=4 17557 B13R1.79 CCC[C@@H](CO)Nc1ccccc1 0c292edf766ebd044cede4f74c152fb7 [0,2,0,0,0,0|2,0,0]=4 17558 B13R1.79 CCC[C@@H](CO)Nc1cccnn1 d1688b42e142d046f596de6b1fb9d4f2 [0,2,0,0,0,0|2,0,0]=4 17559 B13R1.79 CCC[C@@H](CO)Nc1ccncn1 cea62b2433648f3f4a3f92f5321c4043 [0,2,0,0,0,0|2,0,0]=4 17560 B13R1.79 CCC[C@H](CO)Nc1ccccc1 661dc1752dc337e51afb839827a3b3b5 [0,2,0,0,0,0|2,0,0]=4 17561 B13R1.79 CCC[C@H](CO)Nc1cccnn1 36805aa2f15fd756fe05daa3193b4589 [0,2,0,0,0,0|2,0,0]=4 17562 B13R1.79 CCC[C@H](CO)Nc1ccncn1 2d634671f6c094c01f3a57414dffc88a [0,2,0,0,0,0|2,0,0]=4 17563 B13R1.79 CCN(CCCl)Cc1ccccn1 8de864467f1378f4afc4b64afcdd4211 [0,2,0,0,0,0|2,0,0]=4 17564 B13R1.79 CCN(CCF)Cc1ccccn1 ff892e80e16f8345b3dada14b98cef18 [0,2,0,0,0,0|2,0,0]=4 17565 B13R1.79 CCN(CCO)Cc1ccccn1 8cea37db9c186f2444c3c7e07059081a [0,2,0,0,0,0|2,0,0]=4 17566 B13R1.79 CCN(CCS)Cc1ccccn1 820dab26f36333f5be7b152533a9f3fe [0,2,0,0,0,0|2,0,0]=4 17567 B13R1.79 CCN(COC)Cc1ccccn1 6dbdc23feb50fe91f07bbd18f4d26269 [0,2,0,0,0,0|2,0,0]=4 17568 B13R1.79 CCN(CSC)Cc1ccccn1 24491bdb1e88613ee2543706ace87f43 [0,2,0,0,0,0|2,0,0]=4 17569 B13R1.79 CCNC(C#N)Cc1ccccc1 ca21ad0ecb8ed1e689acacd2dd9f2610 [0,2,0,0,0,0|2,0,0]=4 17570 B13R1.79 CCNC(CC)Cc1ccccc1 002ed484243067e94ed6831a206c686f [0,2,0,0,0,0|2,0,0]=4 17571 B13R1.79 CCNC(CO)Cc1ccccc1 c9fb0151efc827a0052c56dadab1697d [0,2,0,0,0,0|2,0,0]=4 17572 B13R1.79 CCN[C@@H](CO)Cc1ccccc1 0a9e3f6adb9d62304a80b4ce73c89527 [0,2,0,0,0,0|2,0,0]=4 17573 B13R1.79 CCN[C@H](CO)Cc1ccccc1 e5a9201f97f671ef08669be1448b8caf [0,2,0,0,0,0|2,0,0]=4 17574 B13R1.79 CCOC(CC)Cc1ccccc1 5414cfbea073f7356f1655cdb43b6ed6 [0,2,0,0,0,0|2,0,0]=4 17575 B13R1.79 CCOC(CC)Cc1ccccn1 c0d13ef534a0f1edceceb8e56de3eb7b [0,2,0,0,0,0|1,0,0]=3 17576 B13R1.79 OCCN(CO)Cc1ccccn1 63a48e0032f70bc8e103370daab2e62c [0,2,0,0,0,0|2,0,0]=4 17577 B13R1.79 OCC[C@H](CO)Nc1ccccn1 56817369b0482b4471d165ed33c1e191 [0,2,0,0,0,0|2,0,0]=4 17578 B13R1.79 OCC[C@H](CO)Oc1ccccn1 689c9540a1aa11573be4e6ea1f6cfe0c [0,2,0,0,0,0|2,0,0]=4 17579 B13R1.348 C=C(C)CN(C)Cc1ccccn1 50f63279112adc62a2d5677fb7cad9b2 [0,2,0,0,0,0|1,0,1]=4 17580 B13R1.348 CC(=O)NC(C)Cc1ccccn1 2a33bb1a2db0d29dc689b065e03e6778 [0,2,0,0,0,0|1,0,1]=4 17581 B13R1.348 CC(C)CC(=O)Nc1ccccn1 d46f787682c9a30598862dbcc9cde6fc [0,2,0,0,0,0|1,0,1]=4 17582 B13R1.348 CC(C)CC(C)Nc1ccccc1 c725022ee842f8debc3081607546c540 [0,2,0,0,0,0|2,0,0]=4 17583 B13R1.348 CC(C)CC(C)Nc1ccccn1 e6201d1d42ec513d36d098f4198db276 [0,2,0,0,0,0|1,0,0]=3 17584 B13R1.348 CC(C)CC(C)Nc1cccnn1 523b496649fdd81fba1cb0fd47160351 [0,2,0,0,0,0|2,0,0]=4 17585 B13R1.348 CC(C)CC(C)Nc1ccncn1 772f61ff090c3d3636fc8c7707d1e907 [0,2,0,0,0,0|2,0,0]=4 17586 B13R1.348 CC(C)CC(C)Nc1cnccn1 b1d49ca9e26648b22c2acca7358b841c [0,2,0,0,0,0|2,0,0]=4 17587 B13R1.348 CC(C)CC(C)Nc1ncccn1 be6fee1c98f5af57c78f3c9a3b4f9dc6 [0,2,0,0,0,0|2,0,0]=4 17588 B13R1.348 CC(C)CC(C)Oc1ccccn1 53616aafa4f4d4e2a87c50dcf789c9cb [0,2,0,0,0,0|1,0,0]=3 17589 B13R1.348 CC(C)CC(C)Oc1cnccn1 9d7e71b217666c431c5590cd0348c92d [0,2,0,0,0,0|2,0,0]=4 17590 B13R1.348 CC(C)CC(C)Oc1ncccn1 6e488d4fde476ca010cccd41c43fb39c [0,2,0,0,0,0|2,0,0]=4 17591 B13R1.348 CC(C)CN(C)Cc1ccccc1 7efbff439c225b8bbd3ff90fdf6954f3 [0,2,0,0,0,0|2,0,0]=4 17592 B13R1.348 CC(C)CN(C)Cc1ccccn1 acfefb074589b96fc71d79d978fb827d [0,2,0,0,0,0|1,0,0]=3 17593 B13R1.348 CC(C)CN(C)Cc1cccnn1 194a00d0f5d871b331fd2e010aaac342 [0,2,0,0,0,0|2,0,0]=4 17594 B13R1.348 CC(C)CN(C)Cc1ccncn1 0026a4b8c5e6c2c00549ff5eb7fc7747 [0,2,0,0,0,0|2,0,0]=4 17595 B13R1.348 CC(C)CN(C)Cc1cnccn1 b804d1e3e25f7e1db91b3d01db3b0bbb [0,2,0,0,0,0|2,0,0]=4 17596 B13R1.348 CC(C)CN(C)Cc1ncccn1 00e6dd736ff73da0cd270fa78aaa7337 [0,2,0,0,0,0|2,0,0]=4 17597 B13R1.348 CC(C)NC(C)Cc1ccccn1 659fd592ffa44d06a3f2333c31b45173 [0,2,0,0,0,0|1,0,0]=3 17598 B13R1.348 CC(C)NC(C)Cc1cnccn1 54cbd5a32d99869625cfe0e70758cae5 [0,2,0,0,0,0|2,0,0]=4 17599 B13R1.348 CC(C)OC(C)Cc1ccccc1 2252e63beb1f94a3718b29632816b153 [0,2,0,0,0,0|2,0,0]=4 17600 B13R1.348 CC(C)OC(C)Cc1ccccn1 89ba247634c915b1308d87a05b414d13 [0,2,0,0,0,0|1,0,0]=3 17601 B13R1.348 CC(C)OC(C)Cc1cnccn1 55508f8a74230630661891ba19e98d2f [0,2,0,0,0,0|2,0,0]=4 17602 B13R1.348 CC(C)O[C@@H](C)Cc1ccccc1 6c0b1ecc6cc0bee8de9de4dafb9a90d4 [0,2,0,0,0,0|2,0,0]=4 17603 B13R1.348 CC(C)O[C@H](C)Cc1ccccc1 cd878f9bbdf7aae1891836954532f65f [0,2,0,0,0,0|2,0,0]=4 17604 B13R1.348 CC(O)CC(=O)Nc1ccccn1 09bcd54c1514115391be245d0421b67a [0,2,0,0,0,0|1,0,1]=4 17605 B13R1.348 CC(O)CC(C)Nc1ccccc1 4fccbf7a7364c4fc5b879bb7ce60f08f [0,2,0,0,0,0|2,0,0]=4 17606 B13R1.348 CC(O)CN(C)Cc1ccccc1 9c4b00009d473743d0e40c91a74eb96c [0,2,0,0,0,0|2,0,0]=4 17607 B13R1.348 CC(O)CN(C)Cc1ccccn1 64c75f6f61cb35ed193473c04248c6e9 [0,2,0,0,0,0|1,0,0]=3 17608 B13R1.348 CC(O)CN(C)Cc1cccnn1 8f02d4089f16dbe5112d737edf4ef0f1 [0,2,0,0,0,0|2,0,0]=4 17609 B13R1.348 CC(O)CN(C)Cc1ccncn1 59acb5946fbc48eb4f7c34811a98d6d1 [0,2,0,0,0,0|2,0,0]=4 17610 B13R1.348 CC(O)CN(C)Cc1cnccn1 3eb001a456f0cc1920e7b54a5b4bb532 [0,2,0,0,0,0|2,0,0]=4 17611 B13R1.348 CC(O)CN(C)Cc1ncccn1 520cf9c7525c3c6744d20fc49516bdaa [0,2,0,0,0,0|2,0,0]=4 17612 B13R1.348 CN(C)CN(C)Cc1ccccn1 8cae9b8f90317a52114fe6fddf43ae52 [0,2,0,0,0,0|2,0,0]=4 17613 B13R1.348 CN(Cc1ccccn1)CC(F)F a0515b20395bd92def069470d3c56279 [0,2,0,0,0,0|2,0,0]=4 17614 B13R1.348 C[C@@H](O)CC(=O)Nc1ccccn1 84be5c463f1a41b174f6a1a96d0f46c6 [0,2,0,0,0,0|1,0,1]=4 17615 B13R1.348 C[C@@H](O)CN(C)Cc1ccccc1 2694449cd1cea42072e3a34f5fa5cd3f [0,2,0,0,0,0|2,0,0]=4 17616 B13R1.348 C[C@@H](O)CN(C)Cc1ccccn1 3e546b333fbd8a6a330355c70a1dafeb [0,2,0,0,0,0|1,0,0]=3 17617 B13R1.348 C[C@@H](O)CN(C)Cc1cnccn1 d56e4edd3d2a88f439bd02733b6925f9 [0,2,0,0,0,0|2,0,0]=4 17618 B13R1.348 C[C@H](O)CC(=O)Nc1ccccn1 bf914881da69f7e99643ba43f760e3f0 [0,2,0,0,0,0|1,0,1]=4 17619 B13R1.348 C[C@H](O)CN(C)Cc1ccccc1 6ffb63057723a6d0e84a6367b8948b24 [0,2,0,0,0,0|2,0,0]=4 17620 B13R1.348 C[C@H](O)CN(C)Cc1ccccn1 767399c33be59fda3519d030a098489c [0,2,0,0,0,0|1,0,0]=3 17621 B13R1.348 C[C@H](O)CN(C)Cc1cccnn1 0b7983bcfbd50c92fd0e4988b540c8ab [0,2,0,0,0,0|2,0,0]=4 17622 B13R1.348 C[C@H](O)CN(C)Cc1ccncn1 cdd5add9ea2ecd9a8844c0e6b690e7f1 [0,2,0,0,0,0|2,0,0]=4 17623 B13R1.348 C[C@H](O)CN(C)Cc1cnccn1 cf1e20eeb34d5e7b386db8136ca48004 [0,2,0,0,0,0|2,0,0]=4 17624 B13R1.348 C[C@H](O)CN(C)Cc1ncccn1 c1863e3c1752379162504f806f831eb0 [0,2,0,0,0,0|2,0,0]=4 17625 B13R1.470 CC(CCO)Nc1ncccc1I 1bab7cf10edf05d146a04a113cba4a09 [0,2,0,0,0,0|2,0,0]=4 17626 B13R1.470 CCCC(=O)Nc1ncccc1C 0869ccdfc044bc4f7552319657146a74 [0,2,0,0,0,0|1,0,1]=4 17627 B13R1.470 CCCC(=O)Nc1ncccc1Cl 196ab8dfe63b7ad3e0ad347887c5469f [0,2,0,0,0,0|1,0,1]=4 17628 B13R1.470 CCCC(=O)Nc1ncccc1F 6966cbef4426de0f0e5a2115635a3715 [0,2,0,0,0,0|1,0,1]=4 17629 B13R1.470 CCCC(=O)Nc1ncccc1I 492b299a0befdf6d690468bba2c558d8 [0,2,0,0,0,0|1,0,1]=4 17630 B13R1.470 CCCC(=O)Nc1ncccc1O d4e9bef483f338ce3ee512414c8232eb [0,2,0,0,0,0|1,0,1]=4 17631 B13R1.470 CCCC(C)Nc1cccc[n+]1[O-] 31a1eb756b9ab91045b60159edee939c [0,2,0,0,0,0|1,0,1]=4 17632 B13R1.470 CCCC(C)Nc1ccccc1I a7b857e0489c0f75e5ae7a1eeea8f3d3 [0,2,0,0,0,0|2,0,0]=4 17633 B13R1.470 CCCC(C)Nc1ncccc1C 312f21ab5e4a87c5fcf4066b13b5aa1a [0,2,0,0,0,0|1,0,0]=3 17634 B13R1.470 CCCC(C)Nc1ncccc1Cl 2ed014531ab21537131f3670f73a45c8 [0,2,0,0,0,0|1,0,0]=3 17635 B13R1.470 CCCC(C)Nc1ncccc1F 09d1d31f39068716048626fa0f024ab6 [0,2,0,0,0,0|1,0,0]=3 17636 B13R1.470 CCCC(C)Nc1ncccc1I 693f1932398c2798a809ca176d65225a [0,2,0,0,0,0|1,0,0]=3 17637 B13R1.470 CCCC(C)Nc1nccnc1Br 966cd854b32acb66e405cc3032be9984 [0,2,0,0,0,0|2,0,0]=4 17638 B13R1.470 CCCC(C)Nc1nccnc1C 7034418a9c0aa0e3bd52982e52c8a13e [0,2,0,0,0,0|2,0,0]=4 17639 B13R1.470 CCCC(C)Nc1nccnc1Cl 811daadfe34fd6f18373c14d8d113458 [0,2,0,0,0,0|2,0,0]=4 17640 B13R1.470 CCCC(C)Nc1nccnc1I 1bea257ed94a018253a52f09bf80a101 [0,2,0,0,0,0|2,0,0]=4 17641 B13R1.470 CCCC(C)Nc1nnccc1C b291bb816cc9921308eaa72e237c9b4c [0,2,0,0,0,0|2,0,0]=4 17642 B13R1.470 CCCC(C)Oc1cccc[n+]1[O-] 83c18b6a747b104e7364d5d976ed43ed [0,2,0,0,0,0|1,0,1]=4 17643 B13R1.470 CCCC(C)Oc1ccccc1C 1f17e8de0fb0c0934746308a75335cc9 [0,2,0,0,0,0|2,0,0]=4 17644 B13R1.470 CCCC(C)Oc1ccccc1Cl 60577e184ec1cdbcdacde3f1c881025a [0,2,0,0,0,0|2,0,0]=4 17645 B13R1.470 CCCC(C)Oc1ncccc1Br e338d6b2fa4305f4e240535f4fd82c01 [0,2,0,0,0,0|1,0,0]=3 17646 B13R1.470 CCCC(C)Oc1ncccc1C f3fce4ef90dfea07e394d4a5b869afaa [0,2,0,0,0,0|1,0,0]=3 17647 B13R1.470 CCCC(C)Oc1ncccc1Cl 751bf9bc747ba4dccc8180fbb40a4a78 [0,2,0,0,0,0|1,0,0]=3 17648 B13R1.470 CCCC(C)Oc1ncccc1F e4d6852bf7dbf16cd1eb4d46f55edb98 [0,2,0,0,0,0|1,0,0]=3 17649 B13R1.470 CCCC(C)Oc1nccnc1Br 753218572f3adf66688b5d1cec18af1f [0,2,0,0,0,0|2,0,0]=4 17650 B13R1.470 CCCC(C)Oc1nccnc1C 47207fd7cdcf76bef030d0728da78a9b [0,2,0,0,0,0|2,0,0]=4 17651 B13R1.470 CCCC(C)Oc1ncncc1Cl 44dde284fb5920d55039f4f276086d9d [0,2,0,0,0,0|2,0,0]=4 17652 B13R1.470 CCCC(C)Oc1ncncc1F 68ff4c18ef4c5e98cd337bc211b59148 [0,2,0,0,0,0|2,0,0]=4 17653 B13R1.470 CCCC(C)Oc1ncncc1I 23ddf030d71bc464281f52b656f87895 [0,2,0,0,0,0|2,0,0]=4 17654 B13R1.470 CCCC(C)Oc1nnccc1C 868aec48e8e743022dabffb76dd9b5f0 [0,2,0,0,0,0|2,0,0]=4 17655 B13R1.470 CCCC(C)Oc1nnccc1Cl 18c090d11d4349106f28e0c08425b8d7 [0,2,0,0,0,0|2,0,0]=4 17656 B13R1.470 CCCC(C)Oc1nnccc1I fa80fcf84166fbb4b34c84c994801ed7 [0,2,0,0,0,0|2,0,0]=4 17657 B13R1.470 CCCN(C)Cc1ccccc1Cl 86941f0771b681d8a8cf2ec0e2996608 [0,2,0,0,0,0|2,0,0]=4 17658 B13R1.470 CCCN(C)Cc1ccccc1F bc8d4b4a20d48b883cf76081418dcd90 [0,2,0,0,0,0|2,0,0]=4 17659 B13R1.470 CCCN(C)Cc1ccccc1I 72501d9a49c52902fca05e1ffa9b5286 [0,2,0,0,0,0|2,0,0]=4 17660 B13R1.470 CCCN(C)Cc1ncccc1C 5fe8230e44fee4a4c8b5a3d70de9307e [0,2,0,0,0,0|1,0,0]=3 17661 B13R1.470 CCCN(C)Cc1ncccc1Cl 54ab46efe520691df71d5f1138a8cecb [0,2,0,0,0,0|1,0,0]=3 17662 B13R1.470 CCCN(C)Cc1ncccc1F 7d10b59efdd87542a330d826707c6855 [0,2,0,0,0,0|1,0,0]=3 17663 B13R1.470 CCCN(C)Cc1nccnc1C 527096c5bd894399f4cdf3913bf523da [0,2,0,0,0,0|2,0,0]=4 17664 B13R1.470 CCC[C@H](C)Nc1cccc[n+]1[O-] 702c3f214cc76a675bf6199c11aad56b [0,2,0,0,0,0|1,0,1]=4 17665 B13R1.470 CCOC(C)Cc1ccccc1Cl 42836db197c27db49b74faadf1b72a1d [0,2,0,0,0,0|2,0,0]=4 17666 B13R1.470 CCOC(C)Cc1ncccc1C 2c91c30d42252453330d92f00784a11a [0,2,0,0,0,0|1,0,0]=3 17667 B13R1.470 CN(CCF)Cc1ncccc1Br 735306c42afd4d655f95eef4a0e98431 [0,2,0,0,0,0|2,0,0]=4 17668 B13R1.470 CN(CCF)Cc1ncccc1Cl f5f58d81d311488bd966f5cd6a541984 [0,2,0,0,0,0|2,0,0]=4 17669 B13R1.470 CN(CCF)Cc1ncccc1F 401df3e0d3a41ba0db80aa8185cbc5d2 [0,2,0,0,0,0|2,0,0]=4 17670 B13R1.470 CN(CCO)Cc1ncccc1Br 4fd860d0f411af20fd7dfa2444d036c4 [0,2,0,0,0,0|2,0,0]=4 17671 B13R1.470 CN(CCO)Cc1ncccc1Cl 3208e7d3a9f37261eafad15b7c692636 [0,2,0,0,0,0|2,0,0]=4 17672 B13R1.470 CN(CCO)Cc1ncccc1F e159e4be8ed4944f9ce9c08e5c872413 [0,2,0,0,0,0|2,0,0]=4 17673 B13R1.470 CN(CCS)Cc1ncccc1F 1cf16147a9adeed5ef29a5cee9b455f5 [0,2,0,0,0,0|2,0,0]=4 17674 B13R1.470 COCC(C)Nc1ncccc1Br 6a34e2455b5ed9787bf6673e4a39f3d1 [0,2,0,0,0,0|2,0,0]=4 17675 B13R1.470 COCC(C)Nc1ncccc1C 98e47a2922841657ede3e9b2a6557d2b [0,2,0,0,0,0|2,0,0]=4 17676 B13R1.470 COCC(C)Nc1ncccc1Cl a4f07748872a4bd6b8e1aa924dcff5c5 [0,2,0,0,0,0|2,0,0]=4 17677 B13R1.470 COCC(C)Nc1ncccc1F 4af0129cecd8c7692b1e6807cd6e16cf [0,2,0,0,0,0|2,0,0]=4 17678 B13R1.470 COCC(C)Nc1ncccc1I bed81f4b9f85e119f4db1afbbf82351f [0,2,0,0,0,0|2,0,0]=4 17679 B13R1.470 COCC(C)Oc1ncccc1Br 116482311f9dea9e3098e14907e20b02 [0,2,0,0,0,0|2,0,0]=4 17680 B13R1.470 COCC(C)Oc1ncccc1C 5cc8adce5f005247219772308e626656 [0,2,0,0,0,0|2,0,0]=4 17681 B13R1.470 COCC(C)Oc1ncccc1Cl 6c15395cb6c224f08202dae4091f1bf8 [0,2,0,0,0,0|2,0,0]=4 17682 B13R1.470 COCC(C)Oc1ncccc1F 4fc1716df989ad9ec9f02b695cfd9588 [0,2,0,0,0,0|2,0,0]=4 17683 B13R1.470 COCN(C)Cc1ncccc1C 5c7a84653a0d62d12cc1e559c691236c [0,2,0,0,0,0|2,0,0]=4 17684 B13R1.470 COCN(C)Cc1ncccc1F bc36cd6ecc29d6e3dc8431cfd60c192e [0,2,0,0,0,0|2,0,0]=4 17685 B13R1.470 CSCN(C)Cc1ncccc1C 235f27f063f1f71b0656d5ad6087cb55 [0,2,0,0,0,0|2,0,0]=4 17686 B13R1.470 CSCN(C)Cc1ncccc1F c4690e8cfba4c7347b153084485f8512 [0,2,0,0,0,0|2,0,0]=4 17687 B13R1.470 Cc1cccnc1CC(C)OCF 4b9e8c6712c83a6640279f21d776440a [0,2,0,0,0,0|2,0,0]=4 17688 B13R1.470 Cc1cccnc1CN(C)CCF 402b7c934fb7c8342b3341682ff3d1ed [0,2,0,0,0,0|2,0,0]=4 17689 B13R1.470 Cc1cccnc1CN(C)CCO bb34765b46915a413965cafffac971bd [0,2,0,0,0,0|2,0,0]=4 17690 B13R1.470 Cc1cccnc1CN(C)CCS 5fa27afb60b7aad45ac0ebc85383635c [0,2,0,0,0,0|2,0,0]=4 17691 B13R1.470 Cc1cccnc1NC(C)CCO e46bedcb20b9a8b2cd2eb2e279b2c3cc [0,2,0,0,0,0|2,0,0]=4 17692 B13R1.158 C=C(C)CCNc1ncccc1Br 1ce2340bfbb8a1784eb6f263385e1eec [0,2,0,0,0,0|1,0,1]=4 17693 B13R1.158 C=C(C)CCNc1ncccc1C e38a6b1a6bff440357ed873655a3800f [0,2,0,0,0,0|1,0,1]=4 17694 B13R1.158 C=C(C)CCNc1ncccc1Cl 017e1798c7b2206bf98d03a60ed3165e [0,2,0,0,0,0|1,0,1]=4 17695 B13R1.158 C=C(C)CCNc1ncccc1F bd2cc964d6117f6e78d452d0081ca028 [0,2,0,0,0,0|1,0,1]=4 17696 B13R1.158 C=C(C)CCNc1ncccc1I bfa320167440c1b18f9a246d56e974fb [0,2,0,0,0,0|1,0,1]=4 17697 B13R1.158 C=C(C)CCOc1ncccc1Br 591dd7c56bac4106f3dc2b37fca265de [0,2,0,0,0,0|1,0,1]=4 17698 B13R1.158 C=C(C)CCOc1ncccc1C 9383fd09ffb7b8f7c28b8dededecb09d [0,2,0,0,0,0|1,0,1]=4 17699 B13R1.158 C=C(C)CCOc1ncccc1Cl f17c19abd8fe657ed15e0e8ab12c61aa [0,2,0,0,0,0|1,0,1]=4 17700 B13R1.158 C=C(C)CCOc1ncccc1F 90cbaa315838cfd4c6e761bf0e02f64e [0,2,0,0,0,0|1,0,1]=4 17701 B13R1.158 C=C(C)CNCc1ncccc1Br 0740b1e5c45bf633196e76ca8c975f57 [0,2,0,0,0,0|1,0,1]=4 17702 B13R1.158 C=C(C)CNCc1ncccc1C 8bc6b4eb28275b178888c2dcb9d6d131 [0,2,0,0,0,0|1,0,1]=4 17703 B13R1.158 C=C(C)CNCc1ncccc1Cl bcaf61b1d977473eff3dde31257fc3fa [0,2,0,0,0,0|1,0,1]=4 17704 B13R1.158 C=C(C)CNCc1ncccc1F 0c7fba9957d3c929854b40f11342b239 [0,2,0,0,0,0|1,0,1]=4 17705 B13R1.158 C=C(C)COCc1ncccc1Br 8c55e9e37f74859a799b5937f36bf48d [0,2,0,0,0,0|1,0,1]=4 17706 B13R1.158 C=C(C)COCc1ncccc1C 5d0e667ad1fbb721746cae8bb176dbbe [0,2,0,0,0,0|1,0,1]=4 17707 B13R1.158 C=C(C)COCc1ncccc1Cl 87a6721a6ddb9f1ffbc9f59e8a791cf6 [0,2,0,0,0,0|1,0,1]=4 17708 B13R1.158 C=C(C)COCc1ncccc1F cd3274a715b11907a046c6c0d8b5f9b1 [0,2,0,0,0,0|1,0,1]=4 17709 B13R1.158 CC(=O)CCNc1ncccc1Br 33183ebab5a03525662b703aef7e53fe [0,2,0,0,0,0|1,0,1]=4 17710 B13R1.158 CC(=O)CCNc1ncccc1C 077f762503e685d8596e582a222d30cf [0,2,0,0,0,0|1,0,1]=4 17711 B13R1.158 CC(=O)CCNc1ncccc1Cl ee735aafad7495ce68aed4f671194356 [0,2,0,0,0,0|1,0,1]=4 17712 B13R1.158 CC(=O)CCNc1ncccc1F 118d265a55eb374ffe5c51d3fe18c1c8 [0,2,0,0,0,0|1,0,1]=4 17713 B13R1.158 CC(=O)CCNc1ncccc1I 679bae9c5d73ab0d3edf8789f118262d [0,2,0,0,0,0|1,0,1]=4 17714 B13R1.158 CC(=O)CCOc1ncccc1C 5b0b32c0c91f4879500960e3a6bbc32a [0,2,0,0,0,0|1,0,1]=4 17715 B13R1.158 CC(=O)CCOc1ncccc1Cl 67125602d6f65b2d8656354834d4a5db [0,2,0,0,0,0|1,0,1]=4 17716 B13R1.158 CC(=O)CCOc1ncccc1F 6d5f10b869f09afc4cadda75d40044b3 [0,2,0,0,0,0|1,0,1]=4 17717 B13R1.158 CC(=O)CNCc1ncccc1Br 48a47fbea2f051e0d6ac6c91fbd36d96 [0,2,0,0,0,0|1,0,1]=4 17718 B13R1.158 CC(=O)CNCc1ncccc1C 8b581514822a054b1cac581d4340abf3 [0,2,0,0,0,0|1,0,1]=4 17719 B13R1.158 CC(=O)CNCc1ncccc1Cl fc281125d725e7e98c9b5504974d1de2 [0,2,0,0,0,0|1,0,1]=4 17720 B13R1.158 CC(=O)CNCc1ncccc1F 6faa9f86da960572ec77dcfd36b043ba [0,2,0,0,0,0|1,0,1]=4 17721 B13R1.158 CC(=O)COCc1ncccc1Br 556f39255e5cd47e29ce7cb84e14c07c [0,2,0,0,0,0|1,0,1]=4 17722 B13R1.158 CC(=O)COCc1ncccc1C abbcc4a373a723a3fb6c761ae9733b94 [0,2,0,0,0,0|1,0,1]=4 17723 B13R1.158 CC(=O)COCc1ncccc1Cl 0d5bf32cc9e7e3a60067154cc2da4ca7 [0,2,0,0,0,0|1,0,1]=4 17724 B13R1.158 CC(=O)COCc1ncccc1F 5f6568b0d7d09fce79f9b50ccc597224 [0,2,0,0,0,0|1,0,1]=4 17725 B13R1.158 CC(=O)NCCc1ncccc1Br 374ae28439bcde66856236919a65e735 [0,2,0,0,0,0|1,0,1]=4 17726 B13R1.158 CC(=O)NCCc1ncccc1C 3f397de82cf784f420f6a7b59558b06b [0,2,0,0,0,0|1,0,1]=4 17727 B13R1.158 CC(C)CCNc1cccc[n+]1[O-] c98f522bc77afc083e7237dff0de93da [0,2,0,0,0,0|1,0,1]=4 17728 B13R1.158 CC(C)CCNc1ccccc1Cl c1cced113eac8843a1b98f35ca82bd40 [0,2,0,0,0,0|2,0,0]=4 17729 B13R1.158 CC(C)CCNc1ccccc1F 799fc9bf9991b819194b5afa9b69d2da [0,2,0,0,0,0|2,0,0]=4 17730 B13R1.158 CC(C)CCNc1ccccc1I 1e1570ef5e35423e415cc60dedd44654 [0,2,0,0,0,0|2,0,0]=4 17731 B13R1.158 CC(C)CCNc1ccccc1S 242e3097e83874be7586e93654d2b938 [0,2,0,0,0,0|2,0,0]=4 17732 B13R1.158 CC(C)CCNc1ncc[nH]c1=O 8feb3e9122d7ef3b55654a183961911e [0,2,0,0,0,0|2,0,0]=4 17733 B13R1.158 CC(C)CCNc1ncccc1Br d75757e0d958b4a4e15c234a3a79b995 [0,2,0,0,0,0|1,0,0]=3 17734 B13R1.158 CC(C)CCNc1ncccc1Cl aa006b3b3944f1b6ae55764ade63a4c2 [0,2,0,0,0,0|1,0,0]=3 17735 B13R1.158 CC(C)CCNc1ncccc1F 457b7d0b747c16c6e7826f4fd35250fa [0,2,0,0,0,0|1,0,0]=3 17736 B13R1.158 CC(C)CCNc1ncccc1I e008a9783e023966bd8f703167d6385e [0,2,0,0,0,0|1,0,0]=3 17737 B13R1.158 CC(C)CCNc1nccnc1Br 0abe2fbf3a07ec98af6ae86b2ff93fb0 [0,2,0,0,0,0|2,0,0]=4 17738 B13R1.158 CC(C)CCNc1nccnc1Cl 26899c4b5fe57e06e07ec24ae20b46a1 [0,2,0,0,0,0|2,0,0]=4 17739 B13R1.158 CC(C)CCNc1nccnc1I 8b2077eb4637711a399784dce5b9e69b [0,2,0,0,0,0|2,0,0]=4 17740 B13R1.158 CC(C)CCNc1ncncc1Br f41669bdbafb133b066de1768d281a1a [0,2,0,0,0,0|2,0,0]=4 17741 B13R1.158 CC(C)CCNc1ncncc1Cl 9040079541e9e54fc80e1a8bdbd1db76 [0,2,0,0,0,0|2,0,0]=4 17742 B13R1.158 CC(C)CCNc1ncncc1F 7a2dc534e39a97aa7fb821f5878ea12f [0,2,0,0,0,0|2,0,0]=4 17743 B13R1.158 CC(C)CCNc1ncncc1I b78892cab81f7d40dc078baba67bb9be [0,2,0,0,0,0|2,0,0]=4 17744 B13R1.158 CC(C)CCOc1cccc[n+]1[O-] 63674157976f07e7f6782980473158e8 [0,2,0,0,0,0|1,0,1]=4 17745 B13R1.158 CC(C)CCOc1ccccc1Br bf5b53a1fc6ef7fcd522ad06312eafc2 [0,2,0,0,0,0|2,0,0]=4 17746 B13R1.158 CC(C)CCOc1ccccc1Cl eb6f6839f383dc853b4636c8dd13c302 [0,2,0,0,0,0|2,0,0]=4 17747 B13R1.158 CC(C)CCOc1ccccc1F 416cbe9a4633ded954c018b8866d7921 [0,2,0,0,0,0|2,0,0]=4 17748 B13R1.158 CC(C)CCOc1ccccc1I 34d17ce55e2dcc7706bcfbf8dcb6c59e [0,2,0,0,0,0|2,0,0]=4 17749 B13R1.158 CC(C)CCOc1ccccc1S 9fbcceeabe4723adbd574f7aeb2565a4 [0,2,0,0,0,0|2,0,0]=4 17750 B13R1.158 CC(C)CCOc1ncccc1Br 7c9319ff1e6202c253253c9d5025b7ed [0,2,0,0,0,0|1,0,0]=3 17751 B13R1.158 CC(C)CCOc1ncccc1Cl 85bbe995ba7d764702a58c0761d1cd2f [0,2,0,0,0,0|1,0,0]=3 17752 B13R1.158 CC(C)CCOc1ncccc1F bcfcbe43c323e8fdbbe3d79b47ccc728 [0,2,0,0,0,0|1,0,0]=3 17753 B13R1.158 CC(C)CCOc1nccnc1Br d0dabee026fdacb0ec9a2a423fd19224 [0,2,0,0,0,0|2,0,0]=4 17754 B13R1.158 CC(C)CCOc1ncncc1Cl 3356e73224a6411033b8fdb6ea193aa8 [0,2,0,0,0,0|2,0,0]=4 17755 B13R1.158 CC(C)CCOc1ncncc1F 0a6681e76a1ec1580e865eb7ddbfa015 [0,2,0,0,0,0|2,0,0]=4 17756 B13R1.158 CC(C)CCOc1ncncc1I 7cedfa30f287759194ee74744579e19d [0,2,0,0,0,0|2,0,0]=4 17757 B13R1.158 CC(C)CCOc1nnccc1Cl b50101fefa8c22ee19be3609b073fb22 [0,2,0,0,0,0|2,0,0]=4 17758 B13R1.158 CC(C)CCOc1nnccc1I b25d45fb4a235ee19c3aaa668315a90a [0,2,0,0,0,0|2,0,0]=4 17759 B13R1.158 CC(C)CNCc1cccc[n+]1[O-] 2d159e540f31912e4a5ed7eff52c4feb [0,2,0,0,0,0|1,0,1]=4 17760 B13R1.158 CC(C)CNCc1ccccc1Br 2d17535b24355d2c6cdee923e7f4c984 [0,2,0,0,0,0|2,0,0]=4 17761 B13R1.158 CC(C)CNCc1ccccc1Cl 20b28b20108c4bd613f67035042b910e [0,2,0,0,0,0|2,0,0]=4 17762 B13R1.158 CC(C)CNCc1ccccc1F 91d65ed1b88dd5c1a5ae856c03877a60 [0,2,0,0,0,0|2,0,0]=4 17763 B13R1.158 CC(C)CNCc1ccccc1I 1b21b5a987d32c91f0fb14ce32d11ae8 [0,2,0,0,0,0|2,0,0]=4 17764 B13R1.158 CC(C)CNCc1ncccc1Br 4d1e7014cefc4f754ab5fe06588053bd [0,2,0,0,0,0|1,0,0]=3 17765 B13R1.158 CC(C)CNCc1ncccc1Cl cf4a993f7b83a99ad860a974f6ff7391 [0,2,0,0,0,0|1,0,0]=3 17766 B13R1.158 CC(C)CNCc1ncccc1F a5959181dd6151e13a620576fb5fdec4 [0,2,0,0,0,0|1,0,0]=3 17767 B13R1.158 CC(C)CNCc1nccnc1Cl 7231022e111d6dabe1206068415d8760 [0,2,0,0,0,0|2,0,0]=4 17768 B13R1.158 CC(C)COCc1cccc[n+]1[O-] 3441d9c50d9766a37a12b2a344a26554 [0,2,0,0,0,0|1,0,1]=4 17769 B13R1.158 CC(C)COCc1ccccc1Br 4adcb21bd966903404afa9bc641a135b [0,2,0,0,0,0|2,0,0]=4 17770 B13R1.158 CC(C)COCc1ccccc1Cl fda3346050c9328c64c0f3843f4ca8ed [0,2,0,0,0,0|2,0,0]=4 17771 B13R1.158 CC(C)COCc1ccccc1F 429d30f7e4641796b5d64c80785e9ec1 [0,2,0,0,0,0|2,0,0]=4 17772 B13R1.158 CC(C)COCc1ccccc1I ec0323607c9555babd466a01c77262c6 [0,2,0,0,0,0|2,0,0]=4 17773 B13R1.158 CC(C)COCc1ccccc1S 14a5b7cb6a7179e4040a572b2e57b298 [0,2,0,0,0,0|2,0,0]=4 17774 B13R1.158 CC(C)COCc1ncccc1Br d146a39c530e2dee6d18b1dd3eac3274 [0,2,0,0,0,0|1,0,0]=3 17775 B13R1.158 CC(C)COCc1ncccc1Cl 889dcb259cb4b26b323c6bcfff69461f [0,2,0,0,0,0|1,0,0]=3 17776 B13R1.158 CC(C)COCc1ncccc1F f98a5aad8c49c4f41702de005b09e6a1 [0,2,0,0,0,0|1,0,0]=3 17777 B13R1.158 CC(C)COCc1nccnc1Cl 617afd916c177052833f5a127bead05c [0,2,0,0,0,0|2,0,0]=4 17778 B13R1.158 CC(C)COCc1ncncc1Br 72171a8d9f16f67596ede55dd430eb5d [0,2,0,0,0,0|2,0,0]=4 17779 B13R1.158 CC(C)NCCc1ccccc1Cl cc1ed481e29ef72030e5f44c363c1dd2 [0,2,0,0,0,0|2,0,0]=4 17780 B13R1.158 CC(C)NCCc1ccccc1F 116fa100bcea44eff2242136c9cf26fc [0,2,0,0,0,0|2,0,0]=4 17781 B13R1.158 CC(C)NCCc1ncccc1Br 755291b2488573f33f2bee64079b7734 [0,2,0,0,0,0|1,0,0]=3 17782 B13R1.158 CC(C)NCCn1ncccc1=O 2ab3e625303d841df83b8f926a2256a1 [0,2,0,0,0,0|2,0,0]=4 17783 B13R1.158 CC(C)OCCc1ccccc1Cl a46b59603348b7552d663dc636652d10 [0,2,0,0,0,0|2,0,0]=4 17784 B13R1.158 CC(C)OCCc1ccccc1F 7f5baca07294020c29c0ecec6d51509e [0,2,0,0,0,0|2,0,0]=4 17785 B13R1.158 CC(C)OCCc1ccccc1I d7d8e103f6d39e596cf6e8fc305c6b06 [0,2,0,0,0,0|2,0,0]=4 17786 B13R1.158 CC(C)OCCc1ncccc1F a0ca5aa617d8c948f81615d8845f0ff6 [0,2,0,0,0,0|1,0,0]=3 17787 B13R1.158 CC(C)OCNc1ncccc1Br d4cda267d89d50360fd81c3d5beef99c [0,2,0,0,0,0|2,0,0]=4 17788 B13R1.158 CC(C)OCNc1ncccc1Cl 578f1f4ba866bd96bd45a5d15639d304 [0,2,0,0,0,0|2,0,0]=4 17789 B13R1.158 CC(C)OCNc1ncccc1F 835db4853d318caa8227da3dbcf8808d [0,2,0,0,0,0|2,0,0]=4 17790 B13R1.158 CC(C)OCNc1ncccc1I fcf84ba6e49c2b816aff830545369395 [0,2,0,0,0,0|2,0,0]=4 17791 B13R1.158 CC(C)OCOc1ncccc1Cl 6d9d8dad9fee3f4a40eb495533f5c71b [0,2,0,0,0,0|2,0,0]=4 17792 B13R1.158 CC(C)OCOc1ncccc1F 4690a314a6a2d0c69002c91a6605237f [0,2,0,0,0,0|2,0,0]=4 17793 B13R1.158 CC(F)COCc1cccc[n+]1[O-] a2f311b74988180015bb8b5a4068ec07 [0,2,0,0,0,0|1,0,1]=4 17794 B13R1.158 CC(F)COCc1ccccc1Cl 1b3d653936bf5c67f9d7549723f4a292 [0,2,0,0,0,0|2,0,0]=4 17795 B13R1.158 CC(F)COCc1ccccc1F b43529feebae94582cfeedcb7e2dced0 [0,2,0,0,0,0|2,0,0]=4 17796 B13R1.158 CC(F)COCc1ccccc1I 5d5299f22c1739107a321ccbb66d9105 [0,2,0,0,0,0|2,0,0]=4 17797 B13R1.158 CC(F)COCc1ncccc1Br d7841d50b8051b6edec5b0c7559b3b4d [0,2,0,0,0,0|1,0,0]=3 17798 B13R1.158 CC(F)COCc1ncccc1Cl 5d8981fdf4c61aaaf38f40d008de4841 [0,2,0,0,0,0|1,0,0]=3 17799 B13R1.158 CC(F)COCc1ncccc1F fa8f867fcc43862b9b10effe1c1948ce [0,2,0,0,0,0|1,0,0]=3 17800 B13R1.158 CC(F)COCc1nccnc1Cl c5ac34a851e5efdedaa50ad093b89633 [0,2,0,0,0,0|2,0,0]=4 17801 B13R1.158 CC(O)CCNc1cccc[n+]1[O-] f14629c537ab11ae4d0e349442e2ba4f [0,2,0,0,0,0|1,0,1]=4 17802 B13R1.158 CC(O)CCNc1ccccc1Cl c3caa9fb52a237f2ab7bac0076e96288 [0,2,0,0,0,0|2,0,0]=4 17803 B13R1.158 CC(O)CCNc1ccccc1F 91abc0ca2d0abb7476769a6adab31a1e [0,2,0,0,0,0|2,0,0]=4 17804 B13R1.158 CC(O)CCNc1ccccc1I 872391b465582e8a028662171a587c48 [0,2,0,0,0,0|2,0,0]=4 17805 B13R1.158 CC(O)CCNc1ccccc1S 33348ebda76ff1a9e90cbc1bd6e5c4a9 [0,2,0,0,0,0|2,0,0]=4 17806 B13R1.158 CC(O)CCNc1ncc[nH]c1=O 3efbe719f6b7e227dd5bce124b25b65f [0,2,0,0,0,0|2,0,0]=4 17807 B13R1.158 CC(O)CCNc1ncccc1Br c4a0b64de456e7550a66bf607a628a25 [0,2,0,0,0,0|1,0,0]=3 17808 B13R1.158 CC(O)CCNc1ncccc1Cl 152a16c432edc6730471d6cabe1078e5 [0,2,0,0,0,0|1,0,0]=3 17809 B13R1.158 CC(O)CCNc1ncccc1F 7000ac892f74b039281b3318fbb84886 [0,2,0,0,0,0|1,0,0]=3 17810 B13R1.158 CC(O)CCNc1ncccc1I ce9bb4c809c200db55d31ca39c1a0abd [0,2,0,0,0,0|1,0,0]=3 17811 B13R1.158 CC(O)CCNc1nccnc1Br ef9c94a12363f289d1e4b193dd041e74 [0,2,0,0,0,0|2,0,0]=4 17812 B13R1.158 CC(O)CCNc1nccnc1Cl 94e25847463ecf6423fcbcf639d3cae9 [0,2,0,0,0,0|2,0,0]=4 17813 B13R1.158 CC(O)CCNc1nccnc1I 53a61fb977af8bbed1365822d4da3660 [0,2,0,0,0,0|2,0,0]=4 17814 B13R1.158 CC(O)CCNc1ncncc1Br f13b72e123baf8612726cef52abde00e [0,2,0,0,0,0|2,0,0]=4 17815 B13R1.158 CC(O)CCNc1ncncc1Cl 55c9aaac2b1554297131241ceacd88c6 [0,2,0,0,0,0|2,0,0]=4 17816 B13R1.158 CC(O)CCNc1ncncc1F c32416a422ccc15816433367133a8c62 [0,2,0,0,0,0|2,0,0]=4 17817 B13R1.158 CC(O)CCNc1ncncc1I 2e7f688181090fdfc4fec9bbaa8364b5 [0,2,0,0,0,0|2,0,0]=4 17818 B13R1.158 CC(O)CNCc1cccc[n+]1[O-] bcde407eb81fc956f4cab52b99bfa7fd [0,2,0,0,0,0|1,0,1]=4 17819 B13R1.158 CC(O)CNCc1ccccc1Br 413d3daff92f8cc55e3ba330d7c0c9e9 [0,2,0,0,0,0|2,0,0]=4 17820 B13R1.158 CC(O)CNCc1ccccc1Cl e6947468542ef26a1792e02fdee46b4a [0,2,0,0,0,0|2,0,0]=4 17821 B13R1.158 CC(O)CNCc1ccccc1F 02a3ed0a085689ca813f610238397c39 [0,2,0,0,0,0|2,0,0]=4 17822 B13R1.158 CC(O)CNCc1ccccc1I 5ad7e9d53b123e46daba5e0f5a622cc8 [0,2,0,0,0,0|2,0,0]=4 17823 B13R1.158 CC(O)CNCc1ncccc1Br 5e2ff8fb15288bc3593cdb944f3c0814 [0,2,0,0,0,0|1,0,0]=3 17824 B13R1.158 CC(O)CNCc1ncccc1Cl c009ccc1356908f47db148bd279356e5 [0,2,0,0,0,0|1,0,0]=3 17825 B13R1.158 CC(O)CNCc1ncccc1F 183891a477a7ef01131cbd0be48c2dc2 [0,2,0,0,0,0|1,0,0]=3 17826 B13R1.158 CC(O)CNCc1nccnc1Cl d8087493c228d60b64a3f089af0d4bdc [0,2,0,0,0,0|2,0,0]=4 17827 B13R1.158 CC(S)COCc1cccc[n+]1[O-] 2f210d499381b34de56fd6f3a3c73ba7 [0,2,0,0,0,0|1,0,1]=4 17828 B13R1.158 CC(S)COCc1ccccc1Br 8450876f73f6ba97083c0970b540fd7d [0,2,0,0,0,0|2,0,0]=4 17829 B13R1.158 CC(S)COCc1ccccc1Cl 785bf2e3c71cbb906fc44e0c823d71d2 [0,2,0,0,0,0|2,0,0]=4 17830 B13R1.158 CC(S)COCc1ccccc1F c1c258f29fd414dfed30e3d9e0bbf5c4 [0,2,0,0,0,0|2,0,0]=4 17831 B13R1.158 CC(S)COCc1ccccc1I b3f6f2e0ed3e18fa1d7e52610ab67194 [0,2,0,0,0,0|2,0,0]=4 17832 B13R1.158 CC(S)COCc1ncccc1Br dff87858b79867712144417cee9d6923 [0,2,0,0,0,0|1,0,0]=3 17833 B13R1.158 CC(S)COCc1ncccc1Cl 5ba3c4478278106319e404823ddcd741 [0,2,0,0,0,0|1,0,0]=3 17834 B13R1.158 CC(S)COCc1ncccc1F 2f9d7c2e17de8242597e3323e3a1a077 [0,2,0,0,0,0|1,0,0]=3 17835 B13R1.158 CC(S)COCc1nccnc1Cl 39aba7982268bc5a991cefbd2f2b79e4 [0,2,0,0,0,0|2,0,0]=4 17836 B13R1.158 CN(C)CCNc1ncccc1Br eb85815777d1168db6abbcf4e36d45af [0,2,0,0,0,0|2,0,0]=4 17837 B13R1.158 CN(C)CCNc1ncccc1Cl 102034cf90b0047ac07d13decb8bc20e [0,2,0,0,0,0|2,0,0]=4 17838 B13R1.158 CN(C)CCNc1ncccc1F 221cc1b1a26b0c1af555f09c39049dd2 [0,2,0,0,0,0|2,0,0]=4 17839 B13R1.158 CN(C)CCNc1ncccc1I b9d12e9d25cc88f1cb993cc629849254 [0,2,0,0,0,0|2,0,0]=4 17840 B13R1.158 CN(C)CCOc1ncccc1Br fa94771e9bf34ffb49664cf5a6cba73c [0,2,0,0,0,0|2,0,0]=4 17841 B13R1.158 CN(C)CCOc1ncccc1Cl 6ad78f295f0713d18b78493a5c400099 [0,2,0,0,0,0|2,0,0]=4 17842 B13R1.158 CN(C)CCOc1ncccc1F 47a9f9169d8ff5dded7c3a480c54c0fc [0,2,0,0,0,0|2,0,0]=4 17843 B13R1.158 CN(C)CNCc1ncccc1Br 852afd95cd512a14a7b80a05d82b7215 [0,2,0,0,0,0|2,0,0]=4 17844 B13R1.158 CN(C)CNCc1ncccc1Cl 5161b78d170e95ef40b981579815b47f [0,2,0,0,0,0|2,0,0]=4 17845 B13R1.158 CN(C)CNCc1ncccc1F 472774463ede40ed49189687c2533d65 [0,2,0,0,0,0|2,0,0]=4 17846 B13R1.158 CN(C)COCc1ncccc1Br b384b3d9b0cc0356889cba6eda8a51e5 [0,2,0,0,0,0|2,0,0]=4 17847 B13R1.158 CN(C)COCc1ncccc1Cl ff109129bb201b112579dc779b43fb03 [0,2,0,0,0,0|2,0,0]=4 17848 B13R1.158 CN(C)COCc1ncccc1F f656abb71a2b13551b2b2c12e6366a27 [0,2,0,0,0,0|2,0,0]=4 17849 B13R1.158 CS(=O)CCNc1ncccc1Br c19b2c107a41429e8a7cf877ea92aee3 [0,2,0,0,0,0|2,0,0]=4 17850 B13R1.158 CS(=O)CCNc1ncccc1Cl ffce8e9b08d934ee4a4d4dad22ebe5f9 [0,2,0,0,0,0|2,0,0]=4 17851 B13R1.158 CS(=O)CCNc1ncccc1F 29ee96653f8f46bc76bb679591500009 [0,2,0,0,0,0|2,0,0]=4 17852 B13R1.158 CS(=O)CCNc1ncccc1I 2bc3963189f8a495c280789335cb931f [0,2,0,0,0,0|2,0,0]=4 17853 B13R1.158 CS(=O)CCOc1ncccc1Br 0400a9ef1c8fd62d4199e72c47a9f544 [0,2,0,0,0,0|2,0,0]=4 17854 B13R1.158 CS(=O)CCOc1ncccc1Cl d5181ff7fb5f639a02dd3bd574a5fb91 [0,2,0,0,0,0|2,0,0]=4 17855 B13R1.158 CS(=O)CCOc1ncccc1F ae792fedebe494fa05398e62850ddc77 [0,2,0,0,0,0|2,0,0]=4 17856 B13R1.158 C[C@@H](F)COCc1cccc[n+]1[O-] d2873c07d7b753c8389e29ec8e0cc5f6 [0,2,0,0,0,0|1,0,1]=4 17857 B13R1.158 C[C@@H](F)COCc1ccccc1Cl e3fc71228144c0b967c7546ab2f57150 [0,2,0,0,0,0|2,0,0]=4 17858 B13R1.158 C[C@@H](F)COCc1ccccc1F b263a8888df53e0c4a0a9c8b7746368c [0,2,0,0,0,0|2,0,0]=4 17859 B13R1.158 C[C@@H](F)COCc1ccccc1I 5c9526e1519b9144d725a57e2610bdbc [0,2,0,0,0,0|2,0,0]=4 17860 B13R1.158 C[C@@H](F)COCc1ncccc1Br 431c3a658d47adae92720fd692d7e7b5 [0,2,0,0,0,0|1,0,0]=3 17861 B13R1.158 C[C@@H](F)COCc1ncccc1Cl 6a6c57173a11f3ffa7c7b2c367bd4bec [0,2,0,0,0,0|1,0,0]=3 17862 B13R1.158 C[C@@H](F)COCc1ncccc1F dc6b58aa1b0a698fecdc886cea4991ca [0,2,0,0,0,0|1,0,0]=3 17863 B13R1.158 C[C@@H](F)COCc1nccnc1Cl 198acd0c8cb2cdc92e2d8fe2b7f1dc03 [0,2,0,0,0,0|2,0,0]=4 17864 B13R1.158 C[C@@H](O)CCNc1cccc[n+]1[O-] 2d1d2e748a8dd7b8db847425abd90cc3 [0,2,0,0,0,0|1,0,1]=4 17865 B13R1.158 C[C@@H](O)CCNc1ncc[nH]c1=O 987bad1351b39ea9e63a1e1a04a35993 [0,2,0,0,0,0|2,0,0]=4 17866 B13R1.158 C[C@@H](O)CNCc1cccc[n+]1[O-] f979832b503eacf7fc0874cf58583286 [0,2,0,0,0,0|1,0,1]=4 17867 B13R1.158 C[C@@H](O)CNCc1ccccc1Br 918f2e816c796b900847e721c06d7d73 [0,2,0,0,0,0|2,0,0]=4 17868 B13R1.158 C[C@@H](O)CNCc1ccccc1Cl d393105c300a830d2c2bd5941489c025 [0,2,0,0,0,0|2,0,0]=4 17869 B13R1.158 C[C@@H](O)CNCc1ccccc1F 53f8822f5e5d46fd99ad188c8d247bd0 [0,2,0,0,0,0|2,0,0]=4 17870 B13R1.158 C[C@@H](O)CNCc1ccccc1I 9512361bf1a630808f7c9d278abded63 [0,2,0,0,0,0|2,0,0]=4 17871 B13R1.158 C[C@@H](O)CNCc1ncccc1Br dd6d43ebc936a4120d6302ae668ee291 [0,2,0,0,0,0|1,0,0]=3 17872 B13R1.158 C[C@@H](O)CNCc1ncccc1Cl dc3e8dd126ff51a9fd5da0e968b5fa3f [0,2,0,0,0,0|1,0,0]=3 17873 B13R1.158 C[C@@H](O)CNCc1ncccc1F 908d1f38212657b11d2559c8d070c2fd [0,2,0,0,0,0|1,0,0]=3 17874 B13R1.158 C[C@@H](O)CNCc1nccnc1Cl 210aae1bfad118a438d3bf71de358217 [0,2,0,0,0,0|2,0,0]=4 17875 B13R1.158 C[C@H](F)COCc1cccc[n+]1[O-] d5b6c13fe462687c9271789ce2205aed [0,2,0,0,0,0|1,0,1]=4 17876 B13R1.158 C[C@H](F)COCc1ccccc1Cl 627ea801010f0a6132b1bb4b320694aa [0,2,0,0,0,0|2,0,0]=4 17877 B13R1.158 C[C@H](F)COCc1ccccc1F 72a6b1051218c0a5766643a40e1146d0 [0,2,0,0,0,0|2,0,0]=4 17878 B13R1.158 C[C@H](F)COCc1ccccc1I d22f3864237cecaadf59342bb3450458 [0,2,0,0,0,0|2,0,0]=4 17879 B13R1.158 C[C@H](F)COCc1ncccc1Br 6f8ea389f5182f32589c30b533917f47 [0,2,0,0,0,0|1,0,0]=3 17880 B13R1.158 C[C@H](F)COCc1ncccc1Cl 171cc62e4537a9d50685146968ffa767 [0,2,0,0,0,0|1,0,0]=3 17881 B13R1.158 C[C@H](F)COCc1ncccc1F d5f13001840bb97684deed5d22aad333 [0,2,0,0,0,0|1,0,0]=3 17882 B13R1.158 C[C@H](F)COCc1nccnc1Cl 5fa016ccece6add474817d882249fb1c [0,2,0,0,0,0|2,0,0]=4 17883 B13R1.158 C[C@H](O)CCNc1cccc[n+]1[O-] 2b46f26309b69ac17422895b65fb2432 [0,2,0,0,0,0|1,0,1]=4 17884 B13R1.158 C[C@H](O)CCNc1ncc[nH]c1=O ccce8d90d31655d2f05c2e42ae0c006d [0,2,0,0,0,0|2,0,0]=4 17885 B13R1.158 C[C@H](O)CNCc1cccc[n+]1[O-] 192dbb1fe7e60c78d329d431164a31aa [0,2,0,0,0,0|1,0,1]=4 17886 B13R1.158 C[C@H](O)CNCc1ccccc1Br 6a65bc5095f2709be035b09e34b2272c [0,2,0,0,0,0|2,0,0]=4 17887 B13R1.158 C[C@H](O)CNCc1ccccc1Cl 9d127214782c796d8ca132e8650e2d99 [0,2,0,0,0,0|2,0,0]=4 17888 B13R1.158 C[C@H](O)CNCc1ccccc1F 10fff265b9422777ceba5d323c936a7c [0,2,0,0,0,0|2,0,0]=4 17889 B13R1.158 C[C@H](O)CNCc1ccccc1I 484524c8d5c927635712b8636cdcbd24 [0,2,0,0,0,0|2,0,0]=4 17890 B13R1.158 C[C@H](O)CNCc1ncccc1Br 4d6b749f1e1ea57fb9d3101cf6e1b4a3 [0,2,0,0,0,0|1,0,0]=3 17891 B13R1.158 C[C@H](O)CNCc1ncccc1Cl 27e806d61796b5759ae79eeae85c34e5 [0,2,0,0,0,0|1,0,0]=3 17892 B13R1.158 C[C@H](O)CNCc1ncccc1F dd45db9ee726c98a8ad839380249d521 [0,2,0,0,0,0|1,0,0]=3 17893 B13R1.158 C[C@H](O)CNCc1nccnc1Cl bd3387a7d9a9613e040b513e49b098ab [0,2,0,0,0,0|2,0,0]=4 17894 B13R1.158 Cc1ccccc1CNCC(C)C 8923d146fea180171fbbc22f54e50329 [0,2,0,0,0,0|2,0,0]=4 17895 B13R1.158 Cc1ccccc1CNCC(C)O 24a1e00122948f4da8d69d82b9b639a5 [0,2,0,0,0,0|2,0,0]=4 17896 B13R1.158 Cc1ccccc1CNC[C@@H](C)O 52fc843ce37f1d0b378a7a5e61d220c9 [0,2,0,0,0,0|2,0,0]=4 17897 B13R1.158 Cc1ccccc1CNC[C@H](C)O 7c0183b09c2e0d7e8dbe09dee18a1496 [0,2,0,0,0,0|2,0,0]=4 17898 B13R1.158 Cc1ccccc1COCC(C)C dc70d5f79c73bb88303f800f663117bf [0,2,0,0,0,0|2,0,0]=4 17899 B13R1.158 Cc1ccccc1COCC(C)F 88573ad4ea126ea328a72a6d66cea4c5 [0,2,0,0,0,0|2,0,0]=4 17900 B13R1.158 Cc1ccccc1COCC(C)S 70af1bbc55f9dac612c5d08391e01342 [0,2,0,0,0,0|2,0,0]=4 17901 B13R1.158 Cc1ccccc1COC[C@@H](C)F 98d22dc69e8c1426fd8aef1c7200de89 [0,2,0,0,0,0|2,0,0]=4 17902 B13R1.158 Cc1ccccc1COC[C@H](C)F b3b166dd5575bc4285c4b0d3ce2612de [0,2,0,0,0,0|2,0,0]=4 17903 B13R1.158 Cc1ccccc1NCCC(C)C 59063a52756ddbd974ebc80f35de4e60 [0,2,0,0,0,0|2,0,0]=4 17904 B13R1.158 Cc1ccccc1NCCC(C)O e4ff0c3f8869d01a30465c8bacb6a274 [0,2,0,0,0,0|2,0,0]=4 17905 B13R1.158 Cc1ccccc1OCCC(C)C 5f3bcefde459a2357fae5478a23eb7ee [0,2,0,0,0,0|2,0,0]=4 17906 B13R1.158 Cc1cccnc1CCNC(C)C 037caec0fffef9c67db922e800b3281b [0,2,0,0,0,0|1,0,0]=3 17907 B13R1.158 Cc1cccnc1CCOC(C)C 96d864397515ba39a1b5b10ecf21ea8d [0,2,0,0,0,0|1,0,0]=3 17908 B13R1.158 Cc1cccnc1CNCC(C)C 33d5370cf360f15bc062e37861a80753 [0,2,0,0,0,0|1,0,0]=3 17909 B13R1.158 Cc1cccnc1CNCC(C)O be002e6a4eff8b7153a51875772a1b3e [0,2,0,0,0,0|1,0,0]=3 17910 B13R1.158 Cc1cccnc1CNCC(F)F a0d0a8d5f45bd2a856c8d4d8d9288483 [0,2,0,0,0,0|2,0,0]=4 17911 B13R1.158 Cc1cccnc1CNCN(C)C c11723059be76688c716d70a42d7e956 [0,2,0,0,0,0|2,0,0]=4 17912 B13R1.158 Cc1cccnc1CNC[C@@H](C)O 0ac0403799c45aeeb1f980bdb2283160 [0,2,0,0,0,0|1,0,0]=3 17913 B13R1.158 Cc1cccnc1CNC[C@H](C)O bfbf897c9abce76673f6bf919125db4c [0,2,0,0,0,0|1,0,0]=3 17914 B13R1.158 Cc1cccnc1COCC(C)C d739b9eb912b78f4420dad3197bda277 [0,2,0,0,0,0|1,0,0]=3 17915 B13R1.158 Cc1cccnc1COCC(C)F c0d6e9b2d9f2a48cd5f99c97cb56c395 [0,2,0,0,0,0|1,0,0]=3 17916 B13R1.158 Cc1cccnc1COCC(C)S 4b556fe1817ceabbd7371ec6dd128b1a [0,2,0,0,0,0|1,0,0]=3 17917 B13R1.158 Cc1cccnc1COCC(F)F 5d6e2e59e2e97c75eaf0871d801b5a3d [0,2,0,0,0,0|2,0,0]=4 17918 B13R1.158 Cc1cccnc1COCN(C)C 985b629df50081f762a222a3d339b5ac [0,2,0,0,0,0|2,0,0]=4 17919 B13R1.158 Cc1cccnc1COC[C@@H](C)F 911cd42f4cd4daad8d2296bc2d305f84 [0,2,0,0,0,0|1,0,0]=3 17920 B13R1.158 Cc1cccnc1COC[C@H](C)F 2005f83344bf2e067eaa26e54be65aa8 [0,2,0,0,0,0|1,0,0]=3 17921 B13R1.158 Cc1cccnc1NCCC(C)C 68d919017c3383d07f7c84be0b1d344c [0,2,0,0,0,0|1,0,0]=3 17922 B13R1.158 Cc1cccnc1NCCC(C)O 53cb4568e71096c7f3e95b45f1636ee9 [0,2,0,0,0,0|1,0,0]=3 17923 B13R1.158 Cc1cccnc1NCCN(C)C a6993bc19086000544055ac341f82baa [0,2,0,0,0,0|2,0,0]=4 17924 B13R1.158 Cc1cccnc1NCCS(=O)C dc88d08be5c048c70b11ac5f09a3a98e [0,2,0,0,0,0|2,0,0]=4 17925 B13R1.158 Cc1cccnc1NCC[C@@H](C)O c90903c6cfbf39a1d9f9544ccb0432fa [0,2,0,0,0,0|1,0,0]=3 17926 B13R1.158 Cc1cccnc1NCC[C@H](C)O 28d63d3d87a7559e9949f2bb1af0c448 [0,2,0,0,0,0|1,0,0]=3 17927 B13R1.158 Cc1cccnc1NCOC(C)C 092126ad10d073791bc7c0f2ade321f8 [0,2,0,0,0,0|2,0,0]=4 17928 B13R1.158 Cc1cccnc1OCCC(C)C 925f5f5ebf45ba697acaa87eef9eef27 [0,2,0,0,0,0|1,0,0]=3 17929 B13R1.158 Cc1cccnc1OCCN(C)C cdafff294bb0dc8f0629b32fb109be3e [0,2,0,0,0,0|2,0,0]=4 17930 B13R1.158 Cc1cccnc1OCCS(=O)C fd321f3ba77bfcd1e283a2c299c17739 [0,2,0,0,0,0|2,0,0]=4 17931 B13R1.158 Cc1cccnc1OCOC(C)C d483defc393e4f6ea37133e5ecfe8a31 [0,2,0,0,0,0|2,0,0]=4 17932 B13R1.158 Cc1ccnnc1CNCC(C)C 007dfa2c224e33513a4e5b8b3d7261d7 [0,2,0,0,0,0|2,0,0]=4 17933 B13R1.158 Cc1ccnnc1CNCC(C)O f700c9263acd76c77da0d7de2a7b5cae [0,2,0,0,0,0|2,0,0]=4 17934 B13R1.158 Cc1ccnnc1CNC[C@@H](C)O 181c4dca6be7cd115258607f2627b872 [0,2,0,0,0,0|2,0,0]=4 17935 B13R1.158 Cc1ccnnc1CNC[C@H](C)O baa1ba9c191a65f3c0c8806ae0fa7014 [0,2,0,0,0,0|2,0,0]=4 17936 B13R1.158 Cc1ccnnc1COCC(C)C 0354984417afe51221bccae02dd52182 [0,2,0,0,0,0|2,0,0]=4 17937 B13R1.158 Cc1ccnnc1NCCC(C)C 92d485247446d082d8b797e34a984013 [0,2,0,0,0,0|2,0,0]=4 17938 B13R1.158 Cc1ccnnc1NCCC(C)O 0fdc1efd3ac15edec82bad0ad9747a92 [0,2,0,0,0,0|2,0,0]=4 17939 B13R1.158 Cc1ccnnc1OCCC(C)C 208abc1229bd27b63b5fbb459390567b [0,2,0,0,0,0|2,0,0]=4 17940 B13R1.158 Cc1cncnc1NCCC(C)C 18177d1b295a1a4ca9ee97b8c6131c88 [0,2,0,0,0,0|2,0,0]=4 17941 B13R1.158 Cc1cncnc1NCCC(C)O 60202b736fc377e26d4521adb691fc2f [0,2,0,0,0,0|2,0,0]=4 17942 B13R1.158 Cc1cncnc1OCCC(C)C dbc19667afef9ac412920a451e812923 [0,2,0,0,0,0|2,0,0]=4 17943 B13R1.158 Cc1nccnc1CCOC(C)C 6056986c953f29e355e03b65467e1ac6 [0,2,0,0,0,0|2,0,0]=4 17944 B13R1.158 Cc1nccnc1CNCC(C)C fc0e0489f34766acb267a21e1275ad52 [0,2,0,0,0,0|2,0,0]=4 17945 B13R1.158 Cc1nccnc1CNCC(C)O 5daf6e56550129de7d0bb9df96c1aa59 [0,2,0,0,0,0|2,0,0]=4 17946 B13R1.158 Cc1nccnc1CNC[C@@H](C)O 82b0b676b4c31f0c22a70ae23aeae7a8 [0,2,0,0,0,0|2,0,0]=4 17947 B13R1.158 Cc1nccnc1CNC[C@H](C)O d7cc23b2fa4157696456e2a88398bae0 [0,2,0,0,0,0|2,0,0]=4 17948 B13R1.158 Cc1nccnc1COCC(C)C ff4ee76b1104f3736df68dd40966077c [0,2,0,0,0,0|2,0,0]=4 17949 B13R1.158 Cc1nccnc1COCC(C)F 2b50dd4a7f387cf3854566140aaa9d6b [0,2,0,0,0,0|2,0,0]=4 17950 B13R1.158 Cc1nccnc1COCC(C)S 7240667672e22a69b71bdff649ca15b1 [0,2,0,0,0,0|2,0,0]=4 17951 B13R1.158 Cc1nccnc1COC[C@@H](C)F e9514bf236687c2e8735fa1be931f2ff [0,2,0,0,0,0|2,0,0]=4 17952 B13R1.158 Cc1nccnc1COC[C@H](C)F 6e41c7c77eedfad2db7a272db89726e8 [0,2,0,0,0,0|2,0,0]=4 17953 B13R1.158 Cc1nccnc1NCCC(C)C bf3ace0754af7d3ba3cb2d8eeb9925d5 [0,2,0,0,0,0|2,0,0]=4 17954 B13R1.158 Cc1nccnc1NCCC(C)O 8f57ac4c329508772981aa4c8d102fbe [0,2,0,0,0,0|2,0,0]=4 17955 B13R1.158 Cc1nccnc1OCCC(C)C 524ba922409401ce6017cfb33ce48606 [0,2,0,0,0,0|2,0,0]=4 17956 B13R1.158 FC(F)CNCc1ncccc1Br 0cd85e022f130f066bc0a845b66d4c59 [0,2,0,0,0,0|2,0,0]=4 17957 B13R1.158 FC(F)CNCc1ncccc1Cl ebc9d25303de87dc32111d045f583bbd [0,2,0,0,0,0|2,0,0]=4 17958 B13R1.158 FC(F)COCc1ncccc1Br 1edd946ddecfd92602c0a33150b9aca5 [0,2,0,0,0,0|2,0,0]=4 17959 B13R1.158 FC(F)COCc1ncccc1Cl 00a99cc53f04d06a4a186fc47a3fb747 [0,2,0,0,0,0|2,0,0]=4 17960 B13R1.158 Fc1cccnc1CNCC(F)F d5507e93dede57a35375656e80da0941 [0,2,0,0,0,0|2,0,0]=4 17961 B13R1.158 Fc1cccnc1COCC(F)F 83f67f0e1b5778503a5f45f4ce93d641 [0,2,0,0,0,0|2,0,0]=4 17962 B13R1.3523 CC(C)(Br)COCc1ccccc1 09a2aea7670059b2ee833bdc0acefff4 [0,2,0,0,0,0|2,0,0]=4 17963 B13R1.3523 CC(C)(Br)COCc1ccccn1 de13c9782fe4890825cffadc194169ea [0,2,0,0,0,0|1,0,0]=3 17964 B13R1.3523 CC(C)(Br)COCc1cccnn1 cccaa42ae70092bc75cefa7b5db9a2d7 [0,2,0,0,0,0|2,0,0]=4 17965 B13R1.3523 CC(C)(Br)COCc1ccncn1 e5e37f9708272b1b5abaaeb10438fed6 [0,2,0,0,0,0|2,0,0]=4 17966 B13R1.3523 CC(C)(Br)COCc1ncccn1 1275664d3ff6a3da48473e013bf3e771 [0,2,0,0,0,0|2,0,0]=4 17967 B13R1.3523 CC(C)(C)CCNc1ccccc1 e4eb5853055cf692dd43a46b2d2d1231 [0,2,0,0,0,0|2,0,0]=4 17968 B13R1.3523 CC(C)(C)CCNc1ccccn1 4cd867408c22b55d687eb53c2130c125 [0,2,0,0,0,0|1,0,0]=3 17969 B13R1.3523 CC(C)(C)CCNc1cccnn1 3463cee97d202cfd2c224d1375513f9c [0,2,0,0,0,0|2,0,0]=4 17970 B13R1.3523 CC(C)(C)CCNc1ccncn1 8effb7806088ff1ef21711da936df56a [0,2,0,0,0,0|2,0,0]=4 17971 B13R1.3523 CC(C)(C)CCNc1cnccn1 af3375fb3bed4824984046f49bc5ddcc [0,2,0,0,0,0|2,0,0]=4 17972 B13R1.3523 CC(C)(C)CCNc1ncccn1 21a765dd01fe60aa8ea2c3401d8af430 [0,2,0,0,0,0|2,0,0]=4 17973 B13R1.3523 CC(C)(C)CCOc1ccccn1 b208b5936e012e4194e0f03e3c86e817 [0,2,0,0,0,0|1,0,0]=3 17974 B13R1.3523 CC(C)(C)CCOc1cnccn1 c5c96285f0dc4f198265faa0bab413fe [0,2,0,0,0,0|2,0,0]=4 17975 B13R1.3523 CC(C)(C)CCOc1ncccn1 d3cc281a6387d93d084b3b14e5e03238 [0,2,0,0,0,0|2,0,0]=4 17976 B13R1.3523 CC(C)(C)CNCc1ccccc1 120dce255af61d3f27a86b6df5546e6d [0,2,0,0,0,0|2,0,0]=4 17977 B13R1.3523 CC(C)(C)CNCc1ccccn1 c4805cba29de1d6693b9042fc74d05d0 [0,2,0,0,0,0|1,0,0]=3 17978 B13R1.3523 CC(C)(C)CNCc1cccnn1 df15765cba90ff0ffed43f00b53b995a [0,2,0,0,0,0|2,0,0]=4 17979 B13R1.3523 CC(C)(C)CNCc1ccncn1 38717ddf870312d3acdb171fc6c4b9f8 [0,2,0,0,0,0|2,0,0]=4 17980 B13R1.3523 CC(C)(C)CNCc1cnccn1 304c7325127eaa65a504e67f2d30bd70 [0,2,0,0,0,0|2,0,0]=4 17981 B13R1.3523 CC(C)(C)CNCc1ncccn1 9bff1bc8d3e1a1f73192ddd47ef7db8a [0,2,0,0,0,0|2,0,0]=4 17982 B13R1.3523 CC(C)(C)COCc1ccccc1 88c36added3761c571c82c9bcdd32e34 [0,2,0,0,0,0|2,0,0]=4 17983 B13R1.3523 CC(C)(C)COCc1ccccn1 7ff580475ef9002f26e342dfb145886c [0,2,0,0,0,0|1,0,0]=3 17984 B13R1.3523 CC(C)(C)COCc1cccnn1 b238c6146ce9f545d38a3692971d2669 [0,2,0,0,0,0|2,0,0]=4 17985 B13R1.3523 CC(C)(C)COCc1ccncn1 8ada534fadd08e29db72915e57d97267 [0,2,0,0,0,0|2,0,0]=4 17986 B13R1.3523 CC(C)(C)COCc1cnccn1 f7b5b4c8138d1e3b7bc770716543a60a [0,2,0,0,0,0|2,0,0]=4 17987 B13R1.3523 CC(C)(C)COCc1ncccn1 b2148cc5820e56db4f5f57ac1d566475 [0,2,0,0,0,0|2,0,0]=4 17988 B13R1.3523 CC(C)(C)NCCc1ccccc1 3f7d750835adb5f58961ed6ea0ec8491 [0,2,0,0,0,0|2,0,0]=4 17989 B13R1.3523 CC(C)(C)NCCc1ccccn1 0a3eb93443b7ba9219a6e04606787e1e [0,2,0,0,0,0|1,0,0]=3 17990 B13R1.3523 CC(C)(F)CCNc1ccccc1 9ca5eb616b5c64c965352963d8743c51 [0,2,0,0,0,0|2,0,0]=4 17991 B13R1.3523 CC(C)(F)CCNc1cccnn1 178b573fa6dcaee1c23d8064ff154cab [0,2,0,0,0,0|2,0,0]=4 17992 B13R1.3523 CC(C)(F)CCNc1ccncn1 3a95029baac9cc8899e5002861bbf4b3 [0,2,0,0,0,0|2,0,0]=4 17993 B13R1.3523 CC(C)(F)CNCc1ccccc1 e89be8c1438a67cc2a6a0da11380728d [0,2,0,0,0,0|2,0,0]=4 17994 B13R1.3523 CC(C)(F)CNCc1ccccn1 4f2c52a604c86dfa2100268d1eb8332c [0,2,0,0,0,0|1,0,0]=3 17995 B13R1.3523 CC(C)(F)CNCc1cccnn1 9e718bce718761b6f4285e22e8e2b1ef [0,2,0,0,0,0|2,0,0]=4 17996 B13R1.3523 CC(C)(F)CNCc1ccncn1 fd04f50f29ec040c146834e5f77675dd [0,2,0,0,0,0|2,0,0]=4 17997 B13R1.3523 CC(C)(F)CNCc1cnccn1 d53017577297c9d8431f8541c5a7aa58 [0,2,0,0,0,0|2,0,0]=4 17998 B13R1.3523 CC(C)(F)CNCc1ncccn1 ce75ab1b4715cf2406d120c8844103fd [0,2,0,0,0,0|2,0,0]=4 17999 B13R1.3523 CC(C)(F)COCc1ccccc1 73208540f130f922b7ebf79f516d6005 [0,2,0,0,0,0|2,0,0]=4 18000 B13R1.3523 CC(C)(F)COCc1ccccn1 3f0e87a884a6b4c77f5b47f2309fb724 [0,2,0,0,0,0|1,0,0]=3 18001 B13R1.3523 CC(C)(F)COCc1cccnn1 083e4238eb21749a409136bcb04811b0 [0,2,0,0,0,0|2,0,0]=4 18002 B13R1.3523 CC(C)(F)COCc1ccncn1 87ee5a3f70f23eaecf8d8c50faea90ae [0,2,0,0,0,0|2,0,0]=4 18003 B13R1.3523 CC(C)(F)COCc1cnccn1 ad4dcb3140b757f9b50349160545a03d [0,2,0,0,0,0|2,0,0]=4 18004 B13R1.3523 CC(C)(F)COCc1ncccn1 90003a26098d982d33816a839d73b67f [0,2,0,0,0,0|2,0,0]=4 18005 B13R1.3523 CC(C)(O)CCNc1ccccc1 c4f5ba88bd1187928d72373d155556e0 [0,2,0,0,0,0|2,0,0]=4 18006 B13R1.3523 CC(C)(O)CCNc1ccccn1 079af5d016e8429727e358ff16f33e24 [0,2,0,0,0,0|1,0,0]=3 18007 B13R1.3523 CC(C)(O)CCNc1cccnn1 055eb2d8e544e84cdcb5fa411a172e35 [0,2,0,0,0,0|2,0,0]=4 18008 B13R1.3523 CC(C)(O)CCNc1ccncn1 2d047f69f58ff0abc468fcfb1b4fa113 [0,2,0,0,0,0|2,0,0]=4 18009 B13R1.3523 CC(C)(O)CCNc1cnccn1 abde09bbbcdbe5b1fd5d82e1f8977b1e [0,2,0,0,0,0|2,0,0]=4 18010 B13R1.3523 CC(C)(O)CCNc1ncccn1 77330569ec0652b22be99ce59c2fade1 [0,2,0,0,0,0|2,0,0]=4 18011 B13R1.3523 CC(C)(O)CCOc1ccccn1 4c2a8627e8924908c4da06c4e02b783e [0,2,0,0,0,0|1,0,0]=3 18012 B13R1.3523 CC(C)(O)CCOc1cnccn1 fb2f7648cee029910c3f89b53af137f9 [0,2,0,0,0,0|2,0,0]=4 18013 B13R1.3523 CC(C)(O)CCOc1ncccn1 a62a61e8da63dda1c83b0bb58a766da4 [0,2,0,0,0,0|2,0,0]=4 18014 B13R1.3523 CC(C)(O)CNCc1ccccc1 ac03deab52d134fd4f2ecc3aba4f9893 [0,2,0,0,0,0|2,0,0]=4 18015 B13R1.3523 CC(C)(O)CNCc1ccccn1 f35897152b0f65dc1b7b40ae25f0932a [0,2,0,0,0,0|1,0,0]=3 18016 B13R1.3523 CC(C)(O)CNCc1cccnn1 db342340d9980bd8eaaa2eeb559027c4 [0,2,0,0,0,0|2,0,0]=4 18017 B13R1.3523 CC(C)(O)CNCc1ccncn1 09ac9f04a455ade62411183de50ae694 [0,2,0,0,0,0|2,0,0]=4 18018 B13R1.3523 CC(C)(O)CNCc1cnccn1 b3611a9ceae8d959631d4142a48b94bd [0,2,0,0,0,0|2,0,0]=4 18019 B13R1.3523 CC(C)(O)CNCc1ncccn1 3305feeab06da73b1d11421e0f0b887a [0,2,0,0,0,0|2,0,0]=4 18020 B13R1.3523 CC(C)(O)COCc1ccccc1 61e7e7507275b8dcd72c7dd1f7a3ecee [0,2,0,0,0,0|2,0,0]=4 18021 B13R1.3523 CC(C)(O)COCc1ccccn1 20bec6710064573e132c08a86cbc5155 [0,2,0,0,0,0|1,0,0]=3 18022 B13R1.3523 CC(C)(O)COCc1cccnn1 c2d0979bcda7904efebc940ec2ab20a6 [0,2,0,0,0,0|2,0,0]=4 18023 B13R1.3523 CC(C)(O)COCc1ccncn1 69fea8d5a7c18a574fbe0a2753d8128f [0,2,0,0,0,0|2,0,0]=4 18024 B13R1.3523 CC(C)(O)COCc1cnccn1 e451257022e8a8e171a22f5383d08591 [0,2,0,0,0,0|2,0,0]=4 18025 B13R1.3523 CC(C)(O)COCc1ncccn1 b82c7dd93a2f4a6fb11e6c80b6f4f428 [0,2,0,0,0,0|2,0,0]=4 18026 B13R1.3523 CC(C)(S)COCc1ccccc1 149a9f519f2ca316fa0c7da7548e2256 [0,2,0,0,0,0|2,0,0]=4 18027 B13R1.3523 CC(C)(S)COCc1ccccn1 8235aab20d494630bea03733e8dde4b2 [0,2,0,0,0,0|1,0,0]=3 18028 B13R1.3523 CC(C)(S)COCc1cccnn1 44219519fac3ab7ed337f958962bcbce [0,2,0,0,0,0|2,0,0]=4 18029 B13R1.3523 CC(C)(S)COCc1ccncn1 3d96021590008c973a2ffa76a0349a5d [0,2,0,0,0,0|2,0,0]=4 18030 B13R1.3523 CC(C)(S)COCc1ncccn1 f943993a366c2e86636e52e8e824809b [0,2,0,0,0,0|2,0,0]=4 18031 B13R1.3523 CC(F)(F)CCNc1ccccc1 59e2148c1ea7a8b812217853a2f23bf7 [0,2,0,0,0,0|2,0,0]=4 18032 B13R1.3523 CC(F)(F)CCNc1ccccn1 ce713a952589fb9653ce7d472b02d228 [0,2,0,0,0,0|1,0,0]=3 18033 B13R1.3523 CC(F)(F)CCNc1cccnn1 bbf259b8146caa9349724254671f32eb [0,2,0,0,0,0|2,0,0]=4 18034 B13R1.3523 CC(F)(F)CCNc1ccncn1 de52bf372ae5312095ad0c0d3c17c785 [0,2,0,0,0,0|2,0,0]=4 18035 B13R1.3523 CC(F)(F)CCNc1cnccn1 1e7c8d0cdfcff6aba65470890dd10cb6 [0,2,0,0,0,0|2,0,0]=4 18036 B13R1.3523 CC(F)(F)CCNc1ncccn1 48f4a97c455f799b7072b194980ee65b [0,2,0,0,0,0|2,0,0]=4 18037 B13R1.3523 CC(F)(F)CCOc1ccccn1 a9888061d16516b214c9e917639ca78b [0,2,0,0,0,0|1,0,0]=3 18038 B13R1.3523 CC(F)(F)CCOc1cnccn1 31bcf8ac46791053717937479be82083 [0,2,0,0,0,0|2,0,0]=4 18039 B13R1.3523 CC(F)(F)CCOc1ncccn1 227d6649c58942592ceae1bcb1524548 [0,2,0,0,0,0|2,0,0]=4 18040 B13R1.3523 CC(F)(F)CNCc1ccccc1 f5d1c85105402783fee3f128e5288419 [0,2,0,0,0,0|2,0,0]=4 18041 B13R1.3523 CC(F)(F)CNCc1ccccn1 86685edba1350e1bd14c59916d61f04c [0,2,0,0,0,0|1,0,0]=3 18042 B13R1.3523 CC(F)(F)CNCc1cccnn1 7aa3dd8b145eb18734f5156fd6f6b2ba [0,2,0,0,0,0|2,0,0]=4 18043 B13R1.3523 CC(F)(F)CNCc1ccncn1 4a3fa2244bfb7c930ebc89b4dcb0ad95 [0,2,0,0,0,0|2,0,0]=4 18044 B13R1.3523 CC(F)(F)CNCc1cnccn1 cc26e2180880108720ed8e7998ab5930 [0,2,0,0,0,0|2,0,0]=4 18045 B13R1.3523 CC(F)(F)CNCc1ncccn1 47125c1df590be00c6a59a7ad32c6873 [0,2,0,0,0,0|2,0,0]=4 18046 B13R1.3523 CC(F)(F)COCc1ccccc1 c289f26370a34cda22ba40d65eb1bb90 [0,2,0,0,0,0|2,0,0]=4 18047 B13R1.3523 CC(F)(F)COCc1ccccn1 b241a16d3e52cb65e3c6077039bd9fc1 [0,2,0,0,0,0|1,0,0]=3 18048 B13R1.3523 CC(F)(F)COCc1cccnn1 bd09c6e47458a91fa15778a009788a13 [0,2,0,0,0,0|2,0,0]=4 18049 B13R1.3523 CC(F)(F)COCc1ccncn1 1aac6738618564cfda4d4b54ef7eb25e [0,2,0,0,0,0|2,0,0]=4 18050 B13R1.3523 CC(F)(F)COCc1cnccn1 560f07f3a07eecf4c6ff0fa15730e04f [0,2,0,0,0,0|2,0,0]=4 18051 B13R1.3523 CC(F)(F)COCc1ncccn1 7500157d8927475527f112b799e114b3 [0,2,0,0,0,0|2,0,0]=4 18052 B13R1.3523 CS(=O)(=O)CCNc1ccccn1 a3ca3debc3322d6be150f79b34f22675 [0,2,0,0,0,0|2,0,0]=4 18053 B13R1.3523 CS(=O)(=O)CCOc1ccccn1 4ff190152b97cc71b99bd7290b851c34 [0,2,0,0,0,0|2,0,0]=4 18054 B13R1.3523 CS(=O)(=O)CNCc1ccccn1 cc1691e555873ef21bc4a7f2bd3414a0 [0,2,0,0,0,0|2,0,0]=4 18055 B13R1.3523 CS(=O)(=O)COCc1ccccn1 d40e92b028f1b9c9d253e4bdeb99eeb1 [0,2,0,0,0,0|2,0,0]=4 18056 B13R1.3523 FC(F)(Br)COCc1ccccn1 8edffa9aa6f6942194e96bad464dfe6c [0,2,0,0,0,0|2,0,0]=4 18057 B13R1.3523 FC(F)(Cl)COCc1ccccn1 fdf431ecc5c0dc3b1e94cd59a0b48f2c [0,2,0,0,0,0|2,0,0]=4 18058 B13R1.3523 FC(F)(F)CCNc1ccccn1 acc110a375746e6c53bc626447306a7b [0,2,0,0,0,0|2,0,0]=4 18059 B13R1.3523 FC(F)(F)CCOc1ccccn1 a686fe21ee7ca52f92211fe7a3cb4e0f [0,2,0,0,0,0|2,0,0]=4 18060 B13R1.3523 FC(F)(F)CNCc1ccccn1 18cba10f8223ad783c2b62c2d8cc70a0 [0,2,0,0,0,0|2,0,0]=4 18061 B13R1.3523 FC(F)(F)COCc1ccccn1 d149be472f70f6173298ad37698e78c5 [0,2,0,0,0,0|2,0,0]=4 18062 B13R1.84 C#Cc1ccccc1COCCC ae5e290b103fab68450c3cffeadd7978 [0,2,0,0,0,0|2,0,0]=4 18063 B13R1.84 C#Cc1ccccc1NCCCC 767634f0977d9a8a31a107c4a0ab330c [0,2,0,0,0,0|2,0,0]=4 18064 B13R1.84 C#Cc1ccccc1OCCCC bf0e74db9a5ff0fdab6f39db8f6fda19 [0,2,0,0,0,0|2,0,0]=4 18065 B13R1.84 C#Cc1cccnc1NCCCC 913b39df3f3ffded2552d16b02ae87eb [0,2,0,0,0,0|1,0,0]=3 18066 B13R1.84 C#Cc1cccnc1NCCCF aae8e5cf968e06b136833f4c2152fa8b [0,2,0,0,0,0|2,0,0]=4 18067 B13R1.84 C#Cc1cccnc1NCCCO 67b7815dce3d8eb34b8b7f8b5a41070c [0,2,0,0,0,0|2,0,0]=4 18068 B13R1.84 C#Cc1cccnc1NCCCS f046586fe5357eb41eea8f11b674659f [0,2,0,0,0,0|2,0,0]=4 18069 B13R1.84 C#Cc1cccnc1NCCOC ec2213934f4494b35ae756cbe8822764 [0,2,0,0,0,0|2,0,0]=4 18070 B13R1.84 C#Cc1cccnc1NCCSC f8b81cbb9da233873af4b8e4f66df3c0 [0,2,0,0,0,0|2,0,0]=4 18071 B13R1.84 C#Cc1cccnc1NCOCC 6ad092e984084aeeeac07f7434edd546 [0,2,0,0,0,0|2,0,0]=4 18072 B13R1.84 C#Cc1cccnc1OCCCC d5db93adfd93791b4fd1133e6eadaf72 [0,2,0,0,0,0|1,0,0]=3 18073 B13R1.84 C#Cc1cccnc1OCCCF 906c02a0b15168c102d7f5f7f1f0ad70 [0,2,0,0,0,0|2,0,0]=4 18074 B13R1.84 C#Cc1cccnc1OCCCS 2aff34747af58dfdaa52608d023758f1 [0,2,0,0,0,0|2,0,0]=4 18075 B13R1.84 C#Cc1cccnc1OCCOC e6369dc31e7f2683d8685201444bd45d [0,2,0,0,0,0|2,0,0]=4 18076 B13R1.84 C#Cc1cccnc1OCCSC 49fd187f762cc913021f70d61fbaba77 [0,2,0,0,0,0|2,0,0]=4 18077 B13R1.84 C#Cc1cccnc1OCOCC f0851a3eec357166ba777d6b027864d9 [0,2,0,0,0,0|2,0,0]=4 18078 B13R1.84 C#Cc1nccnc1NCCCC e471aa233cafd265b79ed4d333e3cec4 [0,2,0,0,0,0|2,0,0]=4 18079 B13R1.84 C=Cc1ccccc1CNCCC aa12ab271f4ef82a273e5b539a30c7db [0,2,0,0,0,0|2,0,0]=4 18080 B13R1.84 C=Cc1ccccc1COCCC adb4cb9377ed9f1aca8565ca35a20c98 [0,2,0,0,0,0|2,0,0]=4 18081 B13R1.84 C=Cc1ccccc1NCCCC e96a0e2e40aac67a1c1d7ada520b81d8 [0,2,0,0,0,0|2,0,0]=4 18082 B13R1.84 C=Cc1ccccc1OCCCC 5c1e379c5e6618f7936fbfe8a6795f33 [0,2,0,0,0,0|2,0,0]=4 18083 B13R1.84 C=Cc1cccnc1NCCCC f57fc202b520238ace41df414016d5d1 [0,2,0,0,0,0|1,0,0]=3 18084 B13R1.84 C=Cc1cccnc1NCCCCl b73a336b88b47ab03490605c03d0c0e7 [0,2,0,0,0,0|2,0,0]=4 18085 B13R1.84 C=Cc1cccnc1NCCCO b27f68177260805d700514f6efab58c9 [0,2,0,0,0,0|2,0,0]=4 18086 B13R1.84 C=Cc1cccnc1NCCOC f53a6593fd76ec6eb14a8c5a0f92cae3 [0,2,0,0,0,0|2,0,0]=4 18087 B13R1.84 C=Cc1cccnc1NCCSC cc8e2d460f0dc682be5f0d7588bf02f0 [0,2,0,0,0,0|2,0,0]=4 18088 B13R1.84 CCCCNc1ccccc1C#N 341663b33f64365450326472e54d85a4 [0,2,0,0,0,0|2,0,0]=4 18089 B13R1.84 CCCCNc1ccccc1C=O f64d572dcfdb32b666e636e87c017be7 [0,2,0,0,0,0|2,0,0]=4 18090 B13R1.84 CCCCNc1ccccc1CBr cdf8b485c5bdbed98a6271bc6e6aa0d8 [0,2,0,0,0,0|2,0,0]=4 18091 B13R1.84 CCCCNc1ccccc1CC 25757d2ddca7a7fcc3137c0cc88bd032 [0,2,0,0,0,0|2,0,0]=4 18092 B13R1.84 CCCCNc1ccccc1CO 85cafbd0cead53e20acb298d90f08aa0 [0,2,0,0,0,0|2,0,0]=4 18093 B13R1.84 CCCCNc1ccccc1CS 91aae57e12ba72681119ba62feb7808b [0,2,0,0,0,0|2,0,0]=4 18094 B13R1.84 CCCCNc1ccccc1OC 3625fefc6d8741beadea6fd03eed5d9e [0,2,0,0,0,0|2,0,0]=4 18095 B13R1.84 CCCCNc1ccccc1SC beecb4e28a7191aaecdd4f50031e8bfc [0,2,0,0,0,0|2,0,0]=4 18096 B13R1.84 CCCCNc1ncccc1C#N 713e2aade6162d6120b41d429f02a6dc [0,2,0,0,0,0|1,0,0]=3 18097 B13R1.84 CCCCNc1ncccc1C=O 1a9c0f481d164e359c2ea022fce440ee [0,2,0,0,0,0|1,0,0]=3 18098 B13R1.84 CCCCNc1ncccc1CC cfee253cb00c58a52b135729c1443ed5 [0,2,0,0,0,0|1,0,0]=3 18099 B13R1.84 CCCCNc1ncccc1CCl 4ecaa1484aa186f92ea00f4ca58097ae [0,2,0,0,0,0|1,0,0]=3 18100 B13R1.84 CCCCNc1ncccc1CO 60ce6704afa3ea87d448598a1dc614e3 [0,2,0,0,0,0|1,0,0]=3 18101 B13R1.84 CCCCNc1ncccc1NO c528004d6460f24b0883fcf7a803d974 [0,2,0,0,0,0|1,0,0]=3 18102 B13R1.84 CCCCNc1ncccc1OC 25f02f046b05a0821736d3975d324fff [0,2,0,0,0,0|1,0,0]=3 18103 B13R1.84 CCCCNc1ncccc1SC 37d44422f84bb4c1f10f9a46425743e3 [0,2,0,0,0,0|1,0,0]=3 18104 B13R1.84 CCCCNc1nccnc1C#N 9bcc53c99683cb76a6cfe886ad527051 [0,2,0,0,0,0|2,0,0]=4 18105 B13R1.84 CCCCNc1nccnc1C=O a4d1db60b03a81168b5d23c1d8fb50e2 [0,2,0,0,0,0|2,0,0]=4 18106 B13R1.84 CCCCNc1nccnc1CC ab72e6932890b5de1e39b231cfab740b [0,2,0,0,0,0|2,0,0]=4 18107 B13R1.84 CCCCNc1nccnc1CO a16bcf955111427d8f9fe4266425c812 [0,2,0,0,0,0|2,0,0]=4 18108 B13R1.84 CCCCNc1nccnc1OC 3f3f585213d746be38edbabe74e63717 [0,2,0,0,0,0|2,0,0]=4 18109 B13R1.84 CCCCNc1ncncc1C#N 0072be8eb93694e5875ada6b884d0afc [0,2,0,0,0,0|2,0,0]=4 18110 B13R1.84 CCCCNc1ncncc1C=O 6df9693697fe1164717bb23f16d4f78f [0,2,0,0,0,0|2,0,0]=4 18111 B13R1.84 CCCCNc1ncncc1CO b06628e4bdcc873861d0bcd4e3e5a988 [0,2,0,0,0,0|2,0,0]=4 18112 B13R1.84 CCCCNc1ncncc1OC a9e28b5065fef2ec058336832b6b3b6f [0,2,0,0,0,0|2,0,0]=4 18113 B13R1.84 CCCCNc1nnccc1C#N 260b40f5cb3951d1ae4014827e53e944 [0,2,0,0,0,0|2,0,0]=4 18114 B13R1.84 CCCCOc1ccccc1C#N 071ff9c07b54e887e77845df371e1255 [0,2,0,0,0,0|2,0,0]=4 18115 B13R1.84 CCCCOc1ccccc1C=O b7f9ed60c3982a9f54914b0ba0a5e7db [0,2,0,0,0,0|2,0,0]=4 18116 B13R1.84 CCCCOc1ccccc1CC 98798d57bbe87fc69ba382004976ea76 [0,2,0,0,0,0|2,0,0]=4 18117 B13R1.84 CCCCOc1ccccc1OC 61886701b0235df51c026acabf3bd09f [0,2,0,0,0,0|2,0,0]=4 18118 B13R1.84 CCCCOc1ccccc1SC 41f7121d4a1a502aa0d2f928b7dc3168 [0,2,0,0,0,0|2,0,0]=4 18119 B13R1.84 CCCCOc1ncccc1CC bd1a8be38c53e1df1a158d1b645a2239 [0,2,0,0,0,0|1,0,0]=3 18120 B13R1.84 CCCCOc1ncncc1C#N 44be22229622926256b9e49325d80dc0 [0,2,0,0,0,0|2,0,0]=4 18121 B13R1.84 CCCCOc1ncncc1CC b9e66f970cdd27037710b5ab1dec9039 [0,2,0,0,0,0|2,0,0]=4 18122 B13R1.84 CCCNCc1ccccc1C#N 80a4db79efaee89c359d78646a340dda [0,2,0,0,0,0|2,0,0]=4 18123 B13R1.84 CCCNCc1ccccc1C=O 15059cbb8b73c1bae74cdf8e4873b58e [0,2,0,0,0,0|2,0,0]=4 18124 B13R1.84 CCCNCc1ccccc1CC 6a7541f0ab0d76b4ecbf70557838c2fe [0,2,0,0,0,0|2,0,0]=4 18125 B13R1.84 CCCNCc1ccccc1CO 3bbc15ab54ddd676da994c5d42a5ddc8 [0,2,0,0,0,0|2,0,0]=4 18126 B13R1.84 CCCNCc1ccccc1OC da4288346f0abd655805af9c258cd861 [0,2,0,0,0,0|2,0,0]=4 18127 B13R1.84 CCCNCc1ccccc1SC 1322042db604d5cf50387e400496a611 [0,2,0,0,0,0|2,0,0]=4 18128 B13R1.84 CCCNCc1ncccc1C#N 32cc9a2113033685382fbc14ecd6a017 [0,2,0,0,0,0|1,0,0]=3 18129 B13R1.84 CCCNCc1ncccc1OC 5b98b9c397a4e75fa79d9d90799312f6 [0,2,0,0,0,0|1,0,0]=3 18130 B13R1.84 CCCNCc1nccnc1OC 7542a692d84c4585f78bef50dfdf0117 [0,2,0,0,0,0|2,0,0]=4 18131 B13R1.84 CCCOCc1ccccc1C#N e76a4544e9ac6516aaac35d05eb310d2 [0,2,0,0,0,0|2,0,0]=4 18132 B13R1.84 CCCOCc1ccccc1C=O e039f4214ca37aec78248bcf926085fd [0,2,0,0,0,0|2,0,0]=4 18133 B13R1.84 CCCOCc1ccccc1CC ab8b23b5ca4fb9c590abe57326166edf [0,2,0,0,0,0|2,0,0]=4 18134 B13R1.84 CCCOCc1ccccc1OC ff74273f66609ae94fed5ec23eb33694 [0,2,0,0,0,0|2,0,0]=4 18135 B13R1.84 CCCOCc1ccccc1SC 7bb93c1137552f43889623e2cfbc3e7a [0,2,0,0,0,0|2,0,0]=4 18136 B13R1.84 CCCOCc1ncccc1C#N 99a6a44a27b834babc8cbed492c7310c [0,2,0,0,0,0|1,0,0]=3 18137 B13R1.84 CCCOCc1ncccc1OC 53f00eb56da398e8da881430d9f095fe [0,2,0,0,0,0|1,0,0]=3 18138 B13R1.84 CCCOCc1ncccc1SC a69a4c808d317775912e395e01d10e21 [0,2,0,0,0,0|1,0,0]=3 18139 B13R1.84 CCCOCc1nccnc1OC ddbc3f03df819406a9ee5b6944438ff3 [0,2,0,0,0,0|2,0,0]=4 18140 B13R1.84 CCNCCc1ccccc1OC 232f6102f8cda6163f548ab08f296337 [0,2,0,0,0,0|2,0,0]=4 18141 B13R1.84 CCOCCc1ccccc1C#N f274becb92b713b287af744641823f13 [0,2,0,0,0,0|2,0,0]=4 18142 B13R1.84 CCOCCc1ccccc1OC a4eca690d96fc0b55cd0b8eaeb680ed3 [0,2,0,0,0,0|2,0,0]=4 18143 B13R1.84 CCOCCc1ncccc1OC b691c397e8f24203015b3a671dcd20ae [0,2,0,0,0,0|1,0,0]=3 18144 B13R1.84 CCOCNc1ncccc1C#N c710702cb22fce74951a18c137a73066 [0,2,0,0,0,0|2,0,0]=4 18145 B13R1.84 CCOCNc1ncccc1C=O 560dbd61b9623afaa0804e8be0b85e9e [0,2,0,0,0,0|2,0,0]=4 18146 B13R1.84 CCOCNc1ncccc1CC 66ae8d7fb7f3c6767d8262f951cac59d [0,2,0,0,0,0|2,0,0]=4 18147 B13R1.84 CCOCNc1ncccc1CCl c25be9859f3c4243f71d6efef15b88eb [0,2,0,0,0,0|2,0,0]=4 18148 B13R1.84 CCOCNc1ncccc1CO 69acc86cbbfdb9f17f79459ba4c035bc [0,2,0,0,0,0|2,0,0]=4 18149 B13R1.84 CCOCNc1ncccc1OC cdaa61434f822bc5bbbbe402881e7153 [0,2,0,0,0,0|2,0,0]=4 18150 B13R1.84 CCOCOc1ncccc1CC 1787d83a12376c2d0429b1cc41fe194c [0,2,0,0,0,0|2,0,0]=4 18151 B13R1.84 CCc1cccnc1NCCCCl 930841a24800c956ddc5ebcb34370d6a [0,2,0,0,0,0|2,0,0]=4 18152 B13R1.84 CCc1cccnc1NCCCF 03db9635dbba276ad375ab34853043da [0,2,0,0,0,0|2,0,0]=4 18153 B13R1.84 CCc1cccnc1NCCCO 88abc5bbca829756d724a7f02d240ec5 [0,2,0,0,0,0|2,0,0]=4 18154 B13R1.84 CCc1cccnc1NCCCS b3b43993eb6bf41ba441dd1d2ad0cb05 [0,2,0,0,0,0|2,0,0]=4 18155 B13R1.84 CCc1cccnc1NCCOC f099a61d9909595d99a6833112851ece [0,2,0,0,0,0|2,0,0]=4 18156 B13R1.84 CCc1cccnc1NCCSC 9e8bb3e495e60169a9b8866a1d32ef62 [0,2,0,0,0,0|2,0,0]=4 18157 B13R1.84 CCc1cccnc1OCCCF 61b033ffeba222c1fe4458336a9a1584 [0,2,0,0,0,0|2,0,0]=4 18158 B13R1.84 CCc1cccnc1OCCCS 50b9285b613624375c940aecf71ada39 [0,2,0,0,0,0|2,0,0]=4 18159 B13R1.84 CCc1cccnc1OCCOC 84cece2d199ecbc53d0d01e6e796c75b [0,2,0,0,0,0|2,0,0]=4 18160 B13R1.84 CCc1cccnc1OCCSC eb64be23c022be1b90ddf864cae8daa1 [0,2,0,0,0,0|2,0,0]=4 18161 B13R1.84 COCCNc1ncccc1C#N ca0862656c5c5bae1e75d9830f2766cc [0,2,0,0,0,0|2,0,0]=4 18162 B13R1.84 COCCNc1ncccc1C=O 1d300ae628a94dfd451c762cbe9f62b4 [0,2,0,0,0,0|2,0,0]=4 18163 B13R1.84 COCCNc1ncccc1CCl 661eccb1bec6274f27d617d46c2d4381 [0,2,0,0,0,0|2,0,0]=4 18164 B13R1.84 COCCNc1ncccc1CO a9a5c5b250384ff7f8b557b75d055900 [0,2,0,0,0,0|2,0,0]=4 18165 B13R1.84 COCCNc1ncccc1NO ac9fd70d978362053dfe51bf80f80cab [0,2,0,0,0,0|2,0,0]=4 18166 B13R1.84 COCCNc1ncccc1OC 2140fdd8bbfc217965ace3a6b449ea7c [0,2,0,0,0,0|2,0,0]=4 18167 B13R1.84 COCCNc1ncccc1SC 1b8330a37b45aa3e2837f6fcd3e8bcd1 [0,2,0,0,0,0|2,0,0]=4 18168 B13R1.84 COCNCc1ncccc1OC 865cf4e9636fea1d2c5bd1aaf62de5a8 [0,2,0,0,0,0|2,0,0]=4 18169 B13R1.84 COCOCc1ncccc1C#N a3f79eaf69c3c39b159f76ab0689cb51 [0,2,0,0,0,0|2,0,0]=4 18170 B13R1.84 COCOCc1ncccc1OC ffd327dcfd98be3779b652dbf1ccbf58 [0,2,0,0,0,0|2,0,0]=4 18171 B13R1.84 COCOCc1ncccc1SC 663dee911c38f252a3ace48e2adfded5 [0,2,0,0,0,0|2,0,0]=4 18172 B13R1.84 COc1cccnc1CCOCF 743745dc2be391112ea95e0bc1c1e544 [0,2,0,0,0,0|2,0,0]=4 18173 B13R1.84 COc1cccnc1CNCCBr 0ec9d7ab49c49b514aa0e2cde749fbee [0,2,0,0,0,0|2,0,0]=4 18174 B13R1.84 COc1cccnc1CNCCF 58c631850a6d8972578b085efa8a9b72 [0,2,0,0,0,0|2,0,0]=4 18175 B13R1.84 COc1cccnc1CNCCI ce01179385d9e01f70c3386e3e7c5df2 [0,2,0,0,0,0|2,0,0]=4 18176 B13R1.84 COc1cccnc1CNCCO 285a90d4558706076ba53a0b69cbfad8 [0,2,0,0,0,0|2,0,0]=4 18177 B13R1.84 COc1cccnc1CNCCS cb8927758a39a1fd8575f7f06858106c [0,2,0,0,0,0|2,0,0]=4 18178 B13R1.84 COc1cccnc1CNCSC 5a40e4992a8a37239863cb376f84191c [0,2,0,0,0,0|2,0,0]=4 18179 B13R1.84 COc1cccnc1COCCF 5d474c060c0f34db01ae2fec838a5478 [0,2,0,0,0,0|2,0,0]=4 18180 B13R1.84 COc1cccnc1COCCS 653d5b8bb9d99d5c06316d09494261c6 [0,2,0,0,0,0|2,0,0]=4 18181 B13R1.84 COc1cccnc1COCSC 59a801f3cba9871ea953025a600cd36b [0,2,0,0,0,0|2,0,0]=4 18182 B13R1.84 COc1cccnc1NCCCCl a1c00ea51e0a84137b8928b59d8b0286 [0,2,0,0,0,0|2,0,0]=4 18183 B13R1.84 COc1cccnc1NCCCF 5b7a450b8bd466431f190a11649e5073 [0,2,0,0,0,0|2,0,0]=4 18184 B13R1.84 COc1cccnc1NCCCO 72b283b43527f6e6272698c5f4b1ec06 [0,2,0,0,0,0|2,0,0]=4 18185 B13R1.84 COc1cccnc1NCCCS 56a50d4ddfeb53d1b1678c2b5f38c3b4 [0,2,0,0,0,0|2,0,0]=4 18186 B13R1.84 COc1cccnc1NCCSC 898f6eae88ed0b0dadf62d815fd8fe6c [0,2,0,0,0,0|2,0,0]=4 18187 B13R1.84 CSCCNc1ncccc1C#N 66ba6a0fa1ef8a0fdda68e5d1e79da41 [0,2,0,0,0,0|2,0,0]=4 18188 B13R1.84 CSCCNc1ncccc1C=O 04e337d409d076dddd10773a97ef9389 [0,2,0,0,0,0|2,0,0]=4 18189 B13R1.84 CSCCNc1ncccc1CCl 4e75f00417187b9e16c43dc02e9d4865 [0,2,0,0,0,0|2,0,0]=4 18190 B13R1.84 CSCCNc1ncccc1CO 181bd9cc363e242805c02a090bab8e49 [0,2,0,0,0,0|2,0,0]=4 18191 B13R1.84 CSCCNc1ncccc1SC b6b5dd9cd3835684846337b01ea5d899 [0,2,0,0,0,0|2,0,0]=4 18192 B13R1.84 CSCOCc1ncccc1SC 5aa8c3f90f25f277a38f161cd16a4532 [0,2,0,0,0,0|2,0,0]=4 18193 B13R1.84 CSc1cccnc1COCCF 7d32ed40042af808158e6c34a9548d88 [0,2,0,0,0,0|2,0,0]=4 18194 B13R1.84 CSc1cccnc1COCCS 70c92cc7445a08c82044faa8d6572fc1 [0,2,0,0,0,0|2,0,0]=4 18195 B13R1.84 CSc1cccnc1NCCCCl c24ac548c77840d8b2e93955a2b04628 [0,2,0,0,0,0|2,0,0]=4 18196 B13R1.84 CSc1cccnc1NCCCF 6cd2bf9063457ca216862ab5d22bb29f [0,2,0,0,0,0|2,0,0]=4 18197 B13R1.84 CSc1cccnc1NCCCO a0de0e9b7af6b6f134db3b416c54cf54 [0,2,0,0,0,0|2,0,0]=4 18198 B13R1.84 CSc1cccnc1NCCCS 034be56c93c2371b80954a9a1a2b03b5 [0,2,0,0,0,0|2,0,0]=4 18199 B13R1.84 FCCCNc1ncccc1CCl c4c7adf025322e89190da874bc3c4ca5 [0,2,0,0,0,0|2,0,0]=4 18200 B13R1.84 N#Cc1cccnc1CNCCBr c762be47aba9ff362c05872f55a1d866 [0,2,0,0,0,0|2,0,0]=4 18201 B13R1.84 N#Cc1cccnc1CNCCF ef71601b825549b53345d43919f80975 [0,2,0,0,0,0|2,0,0]=4 18202 B13R1.84 N#Cc1cccnc1CNCCI 316b62bce1b5467bc8948810e51a9b17 [0,2,0,0,0,0|2,0,0]=4 18203 B13R1.84 N#Cc1cccnc1CNCCO 3ca2df1eee2bb7660bc728a8f5caa80f [0,2,0,0,0,0|2,0,0]=4 18204 B13R1.84 N#Cc1cccnc1CNCCS afaf00a4742fdcf061db1e057ccf0aa2 [0,2,0,0,0,0|2,0,0]=4 18205 B13R1.84 N#Cc1cccnc1COCCF 49102ea096b29fd63d615aa32711d0b2 [0,2,0,0,0,0|2,0,0]=4 18206 B13R1.84 N#Cc1cccnc1COCCS cd5970e54fff10b116df50f90d799ead [0,2,0,0,0,0|2,0,0]=4 18207 B13R1.84 N#Cc1cccnc1NCCCCl 95e063a6949eb000f4d5721a3822783a [0,2,0,0,0,0|2,0,0]=4 18208 B13R1.84 N#Cc1cccnc1NCCCF 24e3c101d1458a0eaa9a8b517981ccf2 [0,2,0,0,0,0|2,0,0]=4 18209 B13R1.84 N#Cc1cccnc1NCCCO 1dff2f4b34db774b404ac37c9607c71e [0,2,0,0,0,0|2,0,0]=4 18210 B13R1.84 N#Cc1cccnc1NCCCS e12ab1bd156994e6c857b8cd9280fe35 [0,2,0,0,0,0|2,0,0]=4 18211 B13R1.84 O=Cc1cccnc1NCCCCl 7981efdbbc837ce9784bc41bb0ace1b7 [0,2,0,0,0,0|2,0,0]=4 18212 B13R1.84 O=Cc1cccnc1NCCCF 7105b6e06e11b840a7c5b49b5a8646c6 [0,2,0,0,0,0|2,0,0]=4 18213 B13R1.84 O=Cc1cccnc1NCCCO b7acf6d8f27687aaf1261d86b4316553 [0,2,0,0,0,0|2,0,0]=4 18214 B13R1.84 O=Cc1cccnc1NCCCS 33a73bf7fed67216b2698ab92b4e7f59 [0,2,0,0,0,0|2,0,0]=4 18215 B13R1.84 OCCCNc1ncccc1CCl feb53f881ed8ca267e2530e20de374e2 [0,2,0,0,0,0|2,0,0]=4 18216 B13R1.84 OCCCNc1ncccc1CO d1544bcf0e3d51650d18e2c27d1392f5 [0,2,0,0,0,0|2,0,0]=4 18217 B13R1.84 OCCCNc1ncccc1NO b2c58d5ca05caf13dbfc90a9a9ca93f2 [0,2,0,0,0,0|2,0,0]=4 18218 B13R1.84 OCc1cccnc1NCCCCl 0f9555d0a5b6a592435c703df01770f7 [0,2,0,0,0,0|2,0,0]=4 18219 B13R1.84 OCc1cccnc1NCCCF d69057c50d1ee30294d24dd8db2c728e [0,2,0,0,0,0|2,0,0]=4 18220 B13R1.84 OCc1cccnc1NCCCS 768dec53ea8ad052a870be67f64ac55f [0,2,0,0,0,0|2,0,0]=4 18221 B13R1.84 ONc1cccnc1NCCCCl e06fa86451aaf3ff2e7ba521b8d29b9c [0,2,0,0,0,0|2,0,0]=4 18222 B13R1.84 SCCCNc1ncccc1CCl 274f20aead54ebe0c4b1bcbe534b7e74 [0,2,0,0,0,0|2,0,0]=4 18223 B13R1.8919 CCCCNc1c(cccc1C)C ab0ef058949f310aff3b1e0e46d95184 [0,2,0,0,0,0|2,0,0]=4 18224 B13R1.8919 CCCCNc1c(cccc1Cl)C 95b9cf62afb5bffdba0d93bc6440d4cf [0,2,0,0,0,0|2,0,0]=4 18225 B13R1.8919 CCCCNc1c(cccc1Cl)Cl 75dc7868a0bcca85cb929efb4f99d76c [0,2,0,0,0,0|2,0,0]=4 18226 B13R1.8919 CCCCNc1c(cccc1Cl)F 185aa48eea4f37334afea71e7ced35f4 [0,2,0,0,0,0|2,0,0]=4 18227 B13R1.8919 CCCCNc1c(cccc1Cl)S b0ea6f55034812fbd3eee261e8f7432a [0,2,0,0,0,0|2,0,0]=4 18228 B13R1.8919 CCCCNc1c(cccc1F)C cefd248ffd44537d5ee47d40d6af1076 [0,2,0,0,0,0|2,0,0]=4 18229 B13R1.8919 CCCCNc1c(cccc1F)F 2746587010ee74532d7043b55aa7b47e [0,2,0,0,0,0|2,0,0]=4 18230 B13R1.8919 CCCCNc1c(cccc1I)C b149a317869d047691d9957b29811f4f [0,2,0,0,0,0|2,0,0]=4 18231 B13R1.8919 CCCCNc1c(cccc1I)Cl 00cc5d93adcb57a8f9a1714ba131d310 [0,2,0,0,0,0|2,0,0]=4 18232 B13R1.8919 CCCCNc1c(cccc1I)F fa17d3a405d2164e401ece1317dbc5e5 [0,2,0,0,0,0|2,0,0]=4 18233 B13R1.8919 CCCCNc1c(cccc1S)F 61b5bd140a9096a8b79bdd7e2e0776b0 [0,2,0,0,0,0|2,0,0]=4 18234 B13R1.8919 CCCCOc1c(cccc1Br)Br d6003be65edef22d7f5a6f2b892f0de6 [0,2,0,0,0,0|2,0,0]=4 18235 B13R1.8919 CCCCOc1c(cccc1Br)C fe9ee5527b07ee493c0afb0314e1111f [0,2,0,0,0,0|2,0,0]=4 18236 B13R1.8919 CCCCOc1c(cccc1Br)Cl cdeb3345389de8a2232d65e68727f3ba [0,2,0,0,0,0|2,0,0]=4 18237 B13R1.8919 CCCCOc1c(cccc1Br)F 0aca59a768bb94d87e0ee161050962ce [0,2,0,0,0,0|2,0,0]=4 18238 B13R1.8919 CCCCOc1c(cccc1C)C 9ec51f4cf4e90a2d00ccb42bede5534d [0,2,0,0,0,0|2,0,0]=4 18239 B13R1.8919 CCCCOc1c(cccc1Cl)C db42d4e20c2391d749fde7c62f2b4e51 [0,2,0,0,0,0|2,0,0]=4 18240 B13R1.8919 CCCCOc1c(cccc1Cl)Cl 983a033ff662825559cfb00dccbefe9a [0,2,0,0,0,0|2,0,0]=4 18241 B13R1.8919 CCCCOc1c(cccc1Cl)F b5a53b2772c426ae36c8afa540c5aac6 [0,2,0,0,0,0|2,0,0]=4 18242 B13R1.8919 CCCCOc1c(cccc1F)C 55e818572a54e94fe2bdc447096eff8e [0,2,0,0,0,0|2,0,0]=4 18243 B13R1.8919 CCCCOc1c(cccc1F)F d98b46f6e6337d7a75ff9a3e14bdaaa8 [0,2,0,0,0,0|2,0,0]=4 18244 B13R1.8919 CCCCOc1c(cccc1I)C c5c4a79227b2b80ffbb46e1393ed8d7b [0,2,0,0,0,0|2,0,0]=4 18245 B13R1.8919 CCCCOc1c(cccc1I)Cl 7b860015691f8e674052da4c1b62ae50 [0,2,0,0,0,0|2,0,0]=4 18246 B13R1.8919 CCCCOc1c(cccc1I)F efc657a20c9e03d2629d02514b2a5ab7 [0,2,0,0,0,0|2,0,0]=4 18247 B13R1.8919 CCCCOc1c(cccc1I)I d383b07078f273ab5ce3bd68046e9af4 [0,2,0,0,0,0|2,0,0]=4 18248 B13R1.8919 CCCNCc1c(cccc1Br)Br 2c794a883caf41b1a29d674397877c75 [0,2,0,0,0,0|2,0,0]=4 18249 B13R1.8919 CCCNCc1c(cccc1Br)C 70c28d1ba191e70a4bff688636318cca [0,2,0,0,0,0|2,0,0]=4 18250 B13R1.8919 CCCNCc1c(cccc1Br)Cl 3adb90f785a12b6cce7307f60d270f2d [0,2,0,0,0,0|2,0,0]=4 18251 B13R1.8919 CCCNCc1c(cccc1Br)F ff5917343447e98b871d1e3ff601d95b [0,2,0,0,0,0|2,0,0]=4 18252 B13R1.8919 CCCNCc1c(cccc1C)C e78afa5648772b893e9b56fda1436882 [0,2,0,0,0,0|2,0,0]=4 18253 B13R1.8919 CCCNCc1c(cccc1Cl)C 792586b6ef97a880cdfa0574f4b009cd [0,2,0,0,0,0|2,0,0]=4 18254 B13R1.8919 CCCNCc1c(cccc1Cl)Cl 93e6481ce2b2fd0c5f7b6068d044554f [0,2,0,0,0,0|2,0,0]=4 18255 B13R1.8919 CCCNCc1c(cccc1Cl)F 1cf529d5e98232f3561bac1a4e55af00 [0,2,0,0,0,0|2,0,0]=4 18256 B13R1.8919 CCCNCc1c(cccc1F)C be24b5d945c646faf842a33bcb199b9e [0,2,0,0,0,0|2,0,0]=4 18257 B13R1.8919 CCCNCc1c(cccc1F)F 6f52db2244ddc2a3791465746c06c7ee [0,2,0,0,0,0|2,0,0]=4 18258 B13R1.8919 CCCNCc1c(cccc1I)Br cd3e2acae72eede9eb27e9a82e6deb44 [0,2,0,0,0,0|2,0,0]=4 18259 B13R1.8919 CCCNCc1c(cccc1I)C b59b2b8b772bfd724e40afc08d90e06d [0,2,0,0,0,0|2,0,0]=4 18260 B13R1.8919 CCCNCc1c(cccc1I)Cl a4a8542b711888074d7be3b90d6c8b96 [0,2,0,0,0,0|2,0,0]=4 18261 B13R1.8919 CCCNCc1c(cccc1I)F 44e4518583bb04c01340df5452615483 [0,2,0,0,0,0|2,0,0]=4 18262 B13R1.8919 CCCOCc1c(cccc1Br)Br 1b5ff96a0f8709a49f41e0ef40e3ac7b [0,2,0,0,0,0|2,0,0]=4 18263 B13R1.8919 CCCOCc1c(cccc1Br)C 9ae9048424b49d67870a336a992e37bf [0,2,0,0,0,0|2,0,0]=4 18264 B13R1.8919 CCCOCc1c(cccc1Br)Cl 8186ab191429e8235085b469a9614cd0 [0,2,0,0,0,0|2,0,0]=4 18265 B13R1.8919 CCCOCc1c(cccc1Br)F 90b996f5f30678f93a0bc1be37bf3106 [0,2,0,0,0,0|2,0,0]=4 18266 B13R1.8919 CCCOCc1c(cccc1C)C 8b658211ae8ff3174b67b60707445b8c [0,2,0,0,0,0|2,0,0]=4 18267 B13R1.8919 CCCOCc1c(cccc1Cl)C fa32383a61a9e9d47591df2fba8d7fb8 [0,2,0,0,0,0|2,0,0]=4 18268 B13R1.8919 CCCOCc1c(cccc1Cl)Cl e96fadfb82db8fa3f5d5362ec86167ec [0,2,0,0,0,0|2,0,0]=4 18269 B13R1.8919 CCCOCc1c(cccc1Cl)F 160e9b393c0dc7043839c0523c719045 [0,2,0,0,0,0|2,0,0]=4 18270 B13R1.8919 CCCOCc1c(cccc1F)C 46ed4bff770de4ee79038bc6b8ec6207 [0,2,0,0,0,0|2,0,0]=4 18271 B13R1.8919 CCCOCc1c(cccc1F)F 5cddef113438686089152c0e836b3c42 [0,2,0,0,0,0|2,0,0]=4 18272 B13R1.8919 CCCOCc1c(cccc1I)Br c3487a598db3ceeb0fde22783fa51229 [0,2,0,0,0,0|2,0,0]=4 18273 B13R1.8919 CCCOCc1c(cccc1I)C 939c9ccc960c3d622b876f5e5a230f13 [0,2,0,0,0,0|2,0,0]=4 18274 B13R1.8919 CCCOCc1c(cccc1I)Cl ae2d50815d8f404a3690a02da05b3e0e [0,2,0,0,0,0|2,0,0]=4 18275 B13R1.8919 CCCOCc1c(cccc1I)F 94c2c9da16bf3e316853a1dd3397402d [0,2,0,0,0,0|2,0,0]=4 18276 B13R1.8919 CCNCCc1c(cccc1C)C 8b2c85876cb8ce256309b569f58fb235 [0,2,0,0,0,0|2,0,0]=4 18277 B13R1.8919 CCNCCc1c(cccc1Cl)Cl c651437ee6c168d970f732d9eef11806 [0,2,0,0,0,0|2,0,0]=4 18278 B13R1.8919 CCOCCc1c(cccc1Br)Cl 155ffaa2ec1462c1e11cf65f77b63f5d [0,2,0,0,0,0|2,0,0]=4 18279 B13R1.8919 CCOCCc1c(cccc1C)C 064e02bf80f507abba6e5a28cb707ca7 [0,2,0,0,0,0|2,0,0]=4 18280 B13R1.8919 CCOCCc1c(cccc1Cl)Cl 535bfc75722cb6ae4fabe511d57b41b6 [0,2,0,0,0,0|2,0,0]=4 18281 B13R1.8919 CCOCCc1c(cccc1Cl)F 176455a694eb11e3cd38ae963f0993a1 [0,2,0,0,0,0|2,0,0]=4 18282 B13R1.8919 CCOCCc1c(cccc1F)F 9622d6b4d3b14632ffea45e0a9b16ccc [0,2,0,0,0,0|2,0,0]=4 18283 B11R1.283 C=C/C=C/C(=O)NC1CC1C 03e281bceb0c0e566d3bc825536554f2 [0,0,1,1,0,0|2,0,0]=4 18284 B11R1.283 C=C/C=C\C(=O)NC1CC1C a7a0a69ef58e898a0c1a5405502b62ab [0,0,1,1,0,0|2,0,0]=4 18285 B11R1.283 C=CC=CC(=O)NC1CC1C 718d7b6455d432ccb09f854529129d60 [0,0,1,1,0,0|2,0,0]=4 18286 B11R1.284 C=C/C=C/C(=O)NC1CCC1 7e2be66c0c2c1a930b1821a10f8550cb [0,0,1,1,0,0|2,0,0]=4 18287 B11R1.284 C=C/C=C\C(=O)NC1CCC1 c3b752f5cdcb549ac39b464773005763 [0,0,1,1,0,0|2,0,0]=4 18288 B11R1.284 C=CC=CC(=O)NC1CCC1 648edb58675446a132a215f9e3886e26 [0,0,1,1,0,0|2,0,0]=4 18289 B11R1.285 C=C/C=C/C(=O)NCC1CC1 24a049ee19631a41d5c1798266bdcba6 [0,0,1,1,0,0|2,0,0]=4 18290 B11R1.285 C=C/C=C\C(=O)NCC1CC1 92137225be475ac8f6f91f996e9359f3 [0,0,1,1,0,0|2,0,0]=4 18291 B11R1.285 C=CC=CC(=O)NCC1CC1 7e617210913b30958bbd606c36e51421 [0,0,1,1,0,0|2,0,0]=4 18292 B11R2.238 c1ccc(cc1)NC2CC2 0cca6617983212a2989086e88698db73 [1,0,0,1,0,0|2,0,0]=4 18293 B11R2.238 c1ccc(nc1)OC2CC2 05f70841461656fba19d4e6cae35b4c4 [1,0,0,1,0,0|1,0,0]=3 18294 B11R2.238 c1cnc(nc1)NC2CC2 18a3c8f8b7f13eb4b818328df7a99401 [1,0,0,1,0,0|2,0,0]=4 18295 B11R2.5 CC1CC1Nc2ccoc2 f306e4fc391a67fbda2e38594357206d [0,0,0,1,1,0|2,0,0]=4 18296 B11R2.5 CC1CC1Nc2ncc[nH]2 8717ab2eff46c2877a88636cf3de1211 [0,0,0,1,1,0|2,0,0]=4 18297 B11R2.5 CC1CC1Nc2ncco2 da24961eb2a36a22de9a7e21978b1ab4 [0,0,0,1,1,0|2,0,0]=4 18298 B11R2.5 CC1CC1Nc2nccs2 35db904ad8c85e2fe57090415dd4e002 [0,0,0,1,1,0|2,0,0]=4 18299 B11R2.191 CCN1CCn2c1ccn2 9e78d5a87d61b8ea3372a8dd69f1e5c0 [0,0,0,1,1,0|2,0,0]=4 18300 B11R2.237 c1c[nH]c(n1)CN2CCC2 17402354dd6f0f1310cff4e72eba983c [0,0,0,1,1,0|2,0,0]=4 18301 B11R2.237 c1c[nH]c(n1)NC2CCC2 4372bf21d7e00261cb94246e6105d244 [0,0,0,1,1,0|2,0,0]=4 18302 B11R2.237 c1cc(cs1)CN2CCC2 9049c6c75800c4cc6b25e1fe3349dfbb [0,0,0,1,1,0|2,0,0]=4 18303 B11R2.237 c1cc(cs1)NC2CCC2 7543eecfd06dbf9b2d319186ea7968ae [0,0,0,1,1,0|2,0,0]=4 18304 B11R2.237 c1cc(cs1)OC2CCC2 6eecea36d0237e37b62c16f474c843b0 [0,0,0,1,1,0|2,0,0]=4 18305 B11R2.237 c1cc(n[nH]1)NC2CCC2 4ec21b2262f468480fe0501adde99d36 [0,0,0,1,1,0|2,0,0]=4 18306 B11R2.237 c1cc(no1)CN2CCC2 8b96ee479c2c3ccccc0016d12ab5cc20 [0,0,0,1,1,0|2,0,0]=4 18307 B11R2.237 c1cnn(c1)OC2CCC2 c51382b38b4a80223451a3882e1fdf14 [0,0,0,1,1,0|2,0,0]=4 18308 B11R2.237 c1coc(c1)CN2CCC2 3e50eaf83d3960c7b6f520b714cdd595 [0,0,0,1,1,0|2,0,0]=4 18309 B11R2.237 c1coc(c1)OC2CCC2 f5af9146d5a318e10ab5a7606f12d4d4 [0,0,0,1,1,0|2,0,0]=4 18310 B11R2.237 c1coc(n1)CN2CCC2 94cb80fde298004e3507d3c464206d90 [0,0,0,1,1,0|2,0,0]=4 18311 B11R2.237 c1csc(c1)CN2CCC2 61f74da87acdf0e734416416174ecede [0,0,0,1,1,0|2,0,0]=4 18312 B11R2.237 c1csc(n1)CN2CCC2 437e6047eb6b0af04795bdafe485e1ee [0,0,0,1,1,0|2,0,0]=4 18313 B11R2.237 c1csc(n1)OC2CCC2 14fc5a83b3b5ad432bb9f5b067995817 [0,0,0,1,1,0|2,0,0]=4 18314 B11R2.237 c1nc(c[nH]1)OC2CCC2 cb9787f12fba2a6c223c299a8423d4ee [0,0,0,1,1,0|2,0,0]=4 18315 B11R2.237 c1nc(co1)CN2CCC2 14c2c0ad56cd73cf9cd1b7fb9b68c77d [0,0,0,1,1,0|2,0,0]=4 18316 B11R2.237 c1nc(cs1)CN2CCC2 3f2b605fd79db0250057f6d5842b1914 [0,0,0,1,1,0|2,0,0]=4 18317 B11R2.385 c1c[nH]c(c1)CNC2CC2 59a6e11358ca50c2f19af30cfbe39db3 [0,0,0,1,1,0|1,0,1]=4 18318 B11R2.385 c1c[nH]c(c1)COC2CC2 d023f1c2c116ea6d7b44d3da54d9b0f1 [0,0,0,1,1,0|1,0,1]=4 18319 B11R2.385 c1c[nH]c(n1)CNC2CC2 990e9bbf8c8c488fdb04996ede2cc90f [0,0,0,1,1,0|2,0,0]=4 18320 B11R2.385 c1c[nH]c(n1)COC2CC2 00e2c0d6adc1526bcc42e3a0bc39cf75 [0,0,0,1,1,0|2,0,0]=4 18321 B11R2.385 c1c[nH]c(n1)NCC2CC2 86de190578d0d618dac1c095d2e4c772 [0,0,0,1,1,0|2,0,0]=4 18322 B11R2.385 c1cc(c[nH]1)CNC2CC2 b804be65a578e905cf1da0545215b041 [0,0,0,1,1,0|2,0,0]=4 18323 B11R2.385 c1cc(c[nH]1)COC2CC2 a7ad929daa8f7f6a5d59ff785d008798 [0,0,0,1,1,0|2,0,0]=4 18324 B11R2.385 c1cc(co1)COC2CC2 35d9e97d12fac95a3d58a489c841e98a [0,0,0,1,1,0|2,0,0]=4 18325 B11R2.385 c1cc(co1)NCC2CC2 1e87185fea84c46c84fa920c9940d803 [0,0,0,1,1,0|2,0,0]=4 18326 B11R2.385 c1cc(cs1)CNC2CC2 a7820cfb7ecff9c89452b6027bd3a5e2 [0,0,0,1,1,0|2,0,0]=4 18327 B11R2.385 c1cc(cs1)COC2CC2 068b9eca04e3b48769d624ee7f31aca1 [0,0,0,1,1,0|2,0,0]=4 18328 B11R2.385 c1cc(cs1)NCC2CC2 d7c1c68c88a0ed9a5acdbe63c10b8479 [0,0,0,1,1,0|2,0,0]=4 18329 B11R2.385 c1cc(cs1)OCC2CC2 a9ccddcf261684bf493f528bf2bde3c0 [0,0,0,1,1,0|2,0,0]=4 18330 B11R2.385 c1cc(n[nH]1)NCC2CC2 481876c06478acccb5e8f047997cadb2 [0,0,0,1,1,0|2,0,0]=4 18331 B11R2.385 c1cc(no1)CNC2CC2 81fc59589b4b1762e5c66cd06eac1dfe [0,0,0,1,1,0|2,0,0]=4 18332 B11R2.385 c1cc(no1)COC2CC2 f509f72911a75184161960d9fc988d33 [0,0,0,1,1,0|2,0,0]=4 18333 B11R2.385 c1cc(no1)NCC2CC2 a28a70437e17863a546a1b98e3b51118 [0,0,0,1,1,0|2,0,0]=4 18334 B11R2.385 c1cc(ns1)COC2CC2 f9b9434b62b4cf8f9ba8bea9fa378b70 [0,0,0,1,1,0|2,0,0]=4 18335 B11R2.385 c1cnn(c1)COC2CC2 5d2880be8993abfcdf4249f0c39f7f5e [0,0,0,1,1,0|2,0,0]=4 18336 B11R2.385 c1cnn(c1)OCC2CC2 7ec879fffc373e9ab50f282e028b0715 [0,0,0,1,1,0|2,0,0]=4 18337 B11R2.385 c1coc(c1)CNC2CC2 a935d11545af700e1f9217e8d211e17d [0,0,0,1,1,0|2,0,0]=4 18338 B11R2.385 c1coc(c1)COC2CC2 03ead378b7018e25b154b738e6adcece [0,0,0,1,1,0|2,0,0]=4 18339 B11R2.385 c1coc(c1)OCC2CC2 47a1be8c37388d024c5b454a8878d544 [0,0,0,1,1,0|2,0,0]=4 18340 B11R2.385 c1coc(n1)CNC2CC2 c5e996094d16df79fcb435eebd38fa1d [0,0,0,1,1,0|2,0,0]=4 18341 B11R2.385 c1coc(n1)COC2CC2 1e557a89a97a47604715be08f048b659 [0,0,0,1,1,0|2,0,0]=4 18342 B11R2.385 c1coc(n1)NCC2CC2 797054f02a1060750213df59834a8720 [0,0,0,1,1,0|2,0,0]=4 18343 B11R2.385 c1csc(c1)CNC2CC2 a3b8685df1d05086920b83e0e1a30168 [0,0,0,1,1,0|2,0,0]=4 18344 B11R2.385 c1csc(c1)COC2CC2 9c47682f7822b9ce46ff4579e17f72af [0,0,0,1,1,0|2,0,0]=4 18345 B11R2.385 c1csc(c1)NCC2CC2 325c825ea7aa3019b849fb2de969b493 [0,0,0,1,1,0|2,0,0]=4 18346 B11R2.385 c1csc(c1)OCC2CC2 48cbf3e23a9745a4d434fee8d20b2061 [0,0,0,1,1,0|2,0,0]=4 18347 B11R2.385 c1csc(n1)CNC2CC2 b8d89713dcd481b9e6be0b5843ef246c [0,0,0,1,1,0|2,0,0]=4 18348 B11R2.385 c1csc(n1)COC2CC2 2d90457352a9185202007aa9b1918864 [0,0,0,1,1,0|2,0,0]=4 18349 B11R2.385 c1csc(n1)NCC2CC2 7b428f84f7e75ab9f36332cbee562ef0 [0,0,0,1,1,0|2,0,0]=4 18350 B11R2.385 c1csc(n1)OCC2CC2 e9a76bf76c95ff84df42200db11c859a [0,0,0,1,1,0|2,0,0]=4 18351 B11R2.385 c1nc(c[nH]1)OCC2CC2 f157aa2e68cba022092c604a0148faa8 [0,0,0,1,1,0|2,0,0]=4 18352 B11R2.385 c1nc(co1)CNC2CC2 e24de11945d488c7ffe7bd6335d9f365 [0,0,0,1,1,0|2,0,0]=4 18353 B11R2.385 c1nc(co1)COC2CC2 845a5f80595260c3addae202c350dc40 [0,0,0,1,1,0|2,0,0]=4 18354 B11R2.385 c1nc(co1)NCC2CC2 116f3bfe7b4a62b9763f03f0ed9633ac [0,0,0,1,1,0|2,0,0]=4 18355 B11R2.385 c1nc(cs1)CNC2CC2 4474308bf3b8e3f23a17c5754d0d4709 [0,0,0,1,1,0|2,0,0]=4 18356 B11R2.385 c1nc(cs1)COC2CC2 6b1683fd5cfde331231fb6063efd0b58 [0,0,0,1,1,0|2,0,0]=4 18357 B11R2.385 c1nc(cs1)NCC2CC2 6425da82f9e6b0a63a6ef80cfda155db [0,0,0,1,1,0|2,0,0]=4 18358 B13R2.42 CCN1CC1c2ccc(cc2)Cl ec70e786c5cacc20d6c2a69040215b56 [0,1,0,1,0,0|2,0,0]=4 18359 B13R2.525 CC1CC1Nc2ccc(cc2)S 7a17d2e48c75aeb35f0bf11ac5361263 [0,1,0,1,0,0|2,0,0]=4 18360 B13R2.525 CC1CC1Nc2ncc(cn2)F b767875cb233abf3c56c25f243c55636 [0,1,0,1,0,0|2,0,0]=4 18361 B13R2.527 Brc1ccc(cc1)CNC2CC2 41c4b0b01161d68c1334b58a2d976561 [0,1,0,1,0,0|2,0,0]=4 18362 B13R2.527 Brc1ccc(cc1)COC2CC2 bcd0d069642f486929d29a3e28cfa0fc [0,1,0,1,0,0|2,0,0]=4 18363 B13R2.527 Brc1ccc(cc1)NCC2CC2 ad0bccdbaa4e5d4292fe77f0286a543b [0,1,0,1,0,0|2,0,0]=4 18364 B13R2.527 Brc1ccc(cc1)OCC2CC2 6e719e49b908d2dc7cf719b5244380e1 [0,1,0,1,0,0|2,0,0]=4 18365 B13R2.527 Brc1ccc(nc1)CNC2CC2 44cbae54a8c2549ede3351346308f17d [0,1,0,1,0,0|1,0,0]=3 18366 B13R2.527 Brc1ccc(nc1)COC2CC2 e5b5bcc3c4e403ce7f85851169d7776f [0,1,0,1,0,0|1,0,0]=3 18367 B13R2.527 Brc1ccc(nc1)NCC2CC2 927d12e8e77206575bb5664dc0e52ee5 [0,1,0,1,0,0|1,0,0]=3 18368 B13R2.527 Brc1ccc(nn1)NCC2CC2 0d7864436ed5ef86d62776898471fd73 [0,1,0,1,0,0|2,0,0]=4 18369 B13R2.527 Brc1ccc(nn1)OCC2CC2 8bb1be6e07635c6ecaf5cb0235301f43 [0,1,0,1,0,0|2,0,0]=4 18370 B13R2.527 Brc1cnc(cn1)CNC2CC2 0e475116e510bc111eb9a4c50568efd3 [0,1,0,1,0,0|2,0,0]=4 18371 B13R2.527 Brc1cnc(cn1)COC2CC2 077ddc44e93dbff677ded736182fb9d1 [0,1,0,1,0,0|2,0,0]=4 18372 B13R2.527 Brc1cnc(cn1)NCC2CC2 ac29504c6af8ee43ae82f297ed869f0d [0,1,0,1,0,0|2,0,0]=4 18373 B13R2.527 Brc1cnc(cn1)OCC2CC2 914df1ee9ffc96b01514b0c330790b5e [0,1,0,1,0,0|2,0,0]=4 18374 B13R2.527 Brc1cnc(nc1)CNC2CC2 882164a86b50575871e5c72e5a28e39d [0,1,0,1,0,0|2,0,0]=4 18375 B13R2.527 Brc1cnc(nc1)COC2CC2 a4067478c6ec6b19ccb752d7abd5c4aa [0,1,0,1,0,0|2,0,0]=4 18376 B13R2.527 Brc1cnc(nc1)NCC2CC2 513a24b679fa3fb81725b6087c948435 [0,1,0,1,0,0|2,0,0]=4 18377 B13R2.527 Brc1cnc(nc1)OCC2CC2 5f113e9626f9a469948eacc3ef230e64 [0,1,0,1,0,0|2,0,0]=4 18378 B13R2.527 Cc1ccc(cc1)CNC2CC2 66120eae50d73955bf64f3bb33a8ed69 [0,1,0,1,0,0|2,0,0]=4 18379 B13R2.527 Cc1ccc(cc1)COC2CC2 49e013e5a795c838f2a7826c7f08320c [0,1,0,1,0,0|2,0,0]=4 18380 B13R2.527 Cc1ccc(cc1)NCC2CC2 a53b11f6229398b5b0a90791beb8706a [0,1,0,1,0,0|2,0,0]=4 18381 B13R2.527 Cc1ccc(cc1)OCC2CC2 3e7a8fbbc538f764b970cd591115d543 [0,1,0,1,0,0|2,0,0]=4 18382 B13R2.527 Cc1ccc(nc1)CNC2CC2 68c13e9d33e1d7508735a0042a9bce85 [0,1,0,1,0,0|1,0,0]=3 18383 B13R2.527 Cc1ccc(nc1)COC2CC2 03d061a096f2d554f1865eeef827b5b1 [0,1,0,1,0,0|1,0,0]=3 18384 B13R2.527 Cc1ccc(nc1)NCC2CC2 5d9baae4ad8e1930f508b63099f8b2f1 [0,1,0,1,0,0|1,0,0]=3 18385 B13R2.527 Cc1ccc(nc1)OCC2CC2 d99df17dee87fb20298a3a81f236afcf [0,1,0,1,0,0|1,0,0]=3 18386 B13R2.527 Cc1ccc(nn1)COC2CC2 90ff0aa976a658b1b729e6552f7e7977 [0,1,0,1,0,0|2,0,0]=4 18387 B13R2.527 Cc1ccc(nn1)NCC2CC2 5085dc19970b531ac6a9e90704dd23b5 [0,1,0,1,0,0|2,0,0]=4 18388 B13R2.527 Cc1ccc(nn1)OCC2CC2 804eeb191e45b3da38c020536d5bdb67 [0,1,0,1,0,0|2,0,0]=4 18389 B13R2.527 Cc1cnc(cn1)COC2CC2 c159c515c51edff41f08004911515c4f [0,1,0,1,0,0|2,0,0]=4 18390 B13R2.527 Cc1cnc(cn1)NCC2CC2 6ed53c79da7018c82a4b16cbc0ab5d1e [0,1,0,1,0,0|2,0,0]=4 18391 B13R2.527 Cc1cnc(cn1)OCC2CC2 f9e72a216f23185d8979e55a807425d5 [0,1,0,1,0,0|2,0,0]=4 18392 B13R2.527 Cc1cnc(nc1)CNC2CC2 f7b69f4b796d50c995d4a83102581cea [0,1,0,1,0,0|2,0,0]=4 18393 B13R2.527 Cc1cnc(nc1)COC2CC2 369501016eb5e803e449dce8fd80fe94 [0,1,0,1,0,0|2,0,0]=4 18394 B13R2.527 Cc1cnc(nc1)NCC2CC2 92cbdb6a35f449ce15466c873ad04034 [0,1,0,1,0,0|2,0,0]=4 18395 B13R2.527 Clc1ccc(cc1)CNC2CC2 4fc554a6d78ba9864c5780202e54b259 [0,1,0,1,0,0|2,0,0]=4 18396 B13R2.527 Clc1ccc(cc1)COC2CC2 d543aed2c6905a4e1b5339c24b2b2eb3 [0,1,0,1,0,0|2,0,0]=4 18397 B13R2.527 Clc1ccc(cc1)NCC2CC2 ee064e6e5fabdfb0a8255b3d510423b7 [0,1,0,1,0,0|2,0,0]=4 18398 B13R2.527 Clc1ccc(cc1)OCC2CC2 17128611dc1b472161596e3de19fdbd9 [0,1,0,1,0,0|2,0,0]=4 18399 B13R2.527 Clc1ccc(nc1)CNC2CC2 87aac2225f262c775204088c1b8d019f [0,1,0,1,0,0|1,0,0]=3 18400 B13R2.527 Clc1ccc(nc1)COC2CC2 192add77b9d37836f588eb7d27ada807 [0,1,0,1,0,0|1,0,0]=3 18401 B13R2.527 Clc1ccc(nc1)NCC2CC2 712ac05568261503ead102948332fee5 [0,1,0,1,0,0|1,0,0]=3 18402 B13R2.527 Clc1ccc(nc1)OCC2CC2 22133e61ff2e1c6dd7fb045752052d30 [0,1,0,1,0,0|1,0,0]=3 18403 B13R2.527 Clc1ccc(nn1)CNC2CC2 453639c6027bdf90ff25512052c1ab5d [0,1,0,1,0,0|2,0,0]=4 18404 B13R2.527 Clc1ccc(nn1)COC2CC2 8c2272523f1fd01408d622568e2ee655 [0,1,0,1,0,0|2,0,0]=4 18405 B13R2.527 Clc1ccc(nn1)NCC2CC2 0751d7ecc48bcf2ba1c9b25e5b2a206c [0,1,0,1,0,0|2,0,0]=4 18406 B13R2.527 Clc1ccc(nn1)OCC2CC2 ccf15d607de14017e5070250f7af19ad [0,1,0,1,0,0|2,0,0]=4 18407 B13R2.527 Clc1cnc(cn1)COC2CC2 280c973bbd7a2f316f5187b436c30627 [0,1,0,1,0,0|2,0,0]=4 18408 B13R2.527 Clc1cnc(cn1)NCC2CC2 cc829eef4384f7b47e8f2a91b74df843 [0,1,0,1,0,0|2,0,0]=4 18409 B13R2.527 Clc1cnc(cn1)OCC2CC2 6266444e657ce051157f51ac175df0bb [0,1,0,1,0,0|2,0,0]=4 18410 B13R2.527 Clc1cnc(nc1)CNC2CC2 55eb859e3fbef249f0995c0adcb9c809 [0,1,0,1,0,0|2,0,0]=4 18411 B13R2.527 Clc1cnc(nc1)COC2CC2 44b0a3b89312dc7c82d20d5974165c57 [0,1,0,1,0,0|2,0,0]=4 18412 B13R2.527 Clc1cnc(nc1)NCC2CC2 3f65c5d61a678d4a50917c44fdcb54fd [0,1,0,1,0,0|2,0,0]=4 18413 B13R2.527 Fc1ccc(cc1)CNC2CC2 985dd799068b4a28b47b55cadb428a4c [0,1,0,1,0,0|2,0,0]=4 18414 B13R2.527 Fc1ccc(cc1)COC2CC2 dba40af6c6adc40a4937a7d7c55cb005 [0,1,0,1,0,0|2,0,0]=4 18415 B13R2.527 Fc1ccc(cc1)NCC2CC2 8681421e9fa2dfbc10740362a91ed7fa [0,1,0,1,0,0|2,0,0]=4 18416 B13R2.527 Fc1ccc(cc1)OCC2CC2 0cd850290317c97b5e28446d1c42a4df [0,1,0,1,0,0|2,0,0]=4 18417 B13R2.527 Fc1ccc(nc1)CNC2CC2 244ea73c787b08867a72f80354131d8e [0,1,0,1,0,0|1,0,0]=3 18418 B13R2.527 Fc1ccc(nc1)COC2CC2 d251964698c5cc6c9b07bb856229fc3b [0,1,0,1,0,0|1,0,0]=3 18419 B13R2.527 Fc1ccc(nc1)NCC2CC2 cb557a3684f03716bb79b5639b81ad5f [0,1,0,1,0,0|1,0,0]=3 18420 B13R2.527 Fc1ccc(nn1)NCC2CC2 69e70dca36d41efb988799d37c71515a [0,1,0,1,0,0|2,0,0]=4 18421 B13R2.527 Fc1cnc(nc1)CNC2CC2 898fdb09e7bf86b3f2d0fe3f0d9ea69a [0,1,0,1,0,0|2,0,0]=4 18422 B13R2.527 Fc1cnc(nc1)COC2CC2 08242dc9a8fc13c209577aa829b108a0 [0,1,0,1,0,0|2,0,0]=4 18423 B13R2.527 Fc1cnc(nc1)NCC2CC2 3968134e6f999b1f2ff7a1d8a226b35e [0,1,0,1,0,0|2,0,0]=4 18424 B13R2.527 Fc1cnc(nc1)OCC2CC2 3ae43c058be8e8f6cbdbe5900581edc5 [0,1,0,1,0,0|2,0,0]=4 18425 B13R2.527 Ic1ccc(cc1)CNC2CC2 8ccd5c570d4ed2e616f8ec7203fec7d6 [0,1,0,1,0,0|2,0,0]=4 18426 B13R2.527 Ic1ccc(cc1)COC2CC2 7a6a5768c6d5f296bdf6c0b697767875 [0,1,0,1,0,0|2,0,0]=4 18427 B13R2.527 Ic1ccc(cc1)NCC2CC2 847648e051631cc3ee49012164105d5b [0,1,0,1,0,0|2,0,0]=4 18428 B13R2.527 Ic1ccc(cc1)OCC2CC2 006b0a8e1c973c215927d707e9af25f6 [0,1,0,1,0,0|2,0,0]=4 18429 B13R2.527 Ic1ccc(nc1)COC2CC2 592f0a45e0cc681f987f8e8966aed50a [0,1,0,1,0,0|1,0,0]=3 18430 B13R2.527 Ic1ccc(nc1)NCC2CC2 00613bbca8c0705825e02c86d54f3515 [0,1,0,1,0,0|1,0,0]=3 18431 B13R2.527 Ic1ccc(nc1)OCC2CC2 ad05df145c96e8323be922218328bae3 [0,1,0,1,0,0|1,0,0]=3 18432 B13R2.527 Ic1ccc(nn1)NCC2CC2 ad3ed4b77281c2e1c7da34a2aea5a85e [0,1,0,1,0,0|2,0,0]=4 18433 B13R2.527 Ic1cnc(cn1)NCC2CC2 aed1efa42fef829ba0b5655756cd7840 [0,1,0,1,0,0|2,0,0]=4 18434 B13R2.527 Ic1cnc(cn1)OCC2CC2 f5b2becc7f2ab3aaf1e90e806e53a975 [0,1,0,1,0,0|2,0,0]=4 18435 B13R2.527 Ic1cnc(nc1)NCC2CC2 6dc77df9bda80ff61b2b8ceebe265772 [0,1,0,1,0,0|2,0,0]=4 18436 B13R2.527 Ic1cnc(nc1)OCC2CC2 5dffd3919e8000d369d8bddc1d2c0066 [0,1,0,1,0,0|2,0,0]=4 18437 B13R2.527 S=c1cnc(c[nH]1)NCC2CC2 4ba1df55001fb620baeaeb8495bda794 [0,1,0,1,0,0|2,0,0]=4 18438 B13R2.527 Sc1ccc(cc1)COC2CC2 b7d16cd5793e0215c67f5d70989d7cfa [0,1,0,1,0,0|2,0,0]=4 18439 B13R2.527 Sc1ccc(cc1)NCC2CC2 65cc0e59526764f6c196fc2722a3de30 [0,1,0,1,0,0|2,0,0]=4 18440 B13R2.527 Sc1ccc(cc1)OCC2CC2 4eb55565b03303779fb77d63eee1479f [0,1,0,1,0,0|2,0,0]=4 18441 B13R2.1069 Brc1ccc(cc1)CN2CCC2 77057b361e44baa71e8fd843a982ff93 [0,1,0,1,0,0|2,0,0]=4 18442 B13R2.1069 Brc1ccc(nc1)CN2CCC2 7cae3e22a364b4e64e0741728220eaab [0,1,0,1,0,0|1,0,0]=3 18443 B13R2.1069 Brc1cnc(cn1)CN2CCC2 bc03b4c812693915fe78cd9aad5a56b0 [0,1,0,1,0,0|2,0,0]=4 18444 B13R2.1069 Brc1cnc(nc1)CN2CCC2 33b5da3e616c2a4f55a0f8d97d85380b [0,1,0,1,0,0|2,0,0]=4 18445 B13R2.1069 Brc1cnc(nc1)NC2CCC2 d3665caa178b9b07e97c1d1cf8848bb9 [0,1,0,1,0,0|2,0,0]=4 18446 B13R2.1069 Cc1ccc(cc1)CN2CCC2 2a727cfffc5d10d4dc1c9e163b1b781c [0,1,0,1,0,0|2,0,0]=4 18447 B13R2.1069 Cc1ccc(nc1)CN2CCC2 9d230f0978a5b03c6a08099403b99b16 [0,1,0,1,0,0|1,0,0]=3 18448 B13R2.1069 Cc1ccc(nc1)OC2CCC2 53f2eb75249ef5ca88b09d24cd7854dd [0,1,0,1,0,0|1,0,0]=3 18449 B13R2.1069 Cc1ccc(nc1)OC2COC2 809b99b6f4df7caed49e2f4d2222b8ca [0,1,0,1,0,0|2,0,0]=4 18450 B13R2.1069 Cc1cnc(nc1)CN2CCC2 a8c7fb8f20f59e8e20023942c9f81335 [0,1,0,1,0,0|2,0,0]=4 18451 B13R2.1069 Cc1cnc(nc1)NC2CCC2 177435aadceac29d8ee0e5274e50bac4 [0,1,0,1,0,0|2,0,0]=4 18452 B13R2.1069 Clc1ccc(cc1)CN2CCC2 a392bb89a849de677717e5e21fd3fa3f [0,1,0,1,0,0|2,0,0]=4 18453 B13R2.1069 Clc1ccc(nc1)CN2CCC2 536756fc8983e6e1c9b231084bd0c054 [0,1,0,1,0,0|1,0,0]=3 18454 B13R2.1069 Clc1cnc(nc1)CN2CCC2 2c5cc442b8febfd029022189296d5d05 [0,1,0,1,0,0|2,0,0]=4 18455 B13R2.1069 Clc1cnc(nc1)NC2CCC2 50ff85a0d66b0c5ca92a10d9563195b9 [0,1,0,1,0,0|2,0,0]=4 18456 B13R2.1069 Fc1ccc(cc1)CN2CCC2 758dbeef4c80936e1fe090e39a2f4d18 [0,1,0,1,0,0|2,0,0]=4 18457 B13R2.1069 Fc1ccc(nc1)CN2CCC2 3c097aa15b50be40225a878d105e1865 [0,1,0,1,0,0|1,0,0]=3 18458 B13R2.1069 Fc1ccc(nc1)OC2CCC2 3af70d41c818b6412cc4d9868b0f4c59 [0,1,0,1,0,0|1,0,0]=3 18459 B13R2.1069 Fc1ccc(nc1)OC2COC2 05c60166c87deb3b516867c2e4159f0f [0,1,0,1,0,0|2,0,0]=4 18460 B13R2.1069 Fc1cnc(nc1)CN2CCC2 00a265519110c97d98288009302add8a [0,1,0,1,0,0|2,0,0]=4 18461 B13R2.1069 Fc1cnc(nc1)NC2CCC2 a6db5acad2646f1e68dcc89b893a277f [0,1,0,1,0,0|2,0,0]=4 18462 B13R2.1069 Ic1ccc(cc1)CN2CCC2 eb24652093daa6cef967677587bcf08c [0,1,0,1,0,0|2,0,0]=4 18463 B13R2.1069 Ic1ccc(nc1)OC2CCC2 b6734e49b4f68913231fbd8f90ebf8ee [0,1,0,1,0,0|1,0,0]=3 18464 B13R2.1069 Ic1ccc(nc1)OC2COC2 857e86ed1d7c2dbbd6d563523f08a176 [0,1,0,1,0,0|2,0,0]=4 18465 B13R2.1069 Ic1cnc(nc1)NC2CCC2 4b060df23ad8981b9ff9d97173d3f7ff [0,1,0,1,0,0|2,0,0]=4 18466 B13R2.1069 Ic1cnc(nc1)OC2CCC2 dbbcfb755e24952966bcb80d749960f2 [0,1,0,1,0,0|2,0,0]=4 18467 B13R2.1069 Sc1ccc(cc1)NC2CCC2 f800318143e2341fd15c2918c8325e54 [0,1,0,1,0,0|2,0,0]=4 18468 B13R2.2136 CCN1CCc2c1cc(cc2)C 50a4f577e4e330aca265f71bfa324dfa [0,1,0,1,0,0|2,0,0]=4 18469 B13R2.2136 CCN1CCc2c1cc(cc2)Cl 5702904dc701aa2c6d86ecb51c626b80 [0,1,0,1,0,0|2,0,0]=4 18470 B13R2.2136 CCN1CCc2c1cc(cc2)F bc928cc4d736ac135a46386d3c2156f0 [0,1,0,1,0,0|2,0,0]=4 18471 B13R2.2136 CCN1CCc2c1cc(cc2)I 562b9656ecc993465928a46b44836e94 [0,1,0,1,0,0|2,0,0]=4 18472 B13R2.2136 CCN1CCc2c1cc(cn2)Br c3c2d39029a9382a9a952e3197c0460f [0,1,0,1,0,0|1,0,0]=3 18473 B13R2.2136 CCN1CCc2c1cc(cn2)F a2bb69ee74f46bd53f8b8d21b4079b98 [0,1,0,1,0,0|1,0,0]=3 18474 B13R2.2136 FCN1CCc2c1cc(cn2)Br 00533cac2a2a470d3eb634531a369300 [0,1,0,1,0,0|2,0,0]=4 18475 B13R2.2136 FCN1CCc2c1cc(cn2)F 7a094044619001d7ce2314d7f98e231d [0,1,0,1,0,0|2,0,0]=4 18476 B13R2.2136 OCN1CCc2c1cc(cn2)Br 45b616e63f383d3582d7a4a01379a76f [0,1,0,1,0,0|2,0,0]=4 18477 B13R2.2136 OCN1CCc2c1cc(cn2)F ab8c1040cc8923b379f6927384194946 [0,1,0,1,0,0|2,0,0]=4 18478 B13R2.4529 CCNC1Cc2c1cc(cc2)Br ceb51f080d6731bc45130c17c127e213 [0,1,0,1,0,0|2,0,0]=4 18479 B13R2.4529 CCO[C@@H]1Cc2c1cc(cc2)Br 267f7e6acfe43841923f221c29614a35 [0,1,0,1,0,0|2,0,0]=4 18480 B13R2.1 C#CCN1CCc2c1cccn2 d3cb51cb5cce10233825871f656d307f [0,1,0,1,0,0|0,0,2]=4 18481 B13R2.1 C=CCN1CCc2c1cccn2 ab4dd48f8b03bd190fda2e73575619e0 [0,1,0,1,0,0|0,0,2]=4 18482 B13R2.1 CCCN1CCc2c1cccc2 cf445eb4d83e99a5cc4d8344bb63d31d [0,1,0,1,0,0|1,0,0]=3 18483 B13R2.1 CCCN1CCc2c1cccn2 1db857eceba67d82bc1cf19a8f34bf48 [0,1,0,1,0,0|0,0,0]=2 18484 B13R2.1 CCCN1CCc2c1ccnc2 a1349eebc7c7ae3a17ca77d7c864da73 [0,1,0,1,0,0|2,0,0]=4 18485 B13R2.1 CCCN1CCc2c1cncc2 be028bcb74b11841fae8db5081146cd3 [0,1,0,1,0,0|2,0,0]=4 18486 B13R2.1 CCCN1CCc2c1nccc2 10767a9047d37830e846b7ba1b507cb7 [0,1,0,1,0,0|2,0,0]=4 18487 B13R2.1 CCCN1CCc2c1nccn2 cbbfb9c78851d336bf3dc3ff863681aa [0,1,0,1,0,0|1,0,0]=3 18488 B13R2.1 CCNC1CCc2c1cccc2 a2f9a7034c524e36dce9da570b8eed38 [0,1,0,1,0,0|1,0,0]=3 18489 B13R2.1 CCNC1CCc2c1cccn2 b3b2e90c68f62fb1ac1e2f62a18647d5 [0,1,0,1,0,0|0,0,0]=2 18490 B13R2.1 CCNC1CCc2c1ccnc2 d425317aec119b5a294b6e42c0aa1567 [0,1,0,1,0,0|2,0,0]=4 18491 B13R2.1 CCNC1CCc2c1nccc2 2d5979d9df982eff9cb602abe8f6fdd4 [0,1,0,1,0,0|2,0,0]=4 18492 B13R2.1 CCNC1COc2c1cccc2 f09dd926899cd5fdddcf32a73bc153be [0,1,0,1,0,0|2,0,0]=4 18493 B13R2.1 CCNC1COc2c1cccn2 5f79db25effbb04df968bf0898ffe111 [0,1,0,1,0,0|1,0,0]=3 18494 B13R2.1 CCN[C@@H]1CCc2c1cccc2 5aed7c7d3dcee97baa206f32f1362e41 [0,1,0,1,0,0|1,0,0]=3 18495 B13R2.1 CCN[C@@H]1CCc2c1cccn2 dfbe01a2bcf28fefda2d3faef7d66293 [0,1,0,1,0,0|0,0,0]=2 18496 B13R2.1 CCN[C@@H]1COc2c1cccc2 360fa0fee3c00ffba95607b5b05700a3 [0,1,0,1,0,0|2,0,0]=4 18497 B13R2.1 CCN[C@H]1CCc2c1cccc2 f19fd7a3a0767a9c0a83a9bd087dc982 [0,1,0,1,0,0|1,0,0]=3 18498 B13R2.1 CCN[C@H]1CCc2c1cccn2 377b65ef739f583520e4d6dcfffb9079 [0,1,0,1,0,0|0,0,0]=2 18499 B13R2.1 CCN[C@H]1COc2c1cccc2 8698f654a274ceb316d7b191697a8e68 [0,1,0,1,0,0|2,0,0]=4 18500 B13R2.1 CCOC1CCc2c1cccc2 0a564ddb836ef50c1bf85fb2687fd49d [0,1,0,1,0,0|1,0,0]=3 18501 B13R2.1 CCOC1CCc2c1cccn2 c6c0f5cd67dfc92d9347f34d8def883b [0,1,0,1,0,0|0,0,0]=2 18502 B13R2.1 CCOC1CCc2c1ccnc2 441ac8e26c735e6d9097823a2774ca38 [0,1,0,1,0,0|2,0,0]=4 18503 B13R2.1 CCOC1CCc2c1nccc2 46712bc3b3957fef0d0bc81ccd2508cf [0,1,0,1,0,0|2,0,0]=4 18504 B13R2.1 CCOC1COc2c1cccc2 169b2661bfe6b350410e42b6f532c79d [0,1,0,1,0,0|2,0,0]=4 18505 B13R2.1 CCOC1COc2c1cccn2 7db7034ef22074140fa8502d3ed3aba8 [0,1,0,1,0,0|1,0,0]=3 18506 B13R2.1 CCO[C@@H]1CCc2c1cccc2 d45cdcdf972d77a1482368de502027ba [0,1,0,1,0,0|1,0,0]=3 18507 B13R2.1 CCO[C@@H]1CCc2c1cccn2 739a4562b2841b730dd2ec77ecb5597d [0,1,0,1,0,0|0,0,0]=2 18508 B13R2.1 CCO[C@@H]1CCc2c1nccc2 d9478c8d6e3fa6b9f56b689a5a2f4ea9 [0,1,0,1,0,0|2,0,0]=4 18509 B13R2.1 CCO[C@H]1CCc2c1cccc2 9fc25a59177ef73a2d9f07d6b3cf667c [0,1,0,1,0,0|1,0,0]=3 18510 B13R2.1 CCO[C@H]1CCc2c1cccn2 7a0c9d9931ea97de8e992f51b791ed97 [0,1,0,1,0,0|0,0,0]=2 18511 B13R2.1 CCO[C@H]1CCc2c1nccc2 49fc56ef3be913f89d886a0adc99dfba [0,1,0,1,0,0|2,0,0]=4 18512 B13R2.1 COCN1CCc2c1cccc2 c60b77eab970945e626beeeffa2e13c9 [0,1,0,1,0,0|2,0,0]=4 18513 B13R2.1 COCN1CCc2c1cccn2 4f5fd1b6836b12cfdbda021487c79c4f [0,1,0,1,0,0|1,0,0]=3 18514 B13R2.1 COCN1CCc2c1nccn2 c50ad1e855d62508624ac5fa41189a7e [0,1,0,1,0,0|2,0,0]=4 18515 B13R2.1 CSCN1CCc2c1cccc2 e5c2414ae459cdefc256f59299ad2cb8 [0,1,0,1,0,0|2,0,0]=4 18516 B13R2.1 CSCN1CCc2c1cccn2 ea64c59aa01f298f36e82d2f788dd00e [0,1,0,1,0,0|1,0,0]=3 18517 B13R2.1 CSCN1CCc2c1nccn2 323c142ca8bd22de6b5bdb576ef306b0 [0,1,0,1,0,0|2,0,0]=4 18518 B13R2.1 FCCN1CCc2c1cccn2 47f3a55426a81e65f70a939a3eb2cd35 [0,1,0,1,0,0|1,0,0]=3 18519 B13R2.1 FCCN1CCc2c1nccn2 91ed380a0e62265fc556a735a3587358 [0,1,0,1,0,0|2,0,0]=4 18520 B13R2.1 FCNC1CCc2c1cccc2 103eb8093388b5304c3d889b2159e580 [0,1,0,1,0,0|2,0,0]=4 18521 B13R2.1 FCNC1CCc2c1cccn2 65500a1e299aeba7d35987dab434c71c [0,1,0,1,0,0|1,0,0]=3 18522 B13R2.1 FCNC1COc2c1cccn2 18df408466a3318a00a1a01445f83ef9 [0,1,0,1,0,0|2,0,0]=4 18523 B13R2.1 FCN[C@@H]1CCc2c1cccc2 80f4a364666628aaed4078d05ba64d81 [0,1,0,1,0,0|2,0,0]=4 18524 B13R2.1 FCN[C@@H]1CCc2c1cccn2 fd2bf79e1015495a188ecc4cbb93174f [0,1,0,1,0,0|1,0,0]=3 18525 B13R2.1 FCN[C@H]1CCc2c1cccc2 e2bc57269246b588ccdae838b66bcdab [0,1,0,1,0,0|2,0,0]=4 18526 B13R2.1 FCN[C@H]1CCc2c1cccn2 885e10c327e51bb62f2c05713f94a754 [0,1,0,1,0,0|1,0,0]=3 18527 B13R2.1 FCOC1CCc2c1cccc2 220ffcfcb17950e6863e8cf7c77f0e80 [0,1,0,1,0,0|2,0,0]=4 18528 B13R2.1 FCOC1CCc2c1cccn2 8d2431df3fa165c464921c4c9b505418 [0,1,0,1,0,0|1,0,0]=3 18529 B13R2.1 FCOC1COc2c1cccn2 c146a4e48e7b634585ae33dc8c475431 [0,1,0,1,0,0|2,0,0]=4 18530 B13R2.1 FCO[C@@H]1CCc2c1cccc2 b81c2aa02363e23e2aa7fd5b72680552 [0,1,0,1,0,0|2,0,0]=4 18531 B13R2.1 FCO[C@@H]1CCc2c1cccn2 2eb2a346635122374af5fba1b76db14e [0,1,0,1,0,0|1,0,0]=3 18532 B13R2.1 FCO[C@H]1CCc2c1cccc2 f0246c395c555c6bc0fc361803df6be2 [0,1,0,1,0,0|2,0,0]=4 18533 B13R2.1 FCO[C@H]1CCc2c1cccn2 88dd3fc1edc745f1a691f7f8debd8268 [0,1,0,1,0,0|1,0,0]=3 18534 B13R2.1 N#CCN1CCc2c1cccn2 3da14a8ed670e76c42f1f59dcf7c26ce [0,1,0,1,0,0|1,0,1]=4 18535 B13R2.1 O=CCN1CCc2c1cccn2 89990832e33d93cf74817c449dd4c659 [0,1,0,1,0,0|1,0,1]=4 18536 B13R2.1 O=CNC1CCc2c1cccn2 ddfb6bd05eb47a61156db8243f90f75b [0,1,0,1,0,0|1,0,1]=4 18537 B13R2.1 O=CN[C@@H]1CCc2c1cccn2 7762682a2e9133aa38422f608642f459 [0,1,0,1,0,0|1,0,1]=4 18538 B13R2.1 O=CN[C@H]1CCc2c1cccn2 edd5838a867407c5fd356ce800d508c4 [0,1,0,1,0,0|1,0,1]=4 18539 B13R2.1 OCCN1CCc2c1cccc2 2aa0ffab467ac65ab0d48d9939646da6 [0,1,0,1,0,0|2,0,0]=4 18540 B13R2.1 OCCN1CCc2c1cccn2 6571c7532817bb33f872175dc5e9c927 [0,1,0,1,0,0|1,0,0]=3 18541 B13R2.1 OCCN1CCc2c1nccn2 a757e554c173ff5f1ebb52279d2d6207 [0,1,0,1,0,0|2,0,0]=4 18542 B13R2.1 OCNC1CCc2c1cccc2 68947de79947f48a5d80c9a9590ab777 [0,1,0,1,0,0|2,0,0]=4 18543 B13R2.1 OCNC1CCc2c1cccn2 55db694eefad1dbd2ad306b99edfa53c [0,1,0,1,0,0|1,0,0]=3 18544 B13R2.1 OCNC1COc2c1cccn2 be056dec23f5145bed9d6c59832548d4 [0,1,0,1,0,0|2,0,0]=4 18545 B13R2.1 OCN[C@@H]1CCc2c1cccc2 6205c97f0245589d6d4ddfad23eea2a6 [0,1,0,1,0,0|2,0,0]=4 18546 B13R2.1 OCN[C@@H]1CCc2c1cccn2 fb36946e03810824aa4d0aebe93c4067 [0,1,0,1,0,0|1,0,0]=3 18547 B13R2.1 OCN[C@H]1CCc2c1cccc2 8cbbf6faa09157d41905fc38137a0b18 [0,1,0,1,0,0|2,0,0]=4 18548 B13R2.1 OCN[C@H]1CCc2c1cccn2 22cfe29a7001e7e1be286839d5aa87ee [0,1,0,1,0,0|1,0,0]=3 18549 B13R2.1 SCCN1CCc2c1cccc2 8de6dbd631c3dda380a9644b37292c9c [0,1,0,1,0,0|2,0,0]=4 18550 B13R2.1 SCCN1CCc2c1cccn2 6ace48428331d3599904ed10fce0aff4 [0,1,0,1,0,0|1,0,0]=3 18551 B13R2.1 SCCN1CCc2c1nccn2 b53214e4045bbe28b1d7cbb65bf679bc [0,1,0,1,0,0|2,0,0]=4 18552 B13R2.17 CC1CC1NCc2ccccc2 4cfdb83dc2f71acc5d554cb409a717c1 [0,1,0,1,0,0|1,0,0]=3 18553 B13R2.17 CC1CC1NCc2ccccn2 121876e18a2f119328db7859e4087861 [0,1,0,1,0,0|0,0,0]=2 18554 B13R2.17 CC1CC1NCc2cccnc2 0e773e8c8aceca3868b86af9296f500e [0,1,0,1,0,0|2,0,0]=4 18555 B13R2.17 CC1CC1NCc2cccnn2 197daa5c88ac83bad367651f7514c560 [0,1,0,1,0,0|1,0,0]=3 18556 B13R2.17 CC1CC1NCc2ccncn2 43d3ccdd54e85cc90e11967237ef5a7d [0,1,0,1,0,0|1,0,0]=3 18557 B13R2.17 CC1CC1NCc2ncccn2 b42cbdebb21e37abeb7fbe747620834b [0,1,0,1,0,0|1,0,0]=3 18558 B13R2.17 F[C@@H]1C[C@@H]1NCc2ccccc2 9057fb3773bb37e850e9042278f52f9f [0,1,0,1,0,0|2,0,0]=4 18559 B13R2.17 F[C@@H]1C[C@@H]1NCc2ccccn2 2a46537095f0affef1459093ef1ed854 [0,1,0,1,0,0|1,0,0]=3 18560 B13R2.17 F[C@@H]1C[C@@H]1NCc2cccnn2 6deff0e199f69da028d25084b21f6f05 [0,1,0,1,0,0|2,0,0]=4 18561 B13R2.17 F[C@@H]1C[C@@H]1NCc2ccncn2 187c4381c571cd63090807a3d7e75312 [0,1,0,1,0,0|2,0,0]=4 18562 B13R2.17 F[C@@H]1C[C@@H]1NCc2ncccn2 d047376e5918b68e4b9cf4e463937305 [0,1,0,1,0,0|2,0,0]=4 18563 B13R2.17 F[C@@H]1C[C@H]1NCc2ccccc2 a39cd5d5b0b9ea9be80edae1c65369c8 [0,1,0,1,0,0|2,0,0]=4 18564 B13R2.17 F[C@@H]1C[C@H]1NCc2ccccn2 2353d23ac98d9dd2788e0836b34f270e [0,1,0,1,0,0|1,0,0]=3 18565 B13R2.17 F[C@@H]1C[C@H]1NCc2cccnn2 72dd72d5e3457f140cf640f6479b2237 [0,1,0,1,0,0|2,0,0]=4 18566 B13R2.17 F[C@@H]1C[C@H]1NCc2ccncn2 70a14099e48baa696510678aac3070b7 [0,1,0,1,0,0|2,0,0]=4 18567 B13R2.17 F[C@@H]1C[C@H]1NCc2ncccn2 09224c9894396bc1c5440145d38561fa [0,1,0,1,0,0|2,0,0]=4 18568 B13R2.17 F[C@H]1C[C@@H]1NCc2ccccc2 9d64da63517ba661c4fcc8089982ed2a [0,1,0,1,0,0|2,0,0]=4 18569 B13R2.17 F[C@H]1C[C@@H]1NCc2ccccn2 141df897a4117d1653092f78023d1a94 [0,1,0,1,0,0|1,0,0]=3 18570 B13R2.17 F[C@H]1C[C@@H]1NCc2cccnn2 bc5d103af9e72ad126d8c028d65585aa [0,1,0,1,0,0|2,0,0]=4 18571 B13R2.17 F[C@H]1C[C@@H]1NCc2ccncn2 69cd98c0360e5481967bbc6176fe3a7b [0,1,0,1,0,0|2,0,0]=4 18572 B13R2.17 F[C@H]1C[C@@H]1NCc2ncccn2 70bee347ec3646ecf004b0b66a0216f4 [0,1,0,1,0,0|2,0,0]=4 18573 B13R2.25 CCCN1CC1c2ccccc2 e270c901fde378e5c915d14628fd0592 [0,1,0,1,0,0|1,0,0]=3 18574 B13R2.25 CCCN1C[C@@H]1c2ccccc2 9063dd0d8d5190fbb4159a798af783d6 [0,1,0,1,0,0|1,0,0]=3 18575 B13R2.25 CCNC1CC1c2ccccc2 d4c0b06f7450b284b9a7403736176252 [0,1,0,1,0,0|1,0,0]=3 18576 B13R2.25 CCN[C@@H]1C[C@H]1c2ccccc2 e5e150ca9d8c1f3071b75d9a3112d3e7 [0,1,0,1,0,0|1,0,0]=3 18577 B13R2.25 CCN[C@H]1C[C@@H]1c2ccccc2 500dcfaf5beb79adb729e93357fd805b [0,1,0,1,0,0|1,0,0]=3 18578 B13R2.25 CCOC1CC1c2ccccc2 27734cfca7e9b5581e39f47784ac1674 [0,1,0,1,0,0|1,0,0]=3 18579 B13R2.25 CCO[C@@H]1C[C@H]1c2ccccc2 4bfcc480eb954bc51df37bb5978ec5ba [0,1,0,1,0,0|1,0,0]=3 18580 B13R2.25 COCN1CC1c2ccccc2 431f8486aa49cd1c4a953713e2221890 [0,1,0,1,0,0|2,0,0]=4 18581 B13R2.25 COCN1C[C@@H]1c2ccccc2 65cecb59e8ef1a2feba2e96da5e7ec6f [0,1,0,1,0,0|2,0,0]=4 18582 B13R2.25 CSCN1CC1c2ccccc2 b084f1b742cc0850b8c734d871a597d6 [0,1,0,1,0,0|2,0,0]=4 18583 B13R2.25 CSCN1C[C@@H]1c2ccccc2 ccb8bad0149379dcc63e42f28ccb0b75 [0,1,0,1,0,0|2,0,0]=4 18584 B13R2.25 FCCN1CC1c2ccccc2 fe6ff9bcb111b1af199eec00ffb7b4da [0,1,0,1,0,0|2,0,0]=4 18585 B13R2.25 FCCN1C[C@@H]1c2ccccc2 c90ebf3969a871515e3d752c1cc92941 [0,1,0,1,0,0|2,0,0]=4 18586 B13R2.25 FCNC1CC1c2ccccc2 df1f2c956aad9bb6b47647de18089992 [0,1,0,1,0,0|2,0,0]=4 18587 B13R2.25 FCN[C@@H]1C[C@H]1c2ccccc2 7e92f870d48663b5f792a27a6901dbf9 [0,1,0,1,0,0|2,0,0]=4 18588 B13R2.25 FCN[C@H]1C[C@@H]1c2ccccc2 a2b525eac511a8cd931fcbf8cf861f81 [0,1,0,1,0,0|2,0,0]=4 18589 B13R2.25 FCOC1CC1c2ccccc2 df578caa84775d30b7731c342f937f99 [0,1,0,1,0,0|2,0,0]=4 18590 B13R2.25 FCO[C@@H]1C[C@H]1c2ccccc2 70b99da946eb8f14a0e24ecf5c3ed6a4 [0,1,0,1,0,0|2,0,0]=4 18591 B13R2.25 OCCN1CC1c2ccccc2 a2e55cfd2ae2d5c63a1176b9d5b1bba1 [0,1,0,1,0,0|2,0,0]=4 18592 B13R2.25 OCCN1C[C@@H]1c2ccccc2 d0d6379ddd9940df05f315bcccdea522 [0,1,0,1,0,0|2,0,0]=4 18593 B13R2.25 OCNC1CC1c2ccccc2 a178b23b256a874c1d88b7e7e9b5abdd [0,1,0,1,0,0|2,0,0]=4 18594 B13R2.25 OCN[C@@H]1C[C@H]1c2ccccc2 56311dbbc739aab2ee186949a6f03cb1 [0,1,0,1,0,0|2,0,0]=4 18595 B13R2.25 OCN[C@H]1C[C@@H]1c2ccccc2 922d45dbd69ecb4851227d9260c32937 [0,1,0,1,0,0|2,0,0]=4 18596 B13R2.25 SCCN1CC1c2ccccc2 23c13de2a7fb3799c14f3d011346fcb5 [0,1,0,1,0,0|2,0,0]=4 18597 B13R2.25 SCCN1C[C@@H]1c2ccccc2 87c9805fc8a52a1837a6537c1a2d5403 [0,1,0,1,0,0|2,0,0]=4 18598 B13R2.27 CC1OCC1Nc2ccccc2 b128ac395a9059b65dba0d9ea3bb54f0 [0,1,0,1,0,0|2,0,0]=4 18599 B13R2.27 CC1OCC1Nc2ccncn2 a0c61f100bd969c1c5df0d9c20205b8e [0,1,0,1,0,0|2,0,0]=4 18600 B13R2.27 CC1OCC1Nc2cnccn2 00f6e57ad7459585016579d4e63294bb [0,1,0,1,0,0|2,0,0]=4 18601 B13R2.27 C[C@@H]1CC[C@@H]1Nc2ccccc2 684c63eb5cb578cf14151b91d0b0133b [0,1,0,1,0,0|1,0,0]=3 18602 B13R2.27 C[C@@H]1CC[C@@H]1Nc2cccnc2 ccb4b0e94de8006b91916ff36babaf8d [0,1,0,1,0,0|2,0,0]=4 18603 B13R2.27 C[C@@H]1CC[C@H]1Nc2ccccc2 a6e394c4737b64f13f3ac1a417405627 [0,1,0,1,0,0|1,0,0]=3 18604 B13R2.27 C[C@@H]1CC[C@H]1Nc2cccnc2 a7de7e49934474a4772bd165861cb2e5 [0,1,0,1,0,0|2,0,0]=4 18605 B13R2.27 FC1CCC1Nc2ccccc2 8228dbbb5f10c6f0996225edf3d6da10 [0,1,0,1,0,0|2,0,0]=4 18606 B13R2.27 FC1CCC1Nc2ccccn2 0e5b6c237e032befe465b01c8e5ea3af [0,1,0,1,0,0|1,0,0]=3 18607 B13R2.27 FC1CCC1Nc2cccnn2 439464a7dbcdd00af230a851cc1172cf [0,1,0,1,0,0|2,0,0]=4 18608 B13R2.27 FC1CCC1Nc2cnccn2 5bc0ee3bf4e423d1673238673e4c2d97 [0,1,0,1,0,0|2,0,0]=4 18609 B13R2.27 FC1CCC1Nc2ncccn2 1d0c8ec423dd1172a8e40f5034a0b0ba [0,1,0,1,0,0|2,0,0]=4 18610 B13R2.27 O=C1CCC1Nc2ccccn2 f5cba642cc1c3b9b0bec58ea2d847dbc [0,1,0,1,0,0|1,0,1]=4 18611 B13R2.27 O=C1CCC1Oc2ccccn2 cf6350f9315352753cb5980b842efa03 [0,1,0,1,0,0|1,0,1]=4 18612 B13R2.27 OC1CCC1Nc2ccccc2 22ccf36632920e2347d87311840cec60 [0,1,0,1,0,0|2,0,0]=4 18613 B13R2.27 OC1CCC1Nc2ccccn2 275af09b7e9d2edd2d30c2a5b4be22de [0,1,0,1,0,0|1,0,0]=3 18614 B13R2.27 OC1CCC1Nc2cccnn2 3b2b4f1460198ee3c447ee8a00f7d437 [0,1,0,1,0,0|2,0,0]=4 18615 B13R2.27 O[C@@H]1CC[C@@H]1Nc2ccccc2 24c8c18bf092a8f81f52a0ac3b04502e [0,1,0,1,0,0|2,0,0]=4 18616 B13R2.27 O[C@@H]1CC[C@@H]1Nc2ccccn2 b1a3e96f0c60ac131df5aeec9ee3c3aa [0,1,0,1,0,0|1,0,0]=3 18617 B13R2.27 O[C@@H]1CC[C@@H]1Nc2cccnn2 2fc5ce5a6c9ce5d9e76ffde842070f2d [0,1,0,1,0,0|2,0,0]=4 18618 B13R2.27 O[C@@H]1CC[C@H]1Nc2ccccc2 9e1f3d8791b3f567d82f5ab87fc30aa0 [0,1,0,1,0,0|2,0,0]=4 18619 B13R2.27 O[C@@H]1CC[C@H]1Nc2ccccn2 2abc7a25bd7e6c91dcac518aa81b1ba9 [0,1,0,1,0,0|1,0,0]=3 18620 B13R2.27 O[C@@H]1CC[C@H]1Nc2cccnn2 fb16477d7c49bf6dedcd347ea59a61dd [0,1,0,1,0,0|2,0,0]=4 18621 B13R2.27 O[C@H]1CC[C@@H]1Nc2ccccc2 1b260cec7536bcd5d480a3538bb0afac [0,1,0,1,0,0|2,0,0]=4 18622 B13R2.27 O[C@H]1CC[C@@H]1Nc2ccccn2 4385b1b759b0182c0bc107ed52b000e8 [0,1,0,1,0,0|1,0,0]=3 18623 B13R2.27 O[C@H]1CC[C@@H]1Nc2cccnn2 2b98bd5975d0ee701de52713fe5a1046 [0,1,0,1,0,0|2,0,0]=4 18624 B13R2.27 O[C@H]1CC[C@H]1Nc2ccccc2 904496f66b00f360c1e9937cd611b9b4 [0,1,0,1,0,0|2,0,0]=4 18625 B13R2.27 O[C@H]1CC[C@H]1Nc2ccccn2 1104f332f50fb1372fe1337b016863eb [0,1,0,1,0,0|1,0,0]=3 18626 B13R2.27 O[C@H]1CC[C@H]1Nc2cccnn2 20aebbaedb024547a74902cbb677495b [0,1,0,1,0,0|2,0,0]=4 18627 B13R2.50 CCN1C[C@@H]1Cc2ccccc2 72eee314b16c58dc582e3e6a580d139e [0,1,0,1,0,0|1,0,0]=3 18628 B13R2.50 CO[C@H]1C[C@H]1Nc2ccccc2 c907af03b24a61b55e237c5a004024cc [0,1,0,1,0,0|2,0,0]=4 18629 B13R2.50 CO[C@H]1C[C@H]1Nc2cccnn2 db94010d52763bc5b96cf63bce1e90ec [0,1,0,1,0,0|2,0,0]=4 18630 B13R2.50 CO[C@H]1C[C@H]1Nc2ccncn2 7b932367f01e2a5350337483d0a9e8ec [0,1,0,1,0,0|2,0,0]=4 18631 B13R2.50 CO[C@H]1C[C@H]1Nc2cnccn2 23d1a8c38fffcbe31eef84604914eec3 [0,1,0,1,0,0|2,0,0]=4 18632 B13R2.50 FCN1C[C@@H]1Cc2ccccc2 2fe655d2e6a0d0b8abc537a648ad2309 [0,1,0,1,0,0|2,0,0]=4 18633 B13R2.50 O=CC1CC1Nc2ccccn2 68ba8c6f18647ea890d86a06b572790a [0,1,0,1,0,0|1,0,1]=4 18634 B13R2.50 O=CC1CC1Oc2ccccn2 f2670eb94eb746da220e8bd834933275 [0,1,0,1,0,0|1,0,1]=4 18635 B13R2.50 OCN1C[C@@H]1Cc2ccccc2 23c338218cf740a486abdd836934ba8d [0,1,0,1,0,0|2,0,0]=4 18636 B13R2.50 OC[C@@H]1C[C@@H]1Nc2ccccc2 b25fe7a9e0e6df82ab17af5b293ded33 [0,1,0,1,0,0|2,0,0]=4 18637 B13R2.50 OC[C@@H]1C[C@@H]1Nc2ccncn2 636b4386032c8c223fd2a3238a7d3c74 [0,1,0,1,0,0|2,0,0]=4 18638 B13R2.50 OC[C@@H]1C[C@H]1Nc2ccccc2 7ada4cf4faab81f6024b1c8d048f713e [0,1,0,1,0,0|2,0,0]=4 18639 B13R2.50 OC[C@@H]1C[C@H]1Nc2ccncn2 6951b9fdc3110fc015657edb433f3315 [0,1,0,1,0,0|2,0,0]=4 18640 B13R2.50 OC[C@H]1C[C@@H]1Nc2ccccc2 45bcb86784bb39a18fadb0ac9283526b [0,1,0,1,0,0|2,0,0]=4 18641 B13R2.50 OC[C@H]1C[C@@H]1Nc2ccncn2 2814224b3f47d9a052a97b81f940846e [0,1,0,1,0,0|2,0,0]=4 18642 B13R2.56 CCN1CCC1c2ccccc2 fda778d48a622a61b172677bfd132183 [0,1,0,1,0,0|1,0,0]=3 18643 B13R2.56 FCN1CCC1c2ccccc2 4ce5ae5906307e3dc3e6487366f62d5e [0,1,0,1,0,0|2,0,0]=4 18644 B13R2.56 OCN1CCC1c2ccccc2 6b97806116c5cdb4eb5c9b9a91151abc [0,1,0,1,0,0|2,0,0]=4 18645 B13R2.64 C1=CCC(C1)Nc2ccccn2 4452758867f312985cc4d2d92e6ef43e [0,1,0,1,0,0|0,0,2]=4 18646 B13R2.64 C1=CCN(C1)Cc2ccccn2 62676026d04f957279463f78318ce51b [0,1,0,1,0,0|0,0,2]=4 18647 B13R2.64 c1cc(ccn1)NC2CCCC2 e127afdb4056271094f7cec3cef337a8 [0,1,0,1,0,0|2,0,0]=4 18648 B13R2.64 c1cc(ccn1)OC2CCCC2 c75d151b84d7b48029703f2b3b0b573f [0,1,0,1,0,0|2,0,0]=4 18649 B13R2.64 c1cc(ncn1)CN2CCSC2 744cd388de2c2182a418416d17b60df4 [0,1,0,1,0,0|2,0,0]=4 18650 B13R2.64 c1ccc(cc1)CN2CCSC2 301ccb0b50045c485d70ef951a7f1502 [0,1,0,1,0,0|2,0,0]=4 18651 B13R2.64 c1ccc(cc1)NC2CCOC2 f7ae5f3053239854f418381e39186b0d [0,1,0,1,0,0|2,0,0]=4 18652 B13R2.64 c1ccc(cc1)N[C@@H]2CCOC2 4f7d5e72059a8626e62a2d3b8459da4f [0,1,0,1,0,0|2,0,0]=4 18653 B13R2.64 c1ccc(cc1)N[C@H]2CCOC2 b2dfd7167909bd165b528bac596e1e42 [0,1,0,1,0,0|2,0,0]=4 18654 B13R2.64 c1ccc(nc1)CN2CCSC2 c7b49a0bb3987411dad357ec9358b4bd [0,1,0,1,0,0|1,0,0]=3 18655 B13R2.64 c1ccc(nc1)NC2CCCC2 ac28426e13bc16414e4fc9d0b84f5f81 [0,1,0,1,0,0|0,0,0]=2 18656 B13R2.64 c1ccc(nc1)OC2CCCC2 8460fb09b70ce957624b342cd2b053cf [0,1,0,1,0,0|0,0,0]=2 18657 B13R2.64 c1ccc(nc1)OC2CCOC2 d0ce0644a2109f7ba2b19277a35b1524 [0,1,0,1,0,0|1,0,0]=3 18658 B13R2.64 c1ccc(nc1)O[C@@H]2CCOC2 7671e765b0b0c52a22afcd6d2d73a14b [0,1,0,1,0,0|1,0,0]=3 18659 B13R2.64 c1ccc(nc1)O[C@H]2CCOC2 8238821989363e570be32543271122ed [0,1,0,1,0,0|1,0,0]=3 18660 B13R2.64 c1cnc(cn1)NC2CCCC2 48b3b0be159a4a3e447af6c60516763f [0,1,0,1,0,0|1,0,0]=3 18661 B13R2.64 c1cnc(nc1)CN2CCSC2 a2d9e147830fc146ad1fea15e0d8f329 [0,1,0,1,0,0|2,0,0]=4 18662 B13R2.64 c1cnc(nc1)NC2CCCC2 72aad9feb769c8747cd53bad4437bd07 [0,1,0,1,0,0|1,0,0]=3 18663 B13R2.64 c1cnc(nc1)NC2CCOC2 c5acd91d8d89cab0445251757a30a7be [0,1,0,1,0,0|2,0,0]=4 18664 B13R2.64 c1cnc(nc1)NC2CCSC2 3e8a7c454d096b95b19fe99feda86d55 [0,1,0,1,0,0|2,0,0]=4 18665 B13R2.64 c1cnc(nc1)N[C@@H]2CCOC2 2c754ba79ac5a7d8587d6ff29e6ff356 [0,1,0,1,0,0|2,0,0]=4 18666 B13R2.64 c1cnc(nc1)N[C@H]2CCOC2 86a3b5434a785c454c2332b4f9d50784 [0,1,0,1,0,0|2,0,0]=4 18667 B13R2.64 c1cnc(nc1)OC2CCCC2 0abb042c18d8e182d7ed5c86f01827ed [0,1,0,1,0,0|1,0,0]=3 18668 B13R2.64 c1cnc(nn1)NC2CCCC2 61ed415c35b0eb0e8b11fcd579553169 [0,1,0,1,0,0|2,0,0]=4 18669 B13R2.64 c1cncc(c1)NC2CCCC2 14401cd3e9b10c83d999169c4c4a1bb4 [0,1,0,1,0,0|2,0,0]=4 18670 B13R2.64 c1cncc(c1)OC2CCCC2 2b723dd8bbc38304d758079f2a928dde [0,1,0,1,0,0|2,0,0]=4 18671 B13R2.64 c1cnnc(c1)CN2CCSC2 9ebcfd6959091a353a0ed85b4426b742 [0,1,0,1,0,0|2,0,0]=4 18672 B13R2.64 c1cnnc(c1)NC2CCCC2 cee98c5f7015583ae075b515d0eb442a [0,1,0,1,0,0|1,0,0]=3 18673 B13R2.64 c1ncnc(n1)NC2CCCC2 402d758aabb1ba8ba6c39ee4d9158c8d [0,1,0,1,0,0|2,0,0]=4 18674 B13R2.1028 BrCCNC1Cc2c1cccc2 5657e954fe2a8d4d23b455cf3fcf91f4 [0,1,0,1,0,0|2,0,0]=4 18675 B13R2.1028 CCCOC1Cc2c1cccc2 0470c60c37869bb43c73e5e5e5c4bf2d [0,1,0,1,0,0|1,0,0]=3 18676 B13R2.1028 CCNCC1Cc2c1cccc2 76babc557632f9d16913fc3e24225c08 [0,1,0,1,0,0|1,0,0]=3 18677 B13R2.1028 CCOCC1Cc2c1cccc2 d06977d066875ebc338591ba61974947 [0,1,0,1,0,0|1,0,0]=3 18678 B13R2.1028 COCOC1Cc2c1cccc2 927a59388f78a5f962d05f55d496f0c4 [0,1,0,1,0,0|2,0,0]=4 18679 B13R2.1028 CSCOC1Cc2c1cccc2 968223ea9c654e3f76363956026e734a [0,1,0,1,0,0|2,0,0]=4 18680 B13R2.1028 FCCNC1Cc2c1cccc2 6415f3754f438f2aea4a8166f6343e25 [0,1,0,1,0,0|2,0,0]=4 18681 B13R2.1028 FCCOC1Cc2c1cccc2 b3ed370ae3d61281334bfcf677ac7106 [0,1,0,1,0,0|2,0,0]=4 18682 B13R2.1028 FCNCC1Cc2c1cccc2 509cb99f405ba32983186c5ecf998b86 [0,1,0,1,0,0|2,0,0]=4 18683 B13R2.1028 FCOCC1Cc2c1cccc2 0828632ad37be3bc6c529a4f7265de3d [0,1,0,1,0,0|2,0,0]=4 18684 B13R2.1028 OCCNC1Cc2c1cccc2 62c70a3974a24e86a842dcc77db0e536 [0,1,0,1,0,0|2,0,0]=4 18685 B13R2.1028 OCNCC1Cc2c1cccc2 eb0432824b8940fda8cd37a550cc20c3 [0,1,0,1,0,0|2,0,0]=4 18686 B13R2.1028 SCCOC1Cc2c1cccc2 2397833ed9359e3aa79756a8dda1433f [0,1,0,1,0,0|2,0,0]=4 18687 B13R2.1613 CCN1CCCc2c1cccn2 91f020e516095b0875f3f56b601d3d59 [0,1,0,1,0,0|0,0,0]=2 18688 B13R2.1613 CCN1CCCc2c1ccnc2 b53d1e005ae9ff77699b2725ed53e6ff [0,1,0,1,0,0|2,0,0]=4 18689 B13R2.1613 CCN1CCCc2c1cncc2 60680a24696761ef2c6d455d33ed3eaa [0,1,0,1,0,0|2,0,0]=4 18690 B13R2.1613 CCN1CCCc2c1cncn2 4c4f122dc9bbac81e36da5d752aafe7b [0,1,0,1,0,0|1,0,0]=3 18691 B13R2.1613 CCN1CCCc2c1nccc2 515a0cca732104e386c736bc99c21ff5 [0,1,0,1,0,0|2,0,0]=4 18692 B13R2.1613 CCN1CCOc2c1cccn2 a3f3c344bf9d41252eda7f608567705d [0,1,0,1,0,0|1,0,0]=3 18693 B13R2.1613 CCN1CCSc2c1cccc2 50f3fa44e804d2d20bf7cbc69555c3b4 [0,1,0,1,0,0|2,0,0]=4 18694 B13R2.1613 CCN1CCSc2c1cccn2 b82a1195e9fd304fd5340226f679a323 [0,1,0,1,0,0|1,0,0]=3 18695 B13R2.1613 FCN1CCCc2c1cccn2 777776ee94d600732d33433523defa1c [0,1,0,1,0,0|1,0,0]=3 18696 B13R2.1613 FCN1CCCc2c1cncn2 c9eed6abeebf274e0a689fe00a4880ce [0,1,0,1,0,0|2,0,0]=4 18697 B13R2.1613 FCN1CCOc2c1cccn2 b112fd7bc64fb0fca6134d1c0293ee6f [0,1,0,1,0,0|2,0,0]=4 18698 B13R2.1613 FCN1CCSc2c1cccn2 582f07cc4daeb627a8d971d6d7eb6bea [0,1,0,1,0,0|2,0,0]=4 18699 B13R2.1613 O=CN1CCCc2c1cccn2 030cfb291d92dfaec48d7c2a8d3a23d3 [0,1,0,1,0,0|1,0,1]=4 18700 B13R2.1613 OCN1CCCc2c1cccn2 0ae2cd4133a645443e1816bcef44fb80 [0,1,0,1,0,0|1,0,0]=3 18701 B13R2.1613 OCN1CCCc2c1cncn2 9427a3d8ba59b1b29505e5e171481fe1 [0,1,0,1,0,0|2,0,0]=4 18702 B13R2.1613 OCN1CCOc2c1cccn2 a5c75ca0e2350931354849a9b9917444 [0,1,0,1,0,0|2,0,0]=4 18703 B13R2.1613 OCN1CCSc2c1cccn2 e41ca1881149aba96df4f49b8525c70d [0,1,0,1,0,0|2,0,0]=4 18704 B13R2.2382 c1cc(ccn1)CCNC2CC2 37fc3949e4098458a348e17c320ec999 [0,1,0,1,0,0|2,0,0]=4 18705 B13R2.2382 c1cc(ccn1)CCOC2CC2 19d5440455d988fe5c18acd5290656c0 [0,1,0,1,0,0|2,0,0]=4 18706 B13R2.2382 c1cc(ccn1)CNCC2CC2 775d0a45524d5e9ebfe0e25baf33adc4 [0,1,0,1,0,0|2,0,0]=4 18707 B13R2.2382 c1cc(ccn1)COCC2CC2 8e9f342a1f1338ebfe3e0fc85a1adbcc [0,1,0,1,0,0|2,0,0]=4 18708 B13R2.2382 c1cc(ccn1)NCCC2CC2 5523de297fc887d1e48e5ae30e7c2dae [0,1,0,1,0,0|2,0,0]=4 18709 B13R2.2382 c1cc(ccn1)OCCC2CC2 595a41c03f6a700af5ded2a3b44d0072 [0,1,0,1,0,0|2,0,0]=4 18710 B13R2.2382 c1cc(ncn1)CCOC2CC2 9481b6cb3bf4d84ea6e4aa661cc6b2f0 [0,1,0,1,0,0|1,0,0]=3 18711 B13R2.2382 c1cc(ncn1)CNCC2CC2 596f9c948aaf803bc82ce3ceb5eb40e2 [0,1,0,1,0,0|1,0,0]=3 18712 B13R2.2382 c1cc(ncn1)COCC2CC2 a2c11d929bf77f2edb3d275439cd9d9e [0,1,0,1,0,0|1,0,0]=3 18713 B13R2.2382 c1cc(ncn1)NCCC2CC2 31d8d4de31e0c280af1f061efac3a2aa [0,1,0,1,0,0|1,0,0]=3 18714 B13R2.2382 c1cc(ncn1)NCCN2CC2 dd6a7b395a53a3980a8443031d210df3 [0,1,0,1,0,0|2,0,0]=4 18715 B13R2.2382 c1ccc(cc1)CCNC2CC2 c0acc909907416c990faac6461a17e3d [0,1,0,1,0,0|1,0,0]=3 18716 B13R2.2382 c1ccc(cc1)CCOC2CC2 9b4d64189ccdbb3669ef5879f884feb2 [0,1,0,1,0,0|1,0,0]=3 18717 B13R2.2382 c1ccc(cc1)CNCC2CC2 80cb94d2a5ebc9f070dab6079001726b [0,1,0,1,0,0|1,0,0]=3 18718 B13R2.2382 c1ccc(cc1)COCC2CC2 d94b6c445a4cec9ce9fd36dbab98e454 [0,1,0,1,0,0|1,0,0]=3 18719 B13R2.2382 c1ccc(cc1)NCCC2CC2 757c7212fbff1795e50d72252d44f390 [0,1,0,1,0,0|1,0,0]=3 18720 B13R2.2382 c1ccc(cc1)NCCN2CC2 16ddcb828f5878255a3b51a418f374af [0,1,0,1,0,0|2,0,0]=4 18721 B13R2.2382 c1ccc(cc1)SCOC2CC2 c8088614beed42bddddc4bb699109e72 [0,1,0,1,0,0|2,0,0]=4 18722 B13R2.2382 c1ccc(nc1)CCNC2CC2 35a709cccf393853b019f29ebf684a4a [0,1,0,1,0,0|0,0,0]=2 18723 B13R2.2382 c1ccc(nc1)CCOC2CC2 81f197f8b1a75cc83cddcb9f7e0b3370 [0,1,0,1,0,0|0,0,0]=2 18724 B13R2.2382 c1ccc(nc1)CNCC2CC2 3cec5e94e357e7a3297e9daffdff2c8b [0,1,0,1,0,0|0,0,0]=2 18725 B13R2.2382 c1ccc(nc1)COCC2CC2 dcec08f65100a950b995b893d71f3651 [0,1,0,1,0,0|0,0,0]=2 18726 B13R2.2382 c1ccc(nc1)NCCC2CC2 cf5c6d56e49ce97108498eddb38dd3d0 [0,1,0,1,0,0|0,0,0]=2 18727 B13R2.2382 c1ccc(nc1)OCCC2CC2 130d29ab7acdfdb06b924ed3eb497713 [0,1,0,1,0,0|0,0,0]=2 18728 B13R2.2382 c1cnc(cn1)CCOC2CC2 708ab63a24bad00840aead36c999da3a [0,1,0,1,0,0|1,0,0]=3 18729 B13R2.2382 c1cnc(cn1)CNCC2CC2 eb836eb8942c8ba7870d49b2f56233d7 [0,1,0,1,0,0|1,0,0]=3 18730 B13R2.2382 c1cnc(cn1)COCC2CC2 6ad067b0ae2396573ffa28bf88133bb6 [0,1,0,1,0,0|1,0,0]=3 18731 B13R2.2382 c1cnc(cn1)NCCC2CC2 e1bd0acf546d68808857b32f8662d2a8 [0,1,0,1,0,0|1,0,0]=3 18732 B13R2.2382 c1cnc(cn1)NCCN2CC2 a997e3f578c69caafb5b0b9c2791fd30 [0,1,0,1,0,0|2,0,0]=4 18733 B13R2.2382 c1cnc(cn1)OCCC2CC2 20bf1e2e43bd9c409cc4e152bbd19f71 [0,1,0,1,0,0|1,0,0]=3 18734 B13R2.2382 c1cnc(nc1)CCNC2CC2 f8bc9cc9c0b22c5eaa95564499a04fc4 [0,1,0,1,0,0|1,0,0]=3 18735 B13R2.2382 c1cnc(nc1)CCOC2CC2 1a04ff67df43a73e8ebd9416e8391de0 [0,1,0,1,0,0|1,0,0]=3 18736 B13R2.2382 c1cnc(nc1)CNCC2CC2 d7b99143add86956fbdf3bbcac44c52b [0,1,0,1,0,0|1,0,0]=3 18737 B13R2.2382 c1cnc(nc1)COCC2CC2 df30081d4885772ad4285f63fda0fe7e [0,1,0,1,0,0|1,0,0]=3 18738 B13R2.2382 c1cnc(nc1)NCCC2CC2 e4bc5d70eaedac9d1e506faee24d0b8f [0,1,0,1,0,0|1,0,0]=3 18739 B13R2.2382 c1cnc(nc1)NCCN2CC2 ed63e825230982b987a8f3e718d6e6b3 [0,1,0,1,0,0|2,0,0]=4 18740 B13R2.2382 c1cnc(nc1)OCCC2CC2 f0ac8d308af666d8a2a7011b0fbbbd5f [0,1,0,1,0,0|1,0,0]=3 18741 B13R2.2382 c1cnc(nn1)NCCC2CC2 8f28f5bfd6f1663eca7e15f936260fb5 [0,1,0,1,0,0|2,0,0]=4 18742 B13R2.2382 c1cncc(c1)CCNC2CC2 9457e793100f8397b19f06d1daa242e4 [0,1,0,1,0,0|2,0,0]=4 18743 B13R2.2382 c1cncc(c1)CCOC2CC2 34f15578df9dbd2f0c78f1dd6cdc5f46 [0,1,0,1,0,0|2,0,0]=4 18744 B13R2.2382 c1cncc(c1)CNCC2CC2 68b46c24d878721f2c4008748c137fe1 [0,1,0,1,0,0|2,0,0]=4 18745 B13R2.2382 c1cncc(c1)COCC2CC2 0a913cf9f29ab010c40b67f584f65f33 [0,1,0,1,0,0|2,0,0]=4 18746 B13R2.2382 c1cncc(c1)NCCC2CC2 2e760af68eeb387ed645545ea996fb4c [0,1,0,1,0,0|2,0,0]=4 18747 B13R2.2382 c1cncc(c1)OCCC2CC2 7549c0ad14f1b5848b13873b4ca1b73f [0,1,0,1,0,0|2,0,0]=4 18748 B13R2.2382 c1cnnc(c1)CNCC2CC2 63842f4d5ec6bea2e46d63e32f2bb2af [0,1,0,1,0,0|1,0,0]=3 18749 B13R2.2382 c1cnnc(c1)COCC2CC2 400f5948036549d3da4c2665f0d28397 [0,1,0,1,0,0|1,0,0]=3 18750 B13R2.2382 c1cnnc(c1)NCCC2CC2 42af7483a66dee6af1ecdc8c62f700da [0,1,0,1,0,0|1,0,0]=3 18751 B13R2.2382 c1cnnc(c1)NCCN2CC2 fcf38568e26c2c6d03e27dabae57359d [0,1,0,1,0,0|2,0,0]=4 18752 B13R2.2382 c1ncc(nn1)OCCC2CC2 414f910a90fc56973676af01437a871d [0,1,0,1,0,0|2,0,0]=4 18753 B13R2.2382 c1ncnc(n1)NCCC2CC2 8600c18de34f4e899ff37eb997deb564 [0,1,0,1,0,0|2,0,0]=4 18754 B13R2.2382 c1nncc(n1)NCCC2CC2 9a78508a6b867170c046aaed5f1ae780 [0,1,0,1,0,0|2,0,0]=4 18755 B13R2.2383 c1cc(ccn1)CCN2CCC2 3a61bae80ec4a1617d281cf3d5d8ef3b [0,1,0,1,0,0|2,0,0]=4 18756 B13R2.2383 c1cc(ccn1)CNC2CCC2 2ab8ed253508ac5ee4ca11e19b8cbdea [0,1,0,1,0,0|2,0,0]=4 18757 B13R2.2383 c1cc(ccn1)COC2CCC2 414cc323e86c3d6e275657e97583a6e3 [0,1,0,1,0,0|2,0,0]=4 18758 B13R2.2383 c1cc(ccn1)NCC2CCC2 eab8836d32586c8ea8ac921da68a8276 [0,1,0,1,0,0|2,0,0]=4 18759 B13R2.2383 c1cc(ccn1)OCC2CCC2 a2e3085149a808d49b05683e6411c719 [0,1,0,1,0,0|2,0,0]=4 18760 B13R2.2383 c1cc(ncn1)CNC2CCC2 05de843a273fcb1d6ae5cd6e7d0f478b [0,1,0,1,0,0|1,0,0]=3 18761 B13R2.2383 c1cc(ncn1)CNC2COC2 b324b64ffcf1232e15b085718ca3388e [0,1,0,1,0,0|2,0,0]=4 18762 B13R2.2383 c1cc(ncn1)COC2CCC2 291be7c2352460f3220a32d03f7d6fe3 [0,1,0,1,0,0|1,0,0]=3 18763 B13R2.2383 c1cc(ncn1)COC2COC2 5b00118c30f07ca5c9a4787b3dfc594d [0,1,0,1,0,0|2,0,0]=4 18764 B13R2.2383 c1cc(ncn1)COC2CSC2 e7cf59947b3b1551c8ea40edd255ca36 [0,1,0,1,0,0|2,0,0]=4 18765 B13R2.2383 c1cc(ncn1)NCC2CCC2 cf2f414b406837bd2907443fab6c9e5b [0,1,0,1,0,0|1,0,0]=3 18766 B13R2.2383 c1cc(ncn1)NCC2CCO2 0b2a9add1b7bc49b84eb3b023618798c [0,1,0,1,0,0|2,0,0]=4 18767 B13R2.2383 c1cc(ncn1)NCC2COC2 ec33a64af2d1a221a1c5865dd84c77fe [0,1,0,1,0,0|2,0,0]=4 18768 B13R2.2383 c1cc(ncn1)NC[C@@H]2CCO2 3663fe01a646e6207f394d5cd1008b11 [0,1,0,1,0,0|2,0,0]=4 18769 B13R2.2383 c1cc(ncn1)NC[C@H]2CCO2 7db601d041ba02ee88e17c9d85e4f46d [0,1,0,1,0,0|2,0,0]=4 18770 B13R2.2383 c1ccc(cc1)CCN2CCC2 22a53212ff75b5e3f191773b1880daf5 [0,1,0,1,0,0|1,0,0]=3 18771 B13R2.2383 c1ccc(cc1)CNC2CCC2 3a6b392b1d26d51094292814d17ea686 [0,1,0,1,0,0|1,0,0]=3 18772 B13R2.2383 c1ccc(cc1)CNC2COC2 51d5165ff5651c61c73d43baba847d87 [0,1,0,1,0,0|2,0,0]=4 18773 B13R2.2383 c1ccc(cc1)COC2CCC2 f8bbcd5737453dbd625ce5790467cebd [0,1,0,1,0,0|1,0,0]=3 18774 B13R2.2383 c1ccc(cc1)COC2COC2 2c8e62ffef83aa8a09ed28b5aa67341f [0,1,0,1,0,0|2,0,0]=4 18775 B13R2.2383 c1ccc(cc1)COC2CSC2 b5a61bc7e3ee8b14ae3f92aa0cb8d4b8 [0,1,0,1,0,0|2,0,0]=4 18776 B13R2.2383 c1ccc(cc1)NCC2CCC2 fc90e0c4b244b2a8349c32f4ee278f6b [0,1,0,1,0,0|1,0,0]=3 18777 B13R2.2383 c1ccc(cc1)NCC2CCO2 5d818abbab86ded9891dd9b13b40da91 [0,1,0,1,0,0|2,0,0]=4 18778 B13R2.2383 c1ccc(cc1)NCC2COC2 0546e72f0eb7c92451540454a2c852c0 [0,1,0,1,0,0|2,0,0]=4 18779 B13R2.2383 c1ccc(cc1)NC[C@@H]2CCO2 20cdb3b5e9bd81893451addec1bb2ae9 [0,1,0,1,0,0|2,0,0]=4 18780 B13R2.2383 c1ccc(cc1)NC[C@H]2CCO2 fc1288ba6814eb5377d68c20a59f5fff [0,1,0,1,0,0|2,0,0]=4 18781 B13R2.2383 c1ccc(nc1)CCN2CCC2 943475f43f82f44af5e86063b6e7d90d [0,1,0,1,0,0|0,0,0]=2 18782 B13R2.2383 c1ccc(nc1)CNC2CCC2 9a01bfa112eb5bbef6eff882f784c492 [0,1,0,1,0,0|0,0,0]=2 18783 B13R2.2383 c1ccc(nc1)CNC2COC2 0d51ecf839465eff3d20be52611becaa [0,1,0,1,0,0|1,0,0]=3 18784 B13R2.2383 c1ccc(nc1)COC2CCC2 436da9ff77c45696333832c3d856d357 [0,1,0,1,0,0|0,0,0]=2 18785 B13R2.2383 c1ccc(nc1)COC2COC2 5e3815e68710e45d683f4941a6b117fe [0,1,0,1,0,0|1,0,0]=3 18786 B13R2.2383 c1ccc(nc1)COC2CSC2 3e14b2274a2a5e2ba750e80ab34d39e6 [0,1,0,1,0,0|1,0,0]=3 18787 B13R2.2383 c1ccc(nc1)NCC2CCC2 5736993b341bb4b682ec085d23854579 [0,1,0,1,0,0|0,0,0]=2 18788 B13R2.2383 c1ccc(nc1)NCC2CCO2 a02a57a51212b230fc2f8096e11ab8e5 [0,1,0,1,0,0|1,0,0]=3 18789 B13R2.2383 c1ccc(nc1)NCC2COC2 7214761ce84b7f2d2d0b2d637c9b966b [0,1,0,1,0,0|1,0,0]=3 18790 B13R2.2383 c1ccc(nc1)NC[C@@H]2CCO2 4dc0ff35dc0a0af30c73235f8ad7e881 [0,1,0,1,0,0|1,0,0]=3 18791 B13R2.2383 c1ccc(nc1)NC[C@H]2CCO2 6fd6d1b013a23cf98a2a545f547b8bb9 [0,1,0,1,0,0|1,0,0]=3 18792 B13R2.2383 c1ccc(nc1)OCC2CCC2 739031db39145e772b7081953a5155e4 [0,1,0,1,0,0|0,0,0]=2 18793 B13R2.2383 c1ccc(nc1)OCC2CCO2 376b904d3e7a2fe22cf77af61fc98a8e [0,1,0,1,0,0|1,0,0]=3 18794 B13R2.2383 c1ccc(nc1)OCC2COC2 c7c87902c930923140d3595a78fdfad3 [0,1,0,1,0,0|1,0,0]=3 18795 B13R2.2383 c1ccc(nc1)OC[C@@H]2CCO2 eab224f9de923902970d18cf7ce72866 [0,1,0,1,0,0|1,0,0]=3 18796 B13R2.2383 c1ccc(nc1)OC[C@H]2CCO2 c7a2b579440aab14ae69dfa466310b9c [0,1,0,1,0,0|1,0,0]=3 18797 B13R2.2383 c1cnc(cn1)CNC2CCC2 a736dbc007a1da0884e9a10588e6a281 [0,1,0,1,0,0|1,0,0]=3 18798 B13R2.2383 c1cnc(cn1)COC2CCC2 684181267f2d66cf31b2c316bba27473 [0,1,0,1,0,0|1,0,0]=3 18799 B13R2.2383 c1cnc(cn1)NCC2CCC2 106d847aa458379b928a98aa4f1617f1 [0,1,0,1,0,0|1,0,0]=3 18800 B13R2.2383 c1cnc(cn1)NCC2CCO2 1ff00bfd218e065f3ad8ca9bee79d5e2 [0,1,0,1,0,0|2,0,0]=4 18801 B13R2.2383 c1cnc(cn1)NCC2COC2 c01c870791cb3aad4da8e083a3a423ad [0,1,0,1,0,0|2,0,0]=4 18802 B13R2.2383 c1cnc(cn1)NC[C@@H]2CCO2 dec03dcb2fb72ffb9ef6db28baf54d7b [0,1,0,1,0,0|2,0,0]=4 18803 B13R2.2383 c1cnc(cn1)NC[C@H]2CCO2 34872c43190ca18ecfafef62f9b6b099 [0,1,0,1,0,0|2,0,0]=4 18804 B13R2.2383 c1cnc(cn1)OCC2CCC2 aff00abe13a0abde095c9abaa50817df [0,1,0,1,0,0|1,0,0]=3 18805 B13R2.2383 c1cnc(cn1)OCC2CCO2 77e171b17ee59b11e148c41ebea7736a [0,1,0,1,0,0|2,0,0]=4 18806 B13R2.2383 c1cnc(cn1)OCC2COC2 d8cb946ee34160c181ecec11c84f7abc [0,1,0,1,0,0|2,0,0]=4 18807 B13R2.2383 c1cnc(cn1)OC[C@@H]2CCO2 32d1eea8a689dc804195fe73b7382701 [0,1,0,1,0,0|2,0,0]=4 18808 B13R2.2383 c1cnc(cn1)OC[C@H]2CCO2 228d9ca4f40d433866ca7be60f1facb4 [0,1,0,1,0,0|2,0,0]=4 18809 B13R2.2383 c1cnc(nc1)CNC2CCC2 b876f476104cd3977867ca391da221c8 [0,1,0,1,0,0|1,0,0]=3 18810 B13R2.2383 c1cnc(nc1)CNC2COC2 e86b5a488c1902915e70c4cddf68f4fc [0,1,0,1,0,0|2,0,0]=4 18811 B13R2.2383 c1cnc(nc1)COC2CCC2 e782b3e38fd948843740cf2b5269a443 [0,1,0,1,0,0|1,0,0]=3 18812 B13R2.2383 c1cnc(nc1)COC2COC2 80e78ab91446895707b2337406d206c6 [0,1,0,1,0,0|2,0,0]=4 18813 B13R2.2383 c1cnc(nc1)COC2CSC2 6058d4e4f147fcc40feec96c3baa9048 [0,1,0,1,0,0|2,0,0]=4 18814 B13R2.2383 c1cnc(nc1)NCC2CCC2 37ae608a5364bb9e8383028088937d03 [0,1,0,1,0,0|1,0,0]=3 18815 B13R2.2383 c1cnc(nc1)NCC2CCO2 1c140a5154fcebbf402e6b197a4517c8 [0,1,0,1,0,0|2,0,0]=4 18816 B13R2.2383 c1cnc(nc1)NCC2COC2 53862c77774f9ee2778bcdbdb4a0384f [0,1,0,1,0,0|2,0,0]=4 18817 B13R2.2383 c1cnc(nc1)NC[C@@H]2CCO2 5c6bca057429329609e495baa90b562d [0,1,0,1,0,0|2,0,0]=4 18818 B13R2.2383 c1cnc(nc1)NC[C@H]2CCO2 6a953b23c9b64bb8ab861a8aaf674416 [0,1,0,1,0,0|2,0,0]=4 18819 B13R2.2383 c1cnc(nc1)OCC2CCC2 ee9664a176e1aa35811f436ea76c37e4 [0,1,0,1,0,0|1,0,0]=3 18820 B13R2.2383 c1cnc(nc1)OCC2CCO2 fdd400d916f2c00a2c54184065e90da6 [0,1,0,1,0,0|2,0,0]=4 18821 B13R2.2383 c1cnc(nc1)OCC2COC2 19d3bf6f22fa86a06f5a311acf8dce2c [0,1,0,1,0,0|2,0,0]=4 18822 B13R2.2383 c1cnc(nc1)OC[C@@H]2CCO2 5d3328c80d1d93b24a2a07356f0602ed [0,1,0,1,0,0|2,0,0]=4 18823 B13R2.2383 c1cnc(nc1)OC[C@H]2CCO2 17c6c9d243510de9a0d4920592debc0c [0,1,0,1,0,0|2,0,0]=4 18824 B13R2.2383 c1cnc(nn1)NCC2CCC2 ace335c4e478485c0dc646bf4ceaacc1 [0,1,0,1,0,0|2,0,0]=4 18825 B13R2.2383 c1cncc(c1)CCN2CCC2 7bcc9c72fadb000669f36bcd093dab7c [0,1,0,1,0,0|2,0,0]=4 18826 B13R2.2383 c1cncc(c1)CNC2CCC2 a4c6d3cbd29a5a08009b790cec1582f2 [0,1,0,1,0,0|2,0,0]=4 18827 B13R2.2383 c1cncc(c1)COC2CCC2 81f50891d4d2e3c89ea5e8029e71ed4d [0,1,0,1,0,0|2,0,0]=4 18828 B13R2.2383 c1cncc(c1)NCC2CCC2 7f37204b6ae9063c18706c654b23dda5 [0,1,0,1,0,0|2,0,0]=4 18829 B13R2.2383 c1cncc(c1)OCC2CCC2 ad2f00b6fac127a0d4c5ada9c0dfef8b [0,1,0,1,0,0|2,0,0]=4 18830 B13R2.2383 c1cnnc(c1)CNC2CCC2 9bd3ba4517e01be4d492e3dcf14e38fd [0,1,0,1,0,0|1,0,0]=3 18831 B13R2.2383 c1cnnc(c1)CNC2COC2 e7c083ac8f8f2c48a47bf4557ff5845b [0,1,0,1,0,0|2,0,0]=4 18832 B13R2.2383 c1cnnc(c1)COC2CCC2 0833bd66e95688d8ef2351b34b2cc385 [0,1,0,1,0,0|1,0,0]=3 18833 B13R2.2383 c1cnnc(c1)COC2COC2 b6e4c6378a8aa53327f84dcf49a1a2b2 [0,1,0,1,0,0|2,0,0]=4 18834 B13R2.2383 c1cnnc(c1)COC2CSC2 3f9b9912185a1eb0bbb18535c29062f2 [0,1,0,1,0,0|2,0,0]=4 18835 B13R2.2383 c1cnnc(c1)NCC2CCC2 24473516475c4c4faaae78f570979e17 [0,1,0,1,0,0|1,0,0]=3 18836 B13R2.2383 c1cnnc(c1)NCC2CCO2 8f4e5dff22f872db02e8622472c796d0 [0,1,0,1,0,0|2,0,0]=4 18837 B13R2.2383 c1cnnc(c1)NCC2COC2 2dada4f0b93e45f42d46564e1c227962 [0,1,0,1,0,0|2,0,0]=4 18838 B13R2.2383 c1cnnc(c1)NC[C@@H]2CCO2 c4e4d434379cf08da85f58e576f463cf [0,1,0,1,0,0|2,0,0]=4 18839 B13R2.2383 c1cnnc(c1)NC[C@H]2CCO2 60f489ecc8d158704857f9b62448f31f [0,1,0,1,0,0|2,0,0]=4 18840 B13R2.2383 c1ncnc(n1)NCC2CCC2 a435ba3fd7cc508cabbe6866ab4d4d58 [0,1,0,1,0,0|2,0,0]=4 18841 B13R2.2383 c1nncc(n1)NCC2CCC2 69e229570027d32ba7f849ec175cda61 [0,1,0,1,0,0|2,0,0]=4 18842 B13R2.52 CCN1CC(C1)c2ccccc2 69d4cc457ae2e1f78728361f56079908 [0,1,0,1,0,0|2,0,0]=4 18843 B13R2.52 CCN1CC(C1)c2ccccn2 43a937e65e9fdb5d528efa0d0a33e9cf [0,1,0,1,0,0|1,0,0]=3 18844 B13R2.52 CCN1CC(C1)c2cnccn2 0399dcc3bf2042341a678c3db4bee578 [0,1,0,1,0,0|2,0,0]=4 18845 B13R2.52 FCN1CC(C1)c2ccccn2 bc91cbdac7ae37756c3aca24bb0d7bce [0,1,0,1,0,0|2,0,0]=4 18846 B13R2.52 OCN1CC(C1)c2ccccn2 0af605af3b5b3f8e0c9e3aba9a2ec833 [0,1,0,1,0,0|2,0,0]=4 18847 B13R2.57 CCN1CCc2ccccc2C1 0fb8fe72984abaf69967df9e6f6e197f [0,1,0,1,0,0|2,0,0]=4 18848 B13R2.57 CCN1CCc2ncccc2C1 2449173e173d150dc402eb195871d698 [0,1,0,1,0,0|1,0,0]=3 18849 B13R2.57 CCN1CCc2nccnc2C1 09580c921c955e79c21a72d2bdb8edfa [0,1,0,1,0,0|2,0,0]=4 18850 B13R2.57 CCN1CCc2ncncc2C1 5dc6e65321b34b9d0f6a91edec3961e5 [0,1,0,1,0,0|2,0,0]=4 18851 B13R2.57 FCN1CCc2ncccc2C1 c2f3938450f3656d2e9059f57ccf27fa [0,1,0,1,0,0|2,0,0]=4 18852 B13R2.57 OCN1CCc2ncccc2C1 2b25c768df1338c2684f5a58055fb958 [0,1,0,1,0,0|2,0,0]=4 18853 B13R2.3203 CC1(CC1)CNc2ccccc2 5b2747131755eb0c99d5e012d3191cf2 [0,1,0,1,0,0|2,0,0]=4 18854 B13R2.3203 CC1(CC1)CNc2ccccn2 90b73c175ba4856f3a8d9c73a1597f69 [0,1,0,1,0,0|1,0,0]=3 18855 B13R2.3203 CC1(CC1)CNc2cccnn2 815fe9ab756742507a4655fcd78e44bc [0,1,0,1,0,0|2,0,0]=4 18856 B13R2.3203 CC1(CC1)CNc2ccncn2 beb868374b3d9a8dfbc5f26231835ad1 [0,1,0,1,0,0|2,0,0]=4 18857 B13R2.3203 CC1(CC1)CNc2cnccn2 c0a1c5ab3a15c7fd1041f72ffd3c4fe0 [0,1,0,1,0,0|2,0,0]=4 18858 B13R2.3203 CC1(CC1)CNc2ncccn2 062dc624b2c2424e335d45f8b6d37a94 [0,1,0,1,0,0|2,0,0]=4 18859 B13R2.3203 CC1(CC1)COc2ccccn2 d6d4fc8d7482872f37cbcdc2e2fc2eec [0,1,0,1,0,0|1,0,0]=3 18860 B13R2.3203 CC1(CC1)COc2cnccn2 d872aec2eb4b9cd82bcecb8b12276c8b [0,1,0,1,0,0|2,0,0]=4 18861 B13R2.3203 CC1(CC1)COc2ncccn2 db7153a49d863d58823b44b8e7a6dea7 [0,1,0,1,0,0|2,0,0]=4 18862 B13R2.3203 CC1(CC1)NCc2ccccc2 95cfa4c5deeec624a45ab39a0fdc89eb [0,1,0,1,0,0|2,0,0]=4 18863 B13R2.3203 CC1(CC1)NCc2ccccn2 0a1307873924870e29c1d4c12af1cbf5 [0,1,0,1,0,0|1,0,0]=3 18864 B13R2.3203 CC1(CC1)NCc2cccnn2 42c8ee5bdadd5edf9a062022c1fbaf53 [0,1,0,1,0,0|2,0,0]=4 18865 B13R2.3203 CC1(CC1)NCc2ccncn2 4e54a1e26367d2825eff49e1ca9d1c3b [0,1,0,1,0,0|2,0,0]=4 18866 B13R2.3203 CC1(CC1)NCc2ncccn2 3d80088e01069b5921490f8a5aac0031 [0,1,0,1,0,0|2,0,0]=4 18867 B13R2.3203 FC1(CC1)CNc2ccccc2 da20d03de0e5f75efd87dcec5af5315e [0,1,0,1,0,0|2,0,0]=4 18868 B13R2.3203 FC1(CC1)CNc2ccccn2 7ca9cf8a8f5e928030317427efc1d797 [0,1,0,1,0,0|1,0,0]=3 18869 B13R2.3203 FC1(CC1)CNc2cccnn2 20ceac5bfdbfd26ad2d57e0892220c9e [0,1,0,1,0,0|2,0,0]=4 18870 B13R2.3203 FC1(CC1)CNc2ccncn2 2b89d9228a3371a59f06860b7386baa9 [0,1,0,1,0,0|2,0,0]=4 18871 B13R2.3203 FC1(CC1)CNc2cnccn2 6bcfedc9dff3798a88582e8094bf1d67 [0,1,0,1,0,0|2,0,0]=4 18872 B13R2.3203 FC1(CC1)CNc2ncccn2 d91bf390386741dc96e2ecd7cafbac4d [0,1,0,1,0,0|2,0,0]=4 18873 B13R2.3203 FC1(CC1)COc2ccccn2 5c8903dc560db4d156932bcf65730e47 [0,1,0,1,0,0|1,0,0]=3 18874 B13R2.3203 FC1(CC1)COc2cnccn2 1bf91f5d8628c503f07828d588199bda [0,1,0,1,0,0|2,0,0]=4 18875 B13R2.3203 FC1(CC1)COc2ncccn2 b092c3e1d227c4156a16827940a8df45 [0,1,0,1,0,0|2,0,0]=4 18876 B13R2.3203 OC1(CC1)CNc2ccccc2 001eef834af10e6558220e5838dcdaee [0,1,0,1,0,0|2,0,0]=4 18877 B13R2.153 CC1CC1Nc2cncc(n2)F 8f4ef4ddb986cadf015fd55d9c33eebc [0,1,0,1,0,0|2,0,0]=4 18878 B13R2.153 Cc1cccc(c1)NC2CC2C 6bea79ef13b6742280e4618a3c4c8e7a [0,1,0,1,0,0|2,0,0]=4 18879 B13R2.153 Cc1ccnc(n1)NC2CC2C 4602b9f01a55262e68e00f01d636bc2a [0,1,0,1,0,0|2,0,0]=4 18880 B13R2.662 CCN1CCc2c1ccc(c2)Cl b3c4d0a24b4c6e5bad8be5bb1cb2933c [0,1,0,1,0,0|2,0,0]=4 18881 B13R2.662 CCN1CCc2c1ccc(c2)F a40be9fcaf2969e4bf325ed25f58a4ab [0,1,0,1,0,0|2,0,0]=4 18882 B13R2.662 CCN1CCc2c1ccc(c2)I 11f2bcf6e76dabd53092942c7459e206 [0,1,0,1,0,0|2,0,0]=4 18883 B13R2.662 CCN1CCc2c1ccc(n2)Br 7a64b15e5e8d9b74cf5fe5802868dd64 [0,1,0,1,0,0|1,0,0]=3 18884 B13R2.662 CCN1CCc2c1ccc(n2)Cl 632e13e14534b557b8c36d3da4909834 [0,1,0,1,0,0|1,0,0]=3 18885 B13R2.662 FCN1CCc2c1ccc(n2)Br 16f14be9155de941aec94bea95537fdf [0,1,0,1,0,0|2,0,0]=4 18886 B13R2.662 FCN1CCc2c1ccc(n2)Cl 9ce4f585014eef3bb896b658a7f82674 [0,1,0,1,0,0|2,0,0]=4 18887 B13R2.662 OCN1CCc2c1ccc(n2)Br 255fd7106b360ac89fc844c52671396d [0,1,0,1,0,0|2,0,0]=4 18888 B13R2.662 OCN1CCc2c1ccc(n2)Cl e23b13900d3c50d05e95f495fb40b5a6 [0,1,0,1,0,0|2,0,0]=4 18889 B13R2.2091 CCN1CCc2c1c(ccc2)Cl 78b6a9799e4dea6d32d8e4964bff2979 [0,1,0,1,0,0|2,0,0]=4 18890 B13R2.2091 CCN1CCc2c1c(ccc2)F 0c41316ca1b4b480c45e9a41401aeae5 [0,1,0,1,0,0|2,0,0]=4 18891 B13R2.3021 Brc1cccc(c1)CN2CCC2 91803036a24627706fa2c47f07f0523c [0,1,0,1,0,0|2,0,0]=4 18892 B13R2.3021 Brc1cccc(n1)CN2CCC2 8efe289dc61f5d4a7d050c89d2b472d1 [0,1,0,1,0,0|1,0,0]=3 18893 B13R2.3021 Brc1ccnc(c1)CN2CCC2 55f8563b0b636f4e23190b3772078822 [0,1,0,1,0,0|1,0,0]=3 18894 B13R2.3021 Brc1ccnc(c1)NC2CCC2 4d63566231b44a3d7ddb0a710c3dd4ab [0,1,0,1,0,0|1,0,0]=3 18895 B13R2.3021 Brc1ccnc(c1)OC2CCC2 6679720b16fe4668b4cab471e2acf55c [0,1,0,1,0,0|1,0,0]=3 18896 B13R2.3021 Brc1ccnc(c1)OC2COC2 539f068cfed9970cdfeb5eb684455a90 [0,1,0,1,0,0|2,0,0]=4 18897 B13R2.3021 Brc1ccnc(n1)NC2CCC2 c759e9061f35f0b1b9183d22a143baf9 [0,1,0,1,0,0|2,0,0]=4 18898 B13R2.3021 Brc1cnnc(c1)NC2CCC2 82b1e670bdec71fd283cddbef4765557 [0,1,0,1,0,0|2,0,0]=4 18899 B13R2.3021 Brc1nccc(n1)NC2CCC2 7c51a5431422b3e4395e772b03fc7f3e [0,1,0,1,0,0|2,0,0]=4 18900 B13R2.3021 Cc1cccc(c1)CN2CCC2 81654fb81cd88c955d3e51ff482f968f [0,1,0,1,0,0|2,0,0]=4 18901 B13R2.3021 Cc1cccc(c1)NC2CCC2 8ded7817c7c593d90ecb8a29d8404308 [0,1,0,1,0,0|2,0,0]=4 18902 B13R2.3021 Cc1cccc(c1)OC2CCC2 87f873e4e680a9b3acf8ec1fce3a4eea [0,1,0,1,0,0|2,0,0]=4 18903 B13R2.3021 Cc1cccc(n1)CN2CCC2 af157f08b7bf9339fa7254d95b7b4e56 [0,1,0,1,0,0|1,0,0]=3 18904 B13R2.3021 Cc1ccnc(c1)NC2CCC2 610987dbc27d15951b8afce2c1348ceb [0,1,0,1,0,0|1,0,0]=3 18905 B13R2.3021 Cc1ccnc(c1)OC2CCC2 7643cf16c109bb288a8cde5832ed1c33 [0,1,0,1,0,0|1,0,0]=3 18906 B13R2.3021 Cc1ccnc(n1)CN2CCC2 7e26af5c709dfa9154b2ab48230e0d45 [0,1,0,1,0,0|2,0,0]=4 18907 B13R2.3021 Cc1ccnc(n1)NC2CCC2 6092430152db338ced05a11f70e51ca2 [0,1,0,1,0,0|2,0,0]=4 18908 B13R2.3021 Cc1cnnc(c1)CN2CCC2 aa154a520e6acb2416ca89693f485303 [0,1,0,1,0,0|2,0,0]=4 18909 B13R2.3021 Cc1nccc(n1)NC2CCC2 34623557c6c0989afc6aab8f0c230645 [0,1,0,1,0,0|2,0,0]=4 18910 B13R2.3021 Clc1cccc(c1)CN2CCC2 6390a4bedf3e238b8fa7db3eea48f0a3 [0,1,0,1,0,0|2,0,0]=4 18911 B13R2.3021 Clc1cccc(c1)NC2CCC2 23ce50d57e0b8927103f52ca9b48bce2 [0,1,0,1,0,0|2,0,0]=4 18912 B13R2.3021 Clc1cccc(c1)OC2CCC2 6803fa65254885f0776bbe1546ed23ae [0,1,0,1,0,0|2,0,0]=4 18913 B13R2.3021 Clc1cccc(n1)CN2CCC2 ca1869918a53f63c3e71b82a4380a44e [0,1,0,1,0,0|1,0,0]=3 18914 B13R2.3021 Clc1ccnc(c1)CN2CCC2 a9585b3626e24dc9fc7d8f73c1df7b47 [0,1,0,1,0,0|1,0,0]=3 18915 B13R2.3021 Clc1ccnc(c1)OC2CCC2 38373ccaadc38dfee7e62a1fbc4bb2b3 [0,1,0,1,0,0|1,0,0]=3 18916 B13R2.3021 Clc1ccnc(n1)CN2CCC2 8f7f59e69170277b7c71c3ed0f549bb3 [0,1,0,1,0,0|2,0,0]=4 18917 B13R2.3021 Clc1ccnc(n1)NC2CCC2 96d3ee91d68279e85927884338f058eb [0,1,0,1,0,0|2,0,0]=4 18918 B13R2.3021 Clc1nccc(n1)CN2CCC2 c04017609320dfd231f6e20c31c5915d [0,1,0,1,0,0|2,0,0]=4 18919 B13R2.3021 Clc1nccc(n1)NC2CCC2 e1c1967b32ceb9c235558544b69d6523 [0,1,0,1,0,0|2,0,0]=4 18920 B13R2.3021 Clc1nccc(n1)OC2CCC2 409b96daea2a19a5080d3e7e1586c3c9 [0,1,0,1,0,0|2,0,0]=4 18921 B13R2.3021 Fc1cccc(c1)CN2CCC2 b2fcd462b17768bf1395a20ea1ca19e6 [0,1,0,1,0,0|2,0,0]=4 18922 B13R2.3021 Fc1cccc(c1)NC2CCC2 d8717984b89235efa2c685d9c8f43efa [0,1,0,1,0,0|2,0,0]=4 18923 B13R2.3021 Fc1cccc(c1)OC2CCC2 f07261cbf856f1f80c8a4a49bb3d46da [0,1,0,1,0,0|2,0,0]=4 18924 B13R2.3021 Fc1cccc(n1)CN2CCC2 977fc5f29ba85fa3fed4cf469678b93f [0,1,0,1,0,0|1,0,0]=3 18925 B13R2.3021 Fc1ccnc(c1)OC2CCC2 f427f9d2d0f27b5e7d34b657e361ff9d [0,1,0,1,0,0|1,0,0]=3 18926 B13R2.3021 Fc1ccnc(c1)OC2COC2 9380a1c237afeb5a5b30a21d13ec693d [0,1,0,1,0,0|2,0,0]=4 18927 B13R2.3021 Fc1ccnc(n1)NC2CCC2 4b86d5c57cc05789e41adaa9d0982b98 [0,1,0,1,0,0|2,0,0]=4 18928 B13R2.3021 Fc1nccc(n1)NC2CCC2 d900da167a61676d3c680699b3af6098 [0,1,0,1,0,0|2,0,0]=4 18929 B13R2.3021 Ic1cccc(c1)CN2CCC2 d6c24b357746871a4b7ee1fff17ef786 [0,1,0,1,0,0|2,0,0]=4 18930 B13R2.3021 Ic1cccc(c1)OC2CCC2 c74752d88c8da0c465a266fa35917be7 [0,1,0,1,0,0|2,0,0]=4 18931 B13R2.3021 Ic1ccnc(n1)NC2CCC2 4afe84da2afd7577ac47b31f1e15a956 [0,1,0,1,0,0|2,0,0]=4 18932 B13R2.3021 O=c1ccnc([nH]1)NC2CCC2 63108872ad5a1edc67efce56dd738ea0 [0,1,0,1,0,0|2,0,0]=4 18933 B13R2.3021 O=c1nc(cc[nH]1)NC2CCC2 0bb674d77ca16773b086ec8b0b164d48 [0,1,0,1,0,0|2,0,0]=4 18934 B13R2.3021 Sc1cccc(c1)OC2CCC2 35a90594619df6000998fef068338ac4 [0,1,0,1,0,0|2,0,0]=4 18935 B13R2.3021 Sc1ccnc(n1)NC2CCC2 5b131807a57127b5389e777944c3d168 [0,1,0,1,0,0|2,0,0]=4 18936 B13R2.5331 Brc1cc(ncn1)NCC2CC2 3744995cdf5af7c3f878c772d285764f [0,1,0,1,0,0|2,0,0]=4 18937 B13R2.5331 Brc1cc(ncn1)OCC2CC2 35b3b6fd8d6300680142337ef7947f57 [0,1,0,1,0,0|2,0,0]=4 18938 B13R2.5331 Brc1cccc(c1)CNC2CC2 f1f308eee460257a2716423a42edb86d [0,1,0,1,0,0|2,0,0]=4 18939 B13R2.5331 Brc1cccc(c1)COC2CC2 bc25e841f3f258c0f5d1958eca4b0945 [0,1,0,1,0,0|2,0,0]=4 18940 B13R2.5331 Brc1cccc(c1)NCC2CC2 921677c955657de47e2aaf6272da38a3 [0,1,0,1,0,0|2,0,0]=4 18941 B13R2.5331 Brc1cccc(c1)OCC2CC2 d2f0362764f4451d5469a1b6e65b6f4e [0,1,0,1,0,0|2,0,0]=4 18942 B13R2.5331 Brc1cccc(n1)CNC2CC2 11269823ee8387844fbe0699e15f67d2 [0,1,0,1,0,0|1,0,0]=3 18943 B13R2.5331 Brc1cccc(n1)COC2CC2 811813f961ca0667e6db24fac760bd37 [0,1,0,1,0,0|1,0,0]=3 18944 B13R2.5331 Brc1cccc(n1)NCC2CC2 6d90010a89eadc1be7edad51e13e9f51 [0,1,0,1,0,0|1,0,0]=3 18945 B13R2.5331 Brc1cccc(n1)OCC2CC2 76a4c1c5fced7fe2abfba5adc5dbd643 [0,1,0,1,0,0|1,0,0]=3 18946 B13R2.5331 Brc1ccnc(c1)CNC2CC2 9516d79cbbf64f0e138cfbce8165888c [0,1,0,1,0,0|1,0,0]=3 18947 B13R2.5331 Brc1ccnc(c1)COC2CC2 5107a5f3511a7961da7bc6783f1d9156 [0,1,0,1,0,0|1,0,0]=3 18948 B13R2.5331 Brc1ccnc(c1)NCC2CC2 3c5416a77935450377df596984474ecb [0,1,0,1,0,0|1,0,0]=3 18949 B13R2.5331 Brc1ccnc(c1)OCC2CC2 66ca3bb356280f0a0f06e4518cb7f8df [0,1,0,1,0,0|1,0,0]=3 18950 B13R2.5331 Brc1ccnc(n1)NCC2CC2 5102a4f5d5963de85f5492c4aa4661f3 [0,1,0,1,0,0|2,0,0]=4 18951 B13R2.5331 Brc1cncc(n1)COC2CC2 0d67813492f41d4f46ea350abb0c5be7 [0,1,0,1,0,0|2,0,0]=4 18952 B13R2.5331 Brc1cncc(n1)NCC2CC2 adf61af15a3a07036faeb4dd30a18318 [0,1,0,1,0,0|2,0,0]=4 18953 B13R2.5331 Brc1cncc(n1)OCC2CC2 69feb7a0759997cded332c9d5f06a0af [0,1,0,1,0,0|2,0,0]=4 18954 B13R2.5331 Brc1cnnc(c1)NCC2CC2 6c71dd64e46eb49992eeee24a340e157 [0,1,0,1,0,0|2,0,0]=4 18955 B13R2.5331 Brc1nccc(n1)NCC2CC2 32949ed1163e500b2f09384b8516c387 [0,1,0,1,0,0|2,0,0]=4 18956 B13R2.5331 Cc1cc(ncn1)COC2CC2 42662104bbc5d0681f9a8fa6182895af [0,1,0,1,0,0|2,0,0]=4 18957 B13R2.5331 Cc1cc(ncn1)NCC2CC2 d0ddadff8034f51b08c14e5ea0a11f4b [0,1,0,1,0,0|2,0,0]=4 18958 B13R2.5331 Cc1cc(ncn1)OCC2CC2 e6192be4dd92ffff46063e495c21e451 [0,1,0,1,0,0|2,0,0]=4 18959 B13R2.5331 Cc1cccc(c1)CNC2CC2 0f7f1082cae530b2e798592232ce960f [0,1,0,1,0,0|2,0,0]=4 18960 B13R2.5331 Cc1cccc(c1)COC2CC2 660d8e0a21e90065593cb40b072de604 [0,1,0,1,0,0|2,0,0]=4 18961 B13R2.5331 Cc1cccc(c1)NCC2CC2 f59001fb7d427fbdd2c5c9eb4c5ecf93 [0,1,0,1,0,0|2,0,0]=4 18962 B13R2.5331 Cc1cccc(c1)OCC2CC2 38e5c792c629987e61ca6ad57099dcfa [0,1,0,1,0,0|2,0,0]=4 18963 B13R2.5331 Cc1cccc(n1)CNC2CC2 ee7874332a20a94e225ff2e56315c346 [0,1,0,1,0,0|1,0,0]=3 18964 B13R2.5331 Cc1cccc(n1)COC2CC2 6f4f118acbe437a274a2acf7dad320a6 [0,1,0,1,0,0|1,0,0]=3 18965 B13R2.5331 Cc1cccc(n1)NCC2CC2 b7f81120599a641aa1e62b4754407f5f [0,1,0,1,0,0|1,0,0]=3 18966 B13R2.5331 Cc1cccc(n1)OCC2CC2 e81832e81c90fd1a7a08960853b79fb9 [0,1,0,1,0,0|1,0,0]=3 18967 B13R2.5331 Cc1ccnc(c1)CNC2CC2 2cb8e29eaac7c46527622ee71d734be3 [0,1,0,1,0,0|1,0,0]=3 18968 B13R2.5331 Cc1ccnc(c1)COC2CC2 0ae350f9263f0a854ec53d38c93cdf29 [0,1,0,1,0,0|1,0,0]=3 18969 B13R2.5331 Cc1ccnc(c1)NCC2CC2 f2909dfa164dbbac210270881038cf3b [0,1,0,1,0,0|1,0,0]=3 18970 B13R2.5331 Cc1ccnc(c1)OCC2CC2 d5b4810bf5c5d322581f9a0f5180d8d2 [0,1,0,1,0,0|1,0,0]=3 18971 B13R2.5331 Cc1ccnc(n1)CNC2CC2 9d8e53953e0c93884b79262e207bee95 [0,1,0,1,0,0|2,0,0]=4 18972 B13R2.5331 Cc1ccnc(n1)COC2CC2 2d91b511e0809ff9f919632dcfa42045 [0,1,0,1,0,0|2,0,0]=4 18973 B13R2.5331 Cc1ccnc(n1)NCC2CC2 5afff13d33d1006f839c10e578134f24 [0,1,0,1,0,0|2,0,0]=4 18974 B13R2.5331 Cc1cncc(n1)NCC2CC2 82de8187f6b47ff5454ec820a135c322 [0,1,0,1,0,0|2,0,0]=4 18975 B13R2.5331 Cc1cnnc(c1)COC2CC2 3d202099ae48870ddf127d0e8e59bc44 [0,1,0,1,0,0|2,0,0]=4 18976 B13R2.5331 Cc1cnnc(c1)NCC2CC2 9dbd5a0b98d685afd29e7b6ec9226a15 [0,1,0,1,0,0|2,0,0]=4 18977 B13R2.5331 Cc1nccc(n1)COC2CC2 42ebfe2bbddfd5510a9c9a50a7cd42d4 [0,1,0,1,0,0|2,0,0]=4 18978 B13R2.5331 Cc1nccc(n1)NCC2CC2 464ce3feb4b61cb30f24723161fec447 [0,1,0,1,0,0|2,0,0]=4 18979 B13R2.5331 Cc1nccc(n1)OCC2CC2 5ba23ea5e18793c26414f1b78da879bf [0,1,0,1,0,0|2,0,0]=4 18980 B13R2.5331 Clc1cc(ncn1)COC2CC2 32347b51651b0560ff228dccda0ef455 [0,1,0,1,0,0|2,0,0]=4 18981 B13R2.5331 Clc1cc(ncn1)NCC2CC2 836ec68b66877a4d62fd1887679c7d96 [0,1,0,1,0,0|2,0,0]=4 18982 B13R2.5331 Clc1cc(ncn1)OCC2CC2 6d0fd9d61929c076a436030f825d9f8a [0,1,0,1,0,0|2,0,0]=4 18983 B13R2.5331 Clc1cccc(c1)CNC2CC2 7960f44a10213787af1c09e11566a3e2 [0,1,0,1,0,0|2,0,0]=4 18984 B13R2.5331 Clc1cccc(c1)COC2CC2 a9c025c7f8307171adb165fce44218a9 [0,1,0,1,0,0|2,0,0]=4 18985 B13R2.5331 Clc1cccc(c1)NCC2CC2 924f2df18f7e61ff9579cb116540f94f [0,1,0,1,0,0|2,0,0]=4 18986 B13R2.5331 Clc1cccc(c1)OCC2CC2 4c43ccff23b5218e0b185a1207a4f9c3 [0,1,0,1,0,0|2,0,0]=4 18987 B13R2.5331 Clc1cccc(n1)CNC2CC2 1c86ff0f637cfad7186e7c15e040ed14 [0,1,0,1,0,0|1,0,0]=3 18988 B13R2.5331 Clc1cccc(n1)COC2CC2 2a77ed1aa34776c321759cc6effb2fdb [0,1,0,1,0,0|1,0,0]=3 18989 B13R2.5331 Clc1cccc(n1)NCC2CC2 fd1c6fe1506f79a73bade5b63576f53a [0,1,0,1,0,0|1,0,0]=3 18990 B13R2.5331 Clc1ccnc(c1)CNC2CC2 0c2c31d44eddebc96c60c41e7b17961c [0,1,0,1,0,0|1,0,0]=3 18991 B13R2.5331 Clc1ccnc(c1)COC2CC2 270f59e5f2e3fd21f9c93333703da50c [0,1,0,1,0,0|1,0,0]=3 18992 B13R2.5331 Clc1ccnc(c1)NCC2CC2 1cfeac3d0604f94d407969bb02dd5b1c [0,1,0,1,0,0|1,0,0]=3 18993 B13R2.5331 Clc1ccnc(c1)OCC2CC2 c6378d18812aec8dd233ff77766554a8 [0,1,0,1,0,0|1,0,0]=3 18994 B13R2.5331 Clc1ccnc(n1)CNC2CC2 1b685ea7d2396857c66ebced67864176 [0,1,0,1,0,0|2,0,0]=4 18995 B13R2.5331 Clc1ccnc(n1)COC2CC2 5d6eb9bb00c428caac5fc4d42faca2c7 [0,1,0,1,0,0|2,0,0]=4 18996 B13R2.5331 Clc1ccnc(n1)NCC2CC2 60479b925f61c3cbf4d28e3a63bdb711 [0,1,0,1,0,0|2,0,0]=4 18997 B13R2.5331 Clc1ccnc(n1)OCC2CC2 67ba8f4e76a8b00f5a87a14170e12659 [0,1,0,1,0,0|2,0,0]=4 18998 B13R2.5331 Clc1cncc(n1)COC2CC2 6c63dbd7eb189995eb1e16bf3158a5c1 [0,1,0,1,0,0|2,0,0]=4 18999 B13R2.5331 Clc1cncc(n1)NCC2CC2 460d0722b8377034ca27c53f1511b8e7 [0,1,0,1,0,0|2,0,0]=4 19000 B13R2.5331 Clc1cncc(n1)OCC2CC2 54718fa126fa0da731c8dbc6e00ed754 [0,1,0,1,0,0|2,0,0]=4 19001 B13R2.5331 Clc1cnnc(c1)NCC2CC2 e8d2c73e9aff2d4e2697686fb5efc7cd [0,1,0,1,0,0|2,0,0]=4 19002 B13R2.5331 Clc1nccc(n1)CNC2CC2 3acaea2237932e031f9916493602f2f0 [0,1,0,1,0,0|2,0,0]=4 19003 B13R2.5331 Clc1nccc(n1)COC2CC2 e0887fde4b1aeba4becd842b5163edc6 [0,1,0,1,0,0|2,0,0]=4 19004 B13R2.5331 Clc1nccc(n1)NCC2CC2 4af6afc87fe0ab6c5170c3f9d8cc8546 [0,1,0,1,0,0|2,0,0]=4 19005 B13R2.5331 Clc1nccc(n1)OCC2CC2 b1bd56a37e986154dd28f05ac9f183e9 [0,1,0,1,0,0|2,0,0]=4 19006 B13R2.5331 Fc1cc(ncn1)NCC2CC2 d2206f900e753b1e6c777c5e47f89c82 [0,1,0,1,0,0|2,0,0]=4 19007 B13R2.5331 Fc1cccc(c1)CNC2CC2 38336cbb255c99239cbaf8d1960fe402 [0,1,0,1,0,0|2,0,0]=4 19008 B13R2.5331 Fc1cccc(c1)COC2CC2 d1b1244c49651faf6869794c4ebb873f [0,1,0,1,0,0|2,0,0]=4 19009 B13R2.5331 Fc1cccc(c1)NCC2CC2 bda290414b4b839f6caf3242218b7cc1 [0,1,0,1,0,0|2,0,0]=4 19010 B13R2.5331 Fc1cccc(c1)OCC2CC2 82d52d20221d1146f3d855fb6da36a81 [0,1,0,1,0,0|2,0,0]=4 19011 B13R2.5331 Fc1cccc(n1)CNC2CC2 e1439e459cd16ee985eb07a47791047d [0,1,0,1,0,0|1,0,0]=3 19012 B13R2.5331 Fc1cccc(n1)COC2CC2 14265c3cb00ca7c9b111f79036be43e6 [0,1,0,1,0,0|1,0,0]=3 19013 B13R2.5331 Fc1cccc(n1)NCC2CC2 0325fd5d39acecf5350725f1bb3cdc49 [0,1,0,1,0,0|1,0,0]=3 19014 B13R2.5331 Fc1cccc(n1)OCC2CC2 d66ee2c65c4ba87b6a2bf89f3b6d6b65 [0,1,0,1,0,0|1,0,0]=3 19015 B13R2.5331 Fc1ccnc(c1)COC2CC2 93ee06e0494b2a31077d1741ba5e59a8 [0,1,0,1,0,0|1,0,0]=3 19016 B13R2.5331 Fc1ccnc(c1)NCC2CC2 76024557378ed603405bc73c5dbc4751 [0,1,0,1,0,0|1,0,0]=3 19017 B13R2.5331 Fc1ccnc(c1)OCC2CC2 4df2d934eda72f56865ec3c850ead00f [0,1,0,1,0,0|1,0,0]=3 19018 B13R2.5331 Fc1ccnc(n1)NCC2CC2 618c17f9cf53cf3a45556a1e737e358e [0,1,0,1,0,0|2,0,0]=4 19019 B13R2.5331 Fc1cncc(n1)NCC2CC2 b113978ff33f494bbd6f240a89cc81e1 [0,1,0,1,0,0|2,0,0]=4 19020 B13R2.5331 Fc1nccc(n1)NCC2CC2 0d0a1d6de3c16861b259e4e10b495c22 [0,1,0,1,0,0|2,0,0]=4 19021 B13R2.5331 Ic1cc(ncn1)NCC2CC2 ebc627b50d419da3aa5981028d000832 [0,1,0,1,0,0|2,0,0]=4 19022 B13R2.5331 Ic1cccc(c1)CNC2CC2 73bbcb4730b3c22cca2f3fda76e50050 [0,1,0,1,0,0|2,0,0]=4 19023 B13R2.5331 Ic1cccc(c1)COC2CC2 69e757453938dc5df13558b486b9a09b [0,1,0,1,0,0|2,0,0]=4 19024 B13R2.5331 Ic1cccc(c1)NCC2CC2 58e082c9a2ca3f3f3f6911d4dd8e3a07 [0,1,0,1,0,0|2,0,0]=4 19025 B13R2.5331 Ic1cccc(c1)OCC2CC2 3b59edece84b58e12c33fd4a2366bbaa [0,1,0,1,0,0|2,0,0]=4 19026 B13R2.5331 Ic1cccc(n1)COC2CC2 3888a5f0f1f53bf7b36c7bfe73817046 [0,1,0,1,0,0|1,0,0]=3 19027 B13R2.5331 Ic1cccc(n1)NCC2CC2 675e2294f23ff2377b861c8e615b05f5 [0,1,0,1,0,0|1,0,0]=3 19028 B13R2.5331 Ic1ccnc(c1)COC2CC2 3ce124649074810c10a5c633cc9cf7f5 [0,1,0,1,0,0|1,0,0]=3 19029 B13R2.5331 Ic1ccnc(c1)NCC2CC2 b354d2fa009419be6483d28dc3a618d2 [0,1,0,1,0,0|1,0,0]=3 19030 B13R2.5331 Ic1ccnc(n1)NCC2CC2 68354916d2ae2666818fb7318df4e291 [0,1,0,1,0,0|2,0,0]=4 19031 B13R2.5331 O=c1cccc([nH]1)NCC2CC2 3ee02eac176710f82c77535aa81dee99 [0,1,0,1,0,0|1,0,1]=4 19032 B13R2.5331 O=c1cccc([nH]1)OCC2CC2 906e33e9a64781bd6a322fb27c5453c9 [0,1,0,1,0,0|1,0,1]=4 19033 B13R2.5331 O=c1ccnc([nH]1)NCC2CC2 168f50c8314d2837388499b66708912a [0,1,0,1,0,0|2,0,0]=4 19034 B13R2.5331 O=c1nc(cc[nH]1)NCC2CC2 f7e206be16039657b249ee44c560a47a [0,1,0,1,0,0|2,0,0]=4 19035 B13R2.5331 Sc1cccc(c1)NCC2CC2 225c9360c4042e5583d69c83b71fee54 [0,1,0,1,0,0|2,0,0]=4 19036 B13R2.5331 Sc1cccc(c1)OCC2CC2 95f64d88bd4528dd923625cdd374a4ab [0,1,0,1,0,0|2,0,0]=4 19037 B13R2.5331 Sc1ccnc(n1)NCC2CC2 ec5b0ac80d806caa3647f5fae631270c [0,1,0,1,0,0|2,0,0]=4 19038 B13R2.5331 Sc1ccnc(n1)OCC2CC2 b67e9fc435062629e31615ab3fcf6fe8 [0,1,0,1,0,0|2,0,0]=4 19039 B13R2.5331 Sc1nccc(n1)NCC2CC2 0a82bb8b52d6576ed8af74fb98ef244a [0,1,0,1,0,0|2,0,0]=4 19040 B13R2.5331 [O-][n+]1ccnc(c1)NCC2CC2 de89b1d112029c914da32ee9dc5bc368 [0,1,0,1,0,0|2,0,0]=4 19041 B13R2.690 CN(CC1CC1)c2ccccc2 52c95350830ca837805f53a7d831b0cd [0,1,0,1,0,0|2,0,0]=4 19042 B13R2.690 CN(CC1CC1)c2ccccn2 1c3d59a1de53639ba54598cff16de974 [0,1,0,1,0,0|1,0,0]=3 19043 B13R2.690 CN(CC1CC1)c2cccnn2 f0eb565aa3317133d241b0e4c41592cd [0,1,0,1,0,0|2,0,0]=4 19044 B13R2.690 CN(CC1CC1)c2ccncn2 0f8e383a153fef24aa5c119aa0eab0e5 [0,1,0,1,0,0|2,0,0]=4 19045 B13R2.690 CN(CC1CC1)c2cnccn2 feb0cc74ec95ef966ce672945880efd9 [0,1,0,1,0,0|2,0,0]=4 19046 B13R2.690 CN(CC1CC1)c2ncccn2 b44912b77db70d83c106341bf266918c [0,1,0,1,0,0|2,0,0]=4 19047 B13R2.690 O=C(NC1CC1)c2ccccn2 7f3142d679d5543e4f0a7f7b6ef7dbf6 [0,1,0,1,0,0|1,0,1]=4 19048 B13R2.2931 CCN1CC(c2c1cccc2)C d351fb04ec5866ada32a5fc0ba14af30 [0,1,0,1,0,0|2,0,0]=4 19049 B13R2.8137 CN(c1ncccn1)C2CCC2 01ac73c3df87acc2c80c89fa60d2017c [0,1,0,1,0,0|2,0,0]=4 19050 B13R2.8137 O=C(c1ccccn1)N2CCC2 2a4a58ac030c443d82a8a74e87e84692 [0,1,0,1,0,0|1,0,1]=4 19051 B13R2.26 CCCN1Cc2ccccc2C1 454701ff7217ba9a0027b896230335b2 [0,1,0,1,0,0|2,0,0]=4 19052 B13R2.26 CCCN1Cc2cccnc2C1 80c3aabcbd2cfc151d65affac636d179 [0,1,0,1,0,0|1,0,0]=3 19053 B13R2.26 CCCN1Cc2cncnc2C1 9028a5ad4c09b0b972eecb6aa3df333e [0,1,0,1,0,0|2,0,0]=4 19054 B13R2.26 CCCN1Cc2nccnc2C1 e55e38d42c8fceb7b5dd153b865cb209 [0,1,0,1,0,0|2,0,0]=4 19055 B13R2.26 CCNC1Cc2cccnc2C1 b187c757420ed75d7ec88068128b829e [0,1,0,1,0,0|1,0,0]=3 19056 B13R2.26 CCOC1Cc2ccccc2C1 40398de306682bfed844d3bf925e2edc [0,1,0,1,0,0|2,0,0]=4 19057 B13R2.26 CCOC1Cc2cccnc2C1 ceb43988726cafd803cf5afa3fa32ef5 [0,1,0,1,0,0|1,0,0]=3 19058 B13R2.26 COCN1Cc2cccnc2C1 4aa906d5cc0608c64fafe3acec845a9d [0,1,0,1,0,0|2,0,0]=4 19059 B13R2.26 CSCN1Cc2cccnc2C1 844b4fc906a34cb959f467a593914147 [0,1,0,1,0,0|2,0,0]=4 19060 B13R2.26 FCCN1Cc2cccnc2C1 e28a79e725f131c27c28d30f9f94d3af [0,1,0,1,0,0|2,0,0]=4 19061 B13R2.26 FCNC1Cc2cccnc2C1 28d3a4bf82e801c0ebc43d84a9099e69 [0,1,0,1,0,0|2,0,0]=4 19062 B13R2.26 FCOC1Cc2cccnc2C1 23df1ba53b0e54adf2cd64c55b0125d6 [0,1,0,1,0,0|2,0,0]=4 19063 B13R2.26 OCCN1Cc2cccnc2C1 7d628065b7eabd5b9471bce7cdc7ddf1 [0,1,0,1,0,0|2,0,0]=4 19064 B13R2.26 OCNC1Cc2cccnc2C1 d5f6014428254c8271683bb12d5d6ec3 [0,1,0,1,0,0|2,0,0]=4 19065 B13R2.26 SCCN1Cc2cccnc2C1 c9841008c3e17c736fd6ab5dccd719eb [0,1,0,1,0,0|2,0,0]=4 19066 B13R2.31 FC1CC(C1)Nc2ccccc2 0063bbac983356a468d92ce93db46f65 [0,1,0,1,0,0|2,0,0]=4 19067 B13R2.31 FC1CC(C1)Nc2cnccn2 deba896e43573128bc44e568a8a958ba [0,1,0,1,0,0|2,0,0]=4 19068 B13R2.31 FC1CC(C1)Nc2ncccn2 347bc821963eb08260698e2c22ab6fc5 [0,1,0,1,0,0|2,0,0]=4 19069 B13R2.31 FC1CN(C1)Cc2ccccc2 11bcd9d3b1770453c4c550c6eff15e2a [0,1,0,1,0,0|2,0,0]=4 19070 B13R2.31 FC1CN(C1)Cc2ccccn2 41f5a3adafbe448dae2d526a3f68c4dc [0,1,0,1,0,0|1,0,0]=3 19071 B13R2.31 FC1CN(C1)Cc2cccnn2 b5f211dde9d3f720bd09d91c54c4b883 [0,1,0,1,0,0|2,0,0]=4 19072 B13R2.31 FC1CN(C1)Cc2ccncn2 d9929655e471e2c8216c5d0703c46ad3 [0,1,0,1,0,0|2,0,0]=4 19073 B13R2.31 FC1CN(C1)Cc2ncccn2 6f959716c73f1340815b5f7e25f69de6 [0,1,0,1,0,0|2,0,0]=4 19074 B13R2.31 F[C@H]1C[C@@H](C1)Nc2ccccc2 3921582339f7025e25d54e17c3371c3b [0,1,0,1,0,0|2,0,0]=4 19075 B13R2.31 F[C@H]1C[C@@H](C1)Nc2cnccn2 18e862c446a1fdcb982cf223d0644bbe [0,1,0,1,0,0|2,0,0]=4 19076 B13R2.31 F[C@H]1C[C@@H](C1)Nc2ncccn2 44feeda00e2b88772b6831bf032894f5 [0,1,0,1,0,0|2,0,0]=4 19077 B13R2.31 F[C@H]1C[C@H](C1)Nc2ccccc2 31f90c435e0d11c0b8f04dc213b35f83 [0,1,0,1,0,0|2,0,0]=4 19078 B13R2.31 F[C@H]1C[C@H](C1)Nc2cnccn2 3a69abe3eedbc1174ebdf3f1f641f2d0 [0,1,0,1,0,0|2,0,0]=4 19079 B13R2.31 F[C@H]1C[C@H](C1)Nc2ncccn2 b348d20876962bdd3452cab0e310875d [0,1,0,1,0,0|2,0,0]=4 19080 B13R2.31 O=C1CC(C1)Oc2ccccn2 71a11ba4e7e7b43d8a976e8c70eb8cde [0,1,0,1,0,0|1,0,1]=4 19081 B13R2.31 OC1CC(C1)Nc2ccccc2 71a911754938dd37972ada3ece1543ca [0,1,0,1,0,0|2,0,0]=4 19082 B13R2.31 OC1CC(C1)Nc2ccccn2 44691850885e2ad0ce72bcfecf24c83d [0,1,0,1,0,0|1,0,0]=3 19083 B13R2.31 OC1CC(C1)Nc2cccnn2 e5d79e86223e2e77104503730600f254 [0,1,0,1,0,0|2,0,0]=4 19084 B13R2.31 OC1CC(C1)Nc2ccncn2 dc38163bc68aabd88193dd69e13c9a50 [0,1,0,1,0,0|2,0,0]=4 19085 B13R2.31 OC1CC(C1)Nc2cnccn2 bc3770e3ed7ab4df96e8184fff3c3040 [0,1,0,1,0,0|2,0,0]=4 19086 B13R2.31 OC1CC(C1)Nc2ncccn2 387e4cc86b03c9306538342dc04a30fb [0,1,0,1,0,0|2,0,0]=4 19087 B13R2.31 OC1CN(C1)Cc2ccccc2 0f2d1ffeab9162a1a1611f924b72d074 [0,1,0,1,0,0|2,0,0]=4 19088 B13R2.31 OC1CN(C1)Cc2ccccn2 e39284a2f035eae0a1a0d83c31d97ddc [0,1,0,1,0,0|1,0,0]=3 19089 B13R2.31 OC1CN(C1)Cc2cccnn2 8495120121cef29a8e90bd7c1b793c01 [0,1,0,1,0,0|2,0,0]=4 19090 B13R2.31 OC1CN(C1)Cc2ccncn2 54128112724962198b42beeb6efec67a [0,1,0,1,0,0|2,0,0]=4 19091 B13R2.31 OC1CN(C1)Cc2ncccn2 7583fc7775f9eeff56d065f85750196e [0,1,0,1,0,0|2,0,0]=4 19092 B13R2.31 O[C@H]1C[C@@H](C1)Nc2ccccc2 641154e36386b330b5a15763bdae2c55 [0,1,0,1,0,0|2,0,0]=4 19093 B13R2.31 O[C@H]1C[C@@H](C1)Nc2ccccn2 d7e00d0b1421f416418d31e93e11fbd4 [0,1,0,1,0,0|1,0,0]=3 19094 B13R2.31 O[C@H]1C[C@@H](C1)Nc2cccnn2 31bd1b76045703ad0e0cb5138a1a124c [0,1,0,1,0,0|2,0,0]=4 19095 B13R2.31 O[C@H]1C[C@@H](C1)Nc2ccncn2 428e55c2a0c26df45dd763bb806b857f [0,1,0,1,0,0|2,0,0]=4 19096 B13R2.31 O[C@H]1C[C@@H](C1)Nc2cnccn2 7209e35c879982425a909f808bd06320 [0,1,0,1,0,0|2,0,0]=4 19097 B13R2.31 O[C@H]1C[C@@H](C1)Nc2ncccn2 8f4607579fd9a2054c64604fa9486505 [0,1,0,1,0,0|2,0,0]=4 19098 B13R2.31 O[C@H]1C[C@H](C1)Nc2ccccc2 d2b195e256c89f17ba7eddc9ef42ea1b [0,1,0,1,0,0|2,0,0]=4 19099 B13R2.31 O[C@H]1C[C@H](C1)Nc2ccccn2 47811582224b4533acdb77ff4e1924a7 [0,1,0,1,0,0|1,0,0]=3 19100 B13R2.31 O[C@H]1C[C@H](C1)Nc2cccnn2 c153144d2242dad9c9de987b54190660 [0,1,0,1,0,0|2,0,0]=4 19101 B13R2.31 O[C@H]1C[C@H](C1)Nc2ccncn2 8bf044ce0b890617a2c5e9a8e3eda8f3 [0,1,0,1,0,0|2,0,0]=4 19102 B13R2.31 O[C@H]1C[C@H](C1)Nc2cnccn2 53e2ab3a82b01cb6f06dfcca46635b4e [0,1,0,1,0,0|2,0,0]=4 19103 B13R2.31 O[C@H]1C[C@H](C1)Nc2ncccn2 7dcf3f24e23c0a1cdb0106beea3f5ff3 [0,1,0,1,0,0|2,0,0]=4 19104 B13R2.138 CCN1C(C1c2ccccc2)C 7347c18968ce51387f036d0fe33e59d8 [0,1,0,1,0,0|2,0,0]=4 19105 B13R2.138 CCN1[C@@H]([C@@H]1c2ccccc2)C 722e7bc8d7ea97c003f1ca9ceeeec978 [0,1,0,1,0,0|2,0,0]=4 19106 B13R2.221 CC1(CCC1)Nc2ncccn2 8ef26fbc41d6490cb9607018eb515cf7 [0,1,0,1,0,0|2,0,0]=4 19107 B13R2.444 CC(Nc1ccccc1)C2CC2 3706ecba23e815e6be707c911b57e057 [0,1,0,1,0,0|2,0,0]=4 19108 B13R2.444 CC(Nc1ccccn1)C2CC2 1074c1892019421985d62ab493eff081 [0,1,0,1,0,0|1,0,0]=3 19109 B13R2.444 CC(Nc1cccnn1)C2CC2 7ce1b96d0dbc4a73b229215185443d57 [0,1,0,1,0,0|2,0,0]=4 19110 B13R2.444 CC(Nc1ccncn1)C2CC2 5964b1e55381b792d1fa0b804e28a027 [0,1,0,1,0,0|2,0,0]=4 19111 B13R2.444 CC(Nc1cnccn1)C2CC2 4bd2834b845ef002288f9e54d1e36004 [0,1,0,1,0,0|2,0,0]=4 19112 B13R2.444 CC(Nc1ncccn1)C2CC2 ea668d142fc6c8b75dcef8b095e5b98f [0,1,0,1,0,0|2,0,0]=4 19113 B13R2.444 CC(Oc1ccccn1)C2CC2 b939b83d50040fcfacee7333879a1af5 [0,1,0,1,0,0|1,0,0]=3 19114 B13R2.444 CC(Oc1cnccn1)C2CC2 e6064cd0e73506df81133f521a5eabdf [0,1,0,1,0,0|2,0,0]=4 19115 B13R2.444 CC(Oc1ncccn1)C2CC2 3af88068295069eb3c236fc2bd283fbf [0,1,0,1,0,0|2,0,0]=4 19116 B13R2.444 CN(Cc1ccccc1)C2CC2 9f52ab7ea1a459ab7455c2343e8d9308 [0,1,0,1,0,0|2,0,0]=4 19117 B13R2.444 CN(Cc1ccccn1)C2CC2 2bdfa7c13e46714ef2652afa44b7f77a [0,1,0,1,0,0|1,0,0]=3 19118 B13R2.444 CN(Cc1cccnn1)C2CC2 d161b74313ee8a6093c74819531d7d5f [0,1,0,1,0,0|2,0,0]=4 19119 B13R2.444 CN(Cc1ccncn1)C2CC2 1c8ae323b9a2d92df5139ecca9bb36e1 [0,1,0,1,0,0|2,0,0]=4 19120 B13R2.444 CN(Cc1cnccn1)C2CC2 0f050baf9ceedc192215490b884c57c3 [0,1,0,1,0,0|2,0,0]=4 19121 B13R2.444 CN(Cc1ncccn1)C2CC2 3e203fcb28e35fe557dfe1cac4fc175e [0,1,0,1,0,0|2,0,0]=4 19122 B13R2.444 C[C@@H](Nc1ccccc1)C2CC2 799bdd408bc60a8de32fe53344c97899 [0,1,0,1,0,0|2,0,0]=4 19123 B13R2.444 C[C@@H](Nc1ccccn1)C2CC2 55bbc405ac6d715e24751e1fe1852ea8 [0,1,0,1,0,0|1,0,0]=3 19124 B13R2.444 C[C@@H](Nc1cccnn1)C2CC2 43a5fd322d32721a8add5e7b90a6194a [0,1,0,1,0,0|2,0,0]=4 19125 B13R2.444 C[C@@H](Nc1ccncn1)C2CC2 c1946b97437a62ac5658577b0ce58be1 [0,1,0,1,0,0|2,0,0]=4 19126 B13R2.444 C[C@@H](Nc1cnccn1)C2CC2 e301928817a88ba458189088864f3827 [0,1,0,1,0,0|2,0,0]=4 19127 B13R2.444 C[C@@H](Nc1ncccn1)C2CC2 e38d653b741d09a3ac81138af0df26fb [0,1,0,1,0,0|2,0,0]=4 19128 B13R2.444 C[C@H](Nc1ccccc1)C2CC2 df9af1d872dd0c81b4b119302c5a2bfd [0,1,0,1,0,0|2,0,0]=4 19129 B13R2.444 C[C@H](Nc1ccccn1)C2CC2 2032ca014f568ab9542a7401719ee8d0 [0,1,0,1,0,0|1,0,0]=3 19130 B13R2.444 C[C@H](Nc1cccnn1)C2CC2 32e5f0ed002ca6cf70dadb66055fc7de [0,1,0,1,0,0|2,0,0]=4 19131 B13R2.444 C[C@H](Nc1ccncn1)C2CC2 479f8e52d08e712cda2bae45d930ae28 [0,1,0,1,0,0|2,0,0]=4 19132 B13R2.444 C[C@H](Nc1cnccn1)C2CC2 43a1fe59501819ef6dfdd6a731f04b82 [0,1,0,1,0,0|2,0,0]=4 19133 B13R2.444 C[C@H](Nc1ncccn1)C2CC2 4fcb0002e7d99a5fe5356e3c00a99150 [0,1,0,1,0,0|2,0,0]=4 19134 B13R2.72 CC(=O)N1CCc2c1cccn2 cace13d03125c22f0b076fa307071656 [0,1,0,1,0,0|1,0,1]=4 19135 B13R2.72 CC(C)N1CCc2c1cccc2 c4d404164fbe04e55e440222637ad19d [0,1,0,1,0,0|2,0,0]=4 19136 B13R2.72 CC(C)N1CCc2c1cccn2 a94148289c0ed61288ba27d3b9239f5c [0,1,0,1,0,0|1,0,0]=3 19137 B13R2.72 CC(C)N1CCc2c1nccn2 fda165b87175b3b2af0807f5a678c8eb [0,1,0,1,0,0|2,0,0]=4 19138 B13R2.187 CC1(CC1Nc2ccccc2)C 93e5b134d0f7db927f308848af5dc163 [0,1,0,1,0,0|2,0,0]=4 19139 B13R2.187 CC1(CC1Nc2ccccn2)C d675a0665f97c2e697d6b55050fa6656 [0,1,0,1,0,0|1,0,0]=3 19140 B13R2.187 CC1(CC1Nc2cccnn2)C 901bc14c7bbde78f8773f9fe1b5fc5ee [0,1,0,1,0,0|2,0,0]=4 19141 B13R2.187 CC1(CC1Nc2ccncn2)C c4a999e92e1a0a92d9a844cbb917d9b9 [0,1,0,1,0,0|2,0,0]=4 19142 B13R2.187 CC1(CC1Nc2cnccn2)C 69c74a0c6e5b0e4f7ca7ecfe74b43d4c [0,1,0,1,0,0|2,0,0]=4 19143 B13R2.187 CC1(CC1Nc2ncccn2)C 18cc6900a0a0e4c08cf2480f50c5264c [0,1,0,1,0,0|2,0,0]=4 19144 B13R2.187 CC1(CC1Oc2ccccn2)C 0f155b42ef173d269762e3658c2eb5d3 [0,1,0,1,0,0|1,0,0]=3 19145 B13R2.187 CC1(CC1Oc2cnccn2)C d9de762e472f813f31f4a7c4036298d1 [0,1,0,1,0,0|2,0,0]=4 19146 B13R2.187 CC1(CC1Oc2ncccn2)C 6ace9ea3013812c86b74645da21ff2f7 [0,1,0,1,0,0|2,0,0]=4 19147 B13R2.187 CC1(CN1Cc2ccccc2)C 809486764f942be742a7f44bea5d4c20 [0,1,0,1,0,0|2,0,0]=4 19148 B13R2.187 CC1(CN1Cc2ccccn2)C cb5015c03663756481f2399007980e0f [0,1,0,1,0,0|1,0,0]=3 19149 B13R2.187 CC1(CN1Cc2cccnn2)C 8ade3f9534740eae672565445e2bc212 [0,1,0,1,0,0|2,0,0]=4 19150 B13R2.187 CC1(CN1Cc2ccncn2)C 3ced7b8ea242cec13a70272fe2cf8ee8 [0,1,0,1,0,0|2,0,0]=4 19151 B13R2.187 CC1(CN1Cc2ncccn2)C 7b1209c2edd49e55c34312341df4090f [0,1,0,1,0,0|2,0,0]=4 19152 B13R2.187 CC1(C[C@@H]1Nc2ccccc2)C e4d47fb69ec4679d7af8da26d624bf0d [0,1,0,1,0,0|2,0,0]=4 19153 B13R2.187 CC1(C[C@H]1Nc2ccccc2)C e70944f25f328cba8b838d11767a7492 [0,1,0,1,0,0|2,0,0]=4 19154 B13R2.187 FC1(CC1Nc2ccccn2)F 9cc183fd759b37d7d1781bb48de199d1 [0,1,0,1,0,0|2,0,0]=4 19155 B13R2.187 FC1(CC1Oc2ccccn2)F 9e805c6ad1822b38e85090e5210c2c4f [0,1,0,1,0,0|2,0,0]=4 19156 B13R2.423 CC(C)N1CC1c2ccccc2 18f4891ac6aabb6616be1fee9081b7fc [0,1,0,1,0,0|2,0,0]=4 19157 B13R2.423 CC(C)N1C[C@@H]1c2ccccc2 3bf2363aada52a88447fe37132928179 [0,1,0,1,0,0|2,0,0]=4 19158 B13R2.5881 CC(C)OC1Cc2c1cccc2 0e53db9fba641338134d98c1f8ac06b0 [0,1,0,1,0,0|2,0,0]=4 19159 B13R2.9 CCN1CCc2c1cccc2C f190ad333a57056d2e092c4876daef1d [0,1,0,1,0,0|2,0,0]=4 19160 B13R2.9 CCN1CCc2c1cccc2Cl f94e3ac09d0f798a8b2035512bfe8d49 [0,1,0,1,0,0|2,0,0]=4 19161 B13R2.9 CCN1CCc2c1cccc2I 55a98b5d366dd59b026b25ecc1329289 [0,1,0,1,0,0|2,0,0]=4 19162 B13R2.377 CC1CC1Nc2cccc[n+]2[O-] 291284cbcce01531f5a3fc284fac57c2 [0,1,0,1,0,0|1,0,1]=4 19163 B13R2.377 CC1CC1Nc2ccccc2F 73fe8236b6c238cddff5b223a645ea98 [0,1,0,1,0,0|2,0,0]=4 19164 B13R2.377 CC1CC1Nc2ncc[nH]c2=O 877767e71881531de48472117b06852f [0,1,0,1,0,0|2,0,0]=4 19165 B13R2.377 Cc1ccccc1NC2CC2C 09d878ade43953c226f1d280cce62851 [0,1,0,1,0,0|2,0,0]=4 19166 B13R2.377 Cc1cccnc1N[C@@H]2C[C@H]2F 8324aaa4cbed528384592692e330069f [0,1,0,1,0,0|2,0,0]=4 19167 B13R2.377 Cc1cccnc1N[C@H]2C[C@@H]2F c19d1d1bdb41f8bc4ed7a23555d03dfa [0,1,0,1,0,0|2,0,0]=4 19168 B13R2.377 Cc1cccnc1N[C@H]2C[C@H]2F 44b7d217a7575cb610b2aa4795669987 [0,1,0,1,0,0|2,0,0]=4 19169 B13R2.3587 Brc1ccccc1CNC2CC2 554145834f7a81c85b56501a7eb86320 [0,1,0,1,0,0|2,0,0]=4 19170 B13R2.3587 Brc1ccccc1COC2CC2 0387ea74140a9d22c20e4f9dca461182 [0,1,0,1,0,0|2,0,0]=4 19171 B13R2.3587 Brc1ccccc1NCC2CC2 ecb17ebf203318ba53e91af9dcc7ef88 [0,1,0,1,0,0|2,0,0]=4 19172 B13R2.3587 Brc1cccnc1CNC2CC2 ef759e5ed77fc589cab2dbe1999590bc [0,1,0,1,0,0|1,0,0]=3 19173 B13R2.3587 Brc1cccnc1COC2CC2 cfad3a443c706e5313cb9059e877f901 [0,1,0,1,0,0|1,0,0]=3 19174 B13R2.3587 Brc1cccnc1NCC2CC2 c5edf65a8dad9d1524af4aa1f9c269c6 [0,1,0,1,0,0|1,0,0]=3 19175 B13R2.3587 Brc1cccnc1OCC2CC2 01e3aadf188ab6816d236146f96147a2 [0,1,0,1,0,0|1,0,0]=3 19176 B13R2.3587 Brc1cncnc1NCC2CC2 4cf535e2507738e6680e7af2045de6f6 [0,1,0,1,0,0|2,0,0]=4 19177 B13R2.3587 Brc1nccnc1NCC2CC2 e2ebce6c51addcc8129b7c53f8b9b75b [0,1,0,1,0,0|2,0,0]=4 19178 B13R2.3587 Brc1nccnc1OCC2CC2 10767786e401ffa0043e5d279b4c737c [0,1,0,1,0,0|2,0,0]=4 19179 B13R2.3587 Cc1ccccc1CNC2CC2 7b95b24612f598dbbbe7812e5b56b73c [0,1,0,1,0,0|2,0,0]=4 19180 B13R2.3587 Cc1ccccc1COC2CC2 c0635c73960ab228d156a3263d1f8ea4 [0,1,0,1,0,0|2,0,0]=4 19181 B13R2.3587 Cc1ccccc1NCC2CC2 bdc18272f333d69bdc5d279ff77269b8 [0,1,0,1,0,0|2,0,0]=4 19182 B13R2.3587 Cc1ccccc1OCC2CC2 f7fb48d76041b094b0e7eb2ba96d06ab [0,1,0,1,0,0|2,0,0]=4 19183 B13R2.3587 Cc1cccnc1CNC2CC2 b78be1e51f611dc4c08af95dcb90dad6 [0,1,0,1,0,0|1,0,0]=3 19184 B13R2.3587 Cc1cccnc1COC2CC2 086ee720977f0f15e103f10e4b92abfd [0,1,0,1,0,0|1,0,0]=3 19185 B13R2.3587 Cc1cccnc1NCC2CC2 c6500181e004ecc6ddba9372cb01deb7 [0,1,0,1,0,0|1,0,0]=3 19186 B13R2.3587 Cc1cccnc1OCC2CC2 b18c291430b38b8d93f8d648d89f0f94 [0,1,0,1,0,0|1,0,0]=3 19187 B13R2.3587 Cc1ccnnc1COC2CC2 73e037f879c0c832c12eea2a8e5ee577 [0,1,0,1,0,0|2,0,0]=4 19188 B13R2.3587 Cc1ccnnc1NCC2CC2 d95ce4aca733bf8e5d504094d36c951e [0,1,0,1,0,0|2,0,0]=4 19189 B13R2.3587 Cc1ccnnc1OCC2CC2 e1d4333444c42702ca48b8cb9b7d5527 [0,1,0,1,0,0|2,0,0]=4 19190 B13R2.3587 Cc1cncnc1NCC2CC2 478882ef1ed97fb7ac3c295587c567e0 [0,1,0,1,0,0|2,0,0]=4 19191 B13R2.3587 Cc1cncnc1OCC2CC2 694c52b7372dac121f5589a25e895213 [0,1,0,1,0,0|2,0,0]=4 19192 B13R2.3587 Cc1nccnc1CNC2CC2 089ecc77c921bd6193539bef1acb5484 [0,1,0,1,0,0|2,0,0]=4 19193 B13R2.3587 Cc1nccnc1COC2CC2 dcfc4f8708a9d0427cc6c17e41324b25 [0,1,0,1,0,0|2,0,0]=4 19194 B13R2.3587 Cc1nccnc1NCC2CC2 26421115228425c3609db5d0125817c3 [0,1,0,1,0,0|2,0,0]=4 19195 B13R2.3587 Cc1nccnc1OCC2CC2 229be17322eb37a4fac4ea9193ce002c [0,1,0,1,0,0|2,0,0]=4 19196 B13R2.3587 Clc1ccccc1CNC2CC2 8f5542ae83e7ce26b653a9ccd8d8cf09 [0,1,0,1,0,0|2,0,0]=4 19197 B13R2.3587 Clc1ccccc1COC2CC2 f7c8a318444098ea95c6220db9287ad3 [0,1,0,1,0,0|2,0,0]=4 19198 B13R2.3587 Clc1ccccc1NCC2CC2 f9e23dd65e3a2a2ca7b9ccedfe334e06 [0,1,0,1,0,0|2,0,0]=4 19199 B13R2.3587 Clc1ccccc1OCC2CC2 f008a379ebd6c64cd3ce8bd8a71b6d82 [0,1,0,1,0,0|2,0,0]=4 19200 B13R2.3587 Clc1cccnc1CNC2CC2 8919c5510e263efaa1d3f0281cd10910 [0,1,0,1,0,0|1,0,0]=3 19201 B13R2.3587 Clc1cccnc1COC2CC2 c27592a200a68da9db2d2a7b654bc4e1 [0,1,0,1,0,0|1,0,0]=3 19202 B13R2.3587 Clc1cccnc1NCC2CC2 42d1c02ce104ad06d85cb6ef4d485656 [0,1,0,1,0,0|1,0,0]=3 19203 B13R2.3587 Clc1cccnc1OCC2CC2 18fea35e2a8c5fd3baf04339cc59f2cb [0,1,0,1,0,0|1,0,0]=3 19204 B13R2.3587 Clc1ccnnc1OCC2CC2 4ac118798b7b30d3e2526113dbbbfcee [0,1,0,1,0,0|2,0,0]=4 19205 B13R2.3587 Clc1cncnc1NCC2CC2 f4be1581cef07a9141564994cdb04a03 [0,1,0,1,0,0|2,0,0]=4 19206 B13R2.3587 Clc1cncnc1OCC2CC2 0dce29fa13a1bc9ba0bc093074057cb2 [0,1,0,1,0,0|2,0,0]=4 19207 B13R2.3587 Clc1nccnc1CNC2CC2 f6be9e6acdaba24fed872ab5336d97ce [0,1,0,1,0,0|2,0,0]=4 19208 B13R2.3587 Clc1nccnc1COC2CC2 b53551d1e912381ab4791fae5086d197 [0,1,0,1,0,0|2,0,0]=4 19209 B13R2.3587 Clc1nccnc1NCC2CC2 a07f13f20a01a8449283d5c4bd288c8b [0,1,0,1,0,0|2,0,0]=4 19210 B13R2.3587 Fc1ccccc1CNC2CC2 013b947027bb3aa99b42dcd9f53e4cfc [0,1,0,1,0,0|2,0,0]=4 19211 B13R2.3587 Fc1ccccc1COC2CC2 623ae5e807d4a554f8a08c72462367de [0,1,0,1,0,0|2,0,0]=4 19212 B13R2.3587 Fc1ccccc1NCC2CC2 643532b2890cba9b6d4e86c3f98190ce [0,1,0,1,0,0|2,0,0]=4 19213 B13R2.3587 Fc1ccccc1OCC2CC2 45110cbc3d1b584dac4a53a114ab04ef [0,1,0,1,0,0|2,0,0]=4 19214 B13R2.3587 Fc1cccnc1CNC2CC2 fa2e316de5a54eab3e049c581c66cd4c [0,1,0,1,0,0|1,0,0]=3 19215 B13R2.3587 Fc1cccnc1COC2CC2 5af0d927d10902ccc6cd4c21aeecd096 [0,1,0,1,0,0|1,0,0]=3 19216 B13R2.3587 Fc1cccnc1NCC2CC2 9eb0e46322e5bf48f6457087691c98af [0,1,0,1,0,0|1,0,0]=3 19217 B13R2.3587 Fc1cccnc1OCC2CC2 76c49e5af6251630ea40039b96a1814f [0,1,0,1,0,0|1,0,0]=3 19218 B13R2.3587 Fc1cncnc1NCC2CC2 6d4c26b6e8dcbc6cbc35323bffa8f2ac [0,1,0,1,0,0|2,0,0]=4 19219 B13R2.3587 Fc1cncnc1OCC2CC2 2b4aee3fa7b7838b080db1e0bb3d8566 [0,1,0,1,0,0|2,0,0]=4 19220 B13R2.3587 Fc1nccnc1NCC2CC2 8a08f95a4a7aea6836e52c26e6a85aef [0,1,0,1,0,0|2,0,0]=4 19221 B13R2.3587 Ic1ccccc1CNC2CC2 9340be8fffcc4111928db2f1a218a071 [0,1,0,1,0,0|2,0,0]=4 19222 B13R2.3587 Ic1ccccc1COC2CC2 d9e8b774d69add1a3c4f45fe8a9b7d23 [0,1,0,1,0,0|2,0,0]=4 19223 B13R2.3587 Ic1ccccc1NCC2CC2 894e01de872d724c75db94186bbc5376 [0,1,0,1,0,0|2,0,0]=4 19224 B13R2.3587 Ic1ccccc1OCC2CC2 f1115151a36d11b9dab732ac8ea67030 [0,1,0,1,0,0|2,0,0]=4 19225 B13R2.3587 Ic1cccnc1NCC2CC2 77b7e99306799cb394b8d6d9356a871e [0,1,0,1,0,0|1,0,0]=3 19226 B13R2.3587 Ic1ccnnc1OCC2CC2 6616efeebc8d34f2183668801efc57db [0,1,0,1,0,0|2,0,0]=4 19227 B13R2.3587 Ic1cncnc1NCC2CC2 db75860c9b975928e0ede92b47306a84 [0,1,0,1,0,0|2,0,0]=4 19228 B13R2.3587 Ic1cncnc1OCC2CC2 b05d8c475327dee63d56fe9abeb9adbb [0,1,0,1,0,0|2,0,0]=4 19229 B13R2.3587 Ic1nccnc1NCC2CC2 e9a7eb01df18b0009f9a4b9295b2c4e5 [0,1,0,1,0,0|2,0,0]=4 19230 B13R2.3587 O=c1[nH]ccnc1NCC2CC2 7945fd507a34a69d3b8ebe9f39501f9e [0,1,0,1,0,0|2,0,0]=4 19231 B13R2.3587 Oc1cccnc1NCC2CC2 7cdf260dc498e03aeafb6d27b22f5fa4 [0,1,0,1,0,0|1,0,0]=3 19232 B13R2.3587 Sc1ccccc1COC2CC2 f6a966f47a0a2cb2f68e501756943b90 [0,1,0,1,0,0|2,0,0]=4 19233 B13R2.3587 Sc1ccccc1NCC2CC2 accf74b6d163dee196dbd4a206a08554 [0,1,0,1,0,0|2,0,0]=4 19234 B13R2.3587 [O-][n+]1ccccc1CNC2CC2 9b6113c81f77fbe3fe402795c1c90572 [0,1,0,1,0,0|1,0,1]=4 19235 B13R2.3587 [O-][n+]1ccccc1COC2CC2 270dc4b1c36809ba7c28995e4a94e0a0 [0,1,0,1,0,0|1,0,1]=4 19236 B13R2.3587 [O-][n+]1ccccc1NCC2CC2 36acc650edfa81a267089ee1fc887b24 [0,1,0,1,0,0|1,0,1]=4 19237 B13R2.3587 [O-][n+]1ccccc1OCC2CC2 d88b29661b603163662513e4847e4d5e [0,1,0,1,0,0|1,0,1]=4 19238 B13R2.5225 Brc1ccccc1CN2CCC2 a7e1183b021eb5bb09346e90fcf0906d [0,1,0,1,0,0|2,0,0]=4 19239 B13R2.5225 Brc1cccnc1CN2CCC2 8ce93a7f7fad4f6a0d69cb9e43c51561 [0,1,0,1,0,0|1,0,0]=3 19240 B13R2.5225 Brc1nccnc1OC2CCC2 d98c99d87f750761be6e9b3cf4ca783b [0,1,0,1,0,0|2,0,0]=4 19241 B13R2.5225 Cc1ccccc1CN2CCC2 f9d862a78192206449640cf36a242fd3 [0,1,0,1,0,0|2,0,0]=4 19242 B13R2.5225 Cc1cccnc1CN2CCC2 cc823414c67ea6c8b9a63dda80a41925 [0,1,0,1,0,0|1,0,0]=3 19243 B13R2.5225 Cc1cccnc1NC2CCC2 741b541dc789ea5746fe7e7bd90af98e [0,1,0,1,0,0|1,0,0]=3 19244 B13R2.5225 Cc1cccnc1OC2CCC2 a2490413478d7eabba9880165aeec032 [0,1,0,1,0,0|1,0,0]=3 19245 B13R2.5225 Cc1ccnnc1OC2CCC2 c3676386bb3361d92cad5510740c29bc [0,1,0,1,0,0|2,0,0]=4 19246 B13R2.5225 Cc1nccnc1CN2CCC2 9595fcf506120fd804f1915d027797aa [0,1,0,1,0,0|2,0,0]=4 19247 B13R2.5225 Cc1nccnc1NC2CCC2 14b0036d71a494403b81e4f5b0f7dfbe [0,1,0,1,0,0|2,0,0]=4 19248 B13R2.5225 Cc1nccnc1OC2CCC2 09faeb9bc9df90d56c0a73d34f1f78f0 [0,1,0,1,0,0|2,0,0]=4 19249 B13R2.5225 Clc1ccccc1CN2CCC2 ceb7dccd3c36f9f640f258008bcb86d0 [0,1,0,1,0,0|2,0,0]=4 19250 B13R2.5225 Clc1ccccc1OC2CCC2 f61c8ee9cc610129b06abc9d3121ccf8 [0,1,0,1,0,0|2,0,0]=4 19251 B13R2.5225 Clc1cccnc1CN2CCC2 17d4d8f6a087906ea90031ac106c2477 [0,1,0,1,0,0|1,0,0]=3 19252 B13R2.5225 Clc1cccnc1OC2CCC2 7eeb310235e005f970dca573fb5235b9 [0,1,0,1,0,0|1,0,0]=3 19253 B13R2.5225 Clc1ccnnc1OC2CCC2 57055788b9770eb4adc395f56e5b86f6 [0,1,0,1,0,0|2,0,0]=4 19254 B13R2.5225 Clc1nccnc1CN2CCC2 5a16346568dcbf40c970e71d150d0922 [0,1,0,1,0,0|2,0,0]=4 19255 B13R2.5225 Fc1ccccc1CN2CCC2 d60b0655de93a5f4a0e0147f723e490f [0,1,0,1,0,0|2,0,0]=4 19256 B13R2.5225 Fc1cccnc1CN2CCC2 71ce3d29f6b5317c31f0c7cc4405226b [0,1,0,1,0,0|1,0,0]=3 19257 B13R2.5225 Fc1cccnc1NC2CCC2 57f367a07539bd6248222c4ed6574647 [0,1,0,1,0,0|1,0,0]=3 19258 B13R2.5225 Fc1cccnc1OC2CCC2 98ed30fba5531f5750deed4ede4bb711 [0,1,0,1,0,0|1,0,0]=3 19259 B13R2.5225 Ic1ccccc1CN2CCC2 4f2e106b4c99b9fc7193c37ce6f838e0 [0,1,0,1,0,0|2,0,0]=4 19260 B13R2.5225 Ic1ccccc1NC2CCC2 6a94d873022230cd3d26b7d9792c6142 [0,1,0,1,0,0|2,0,0]=4 19261 B13R2.5225 Ic1cccnc1NC2CCC2 6a77716edb5ee4ee5da4484d9a355bd4 [0,1,0,1,0,0|1,0,0]=3 19262 B13R2.5225 Ic1cccnc1NC2COC2 6f6360f6c7100707dc689a2651bc51ad [0,1,0,1,0,0|2,0,0]=4 19263 B13R2.5225 Ic1ccnnc1OC2CCC2 7b5809a6e1e7fe3c607721cab2e0b19d [0,1,0,1,0,0|2,0,0]=4 19264 B13R2.5225 Ic1nccnc1NC2CCC2 785d10f2bb1f958cd81fd882d6ee107d [0,1,0,1,0,0|2,0,0]=4 19265 B13R2.5225 [O-][n+]1ccccc1CN2CCC2 81094585fdde90c9a018e1f9d6bd78be [0,1,0,1,0,0|1,0,1]=4 19266 B13R2.5225 [O-][n+]1ccccc1NC2CCC2 6db1c1642304fbb136fe3a0f52bb4711 [0,1,0,1,0,0|1,0,1]=4 19267 B9R1.12 CCCNc1c[nH]cn1 6b63b2271006eeda903e175a88c0546a [1,0,0,0,1,0|2,0,0]=4 19268 B9R1.12 CCCNc1cc[nH]n1 970996a901dc2871e25e1b3f58bb1ae9 [1,0,0,0,1,0|2,0,0]=4 19269 B9R1.12 CCCNc1cccs1 dddbeb0cebfad93e2ee450a927f1f846 [1,0,0,0,1,0|2,0,0]=4 19270 B9R1.12 CCCNc1ccoc1 cc4f6f51569c182aca4da58e5f019c78 [1,0,0,0,1,0|2,0,0]=4 19271 B9R1.12 CCCNc1ccon1 67d2486210e5c6b1db57939f48d96b10 [1,0,0,0,1,0|2,0,0]=4 19272 B9R1.12 CCCNc1ccsc1 a70237f11ed81d43b5ff787e5b6c83f9 [1,0,0,0,1,0|2,0,0]=4 19273 B9R1.12 CCCNc1cocn1 ba2d440733fea026f6967dab40049325 [1,0,0,0,1,0|2,0,0]=4 19274 B9R1.12 CCCNc1cscn1 fae4b904f23fb93e2e56928f5d9cc6d4 [1,0,0,0,1,0|2,0,0]=4 19275 B9R1.12 CCCNc1ncc[nH]1 8f0b11e739cdbcc3c6e78e115ed494fe [1,0,0,0,1,0|2,0,0]=4 19276 B9R1.12 CCCNc1ncco1 d0c0e653694791440ac2f0d78edc0e34 [1,0,0,0,1,0|2,0,0]=4 19277 B9R1.12 CCCNc1nccs1 26bd7c90c10f9395c78eb9fc2d80649e [1,0,0,0,1,0|2,0,0]=4 19278 B9R1.12 CCCOc1c[nH]cn1 45a2af4246e68dfa1ee3afde5dc82ddf [1,0,0,0,1,0|2,0,0]=4 19279 B9R1.12 CCCOc1ccco1 892ad9a1c4eda1b2e579e57ab16386c6 [1,0,0,0,1,0|2,0,0]=4 19280 B9R1.12 CCCOc1cccs1 08634ab81341ae1b1178430949f9ac0f [1,0,0,0,1,0|2,0,0]=4 19281 B9R1.12 CCCOc1ccsc1 09284982954b71ce4e3ef57411744ecc [1,0,0,0,1,0|2,0,0]=4 19282 B9R1.12 CCCOc1nccs1 5f60e0b45753d03ef3faa171be938859 [1,0,0,0,1,0|2,0,0]=4 19283 B9R1.12 CCCOn1cccn1 2e48792a1b51d3b1159f5dd703032bb5 [1,0,0,0,1,0|2,0,0]=4 19284 B9R1.12 CCNCc1cc[nH]c1 5f34bb16d580f8126d210a7f1c922122 [1,0,0,0,1,0|2,0,0]=4 19285 B9R1.12 CCNCc1ccc[nH]1 d148947c496d04ba3fda3d28b4738aad [1,0,0,0,1,0|1,0,1]=4 19286 B9R1.12 CCNCc1ccco1 4817cc97570de733e3d59f88500c3b37 [1,0,0,0,1,0|2,0,0]=4 19287 B9R1.12 CCNCc1cccs1 4bb993aa1ef7b62c5d2b7781bf586f7d [1,0,0,0,1,0|2,0,0]=4 19288 B9R1.12 CCNCc1ccoc1 790b339bd93664fda272fb5f895d2be9 [1,0,0,0,1,0|2,0,0]=4 19289 B9R1.12 CCNCc1ccon1 76008202c967d53995dbdd46c4b0b05b [1,0,0,0,1,0|2,0,0]=4 19290 B9R1.12 CCNCc1ccsc1 8d2a00279cff0e97c4d4139ed8f7ead4 [1,0,0,0,1,0|2,0,0]=4 19291 B9R1.12 CCNCc1ccsn1 c640c32a57f58f85269acc4cf13e08dd [1,0,0,0,1,0|2,0,0]=4 19292 B9R1.12 CCNCc1cocn1 ee5152002bd65a9d43431c8076f0a4d3 [1,0,0,0,1,0|2,0,0]=4 19293 B9R1.12 CCNCc1cscn1 6ac8fdacb085e4e7af5e2a744e0781a5 [1,0,0,0,1,0|2,0,0]=4 19294 B9R1.12 CCNCc1ncc[nH]1 80bb75fd4db514b30cbb9decd5220667 [1,0,0,0,1,0|2,0,0]=4 19295 B9R1.12 CCNCc1ncco1 d59ea2eedd26cb1a330141171d90cbfb [1,0,0,0,1,0|2,0,0]=4 19296 B9R1.12 CCNCc1nccs1 526a03e98732df2789dd97318edaafd6 [1,0,0,0,1,0|2,0,0]=4 19297 B9R1.12 CCOCc1cc[nH]c1 59d617c736c503e8fe59f893e6c21bac [1,0,0,0,1,0|2,0,0]=4 19298 B9R1.12 CCOCc1ccc[nH]1 0b5c52ca398d6e6823ab9d1f4fb92621 [1,0,0,0,1,0|1,0,1]=4 19299 B9R1.12 CCOCc1ccco1 e774f039f2ee21ec2e9d047bdeb979aa [1,0,0,0,1,0|2,0,0]=4 19300 B9R1.12 CCOCc1cccs1 8766881c6db57c6784fc6c93385667d4 [1,0,0,0,1,0|2,0,0]=4 19301 B9R1.12 CCOCc1ccon1 c3dd8303abc344854e3a20eb862deac2 [1,0,0,0,1,0|2,0,0]=4 19302 B9R1.12 CCOCc1ccsc1 386d4e7246ff291707b3e218c5edbe51 [1,0,0,0,1,0|2,0,0]=4 19303 B9R1.12 CCOCc1ccsn1 85325b8df299b4348765c5ae4f3bbc2a [1,0,0,0,1,0|2,0,0]=4 19304 B9R1.12 CCOCc1cocn1 8d5c6b8af6fe755487d9214435b13700 [1,0,0,0,1,0|2,0,0]=4 19305 B9R1.12 CCOCc1cscn1 77c64af51f4fa6cafcbef73604cf106e [1,0,0,0,1,0|2,0,0]=4 19306 B9R1.12 CCOCc1ncc[nH]1 cf0678147462fc427b9541c5f3d75f6c [1,0,0,0,1,0|2,0,0]=4 19307 B9R1.12 CCOCc1ncco1 7b912d50833e4919d9e0630ebdd06bd0 [1,0,0,0,1,0|2,0,0]=4 19308 B9R1.12 CCOCc1nccs1 42a4ef0c68f9f4ccf7685ffa2d58e68a [1,0,0,0,1,0|2,0,0]=4 19309 B9R1.12 CCOCn1cccn1 75e33447e70b4a19050f65c31ed6077f [1,0,0,0,1,0|2,0,0]=4