0 B11R1.41 C#Cc1ccccc1NC=O 3cc909c7c9e0ea24cc63334d2915102a [0,1,0,0,0,0|1,0,1]=3 1 B11R1.41 C#Cc1ccccc1NCC 2236a7c903f88e7f994483811b77ca06 [0,1,0,0,0,0|2,0,1]=4 2 B11R1.41 C#Cc1ccccc1NCF f9e2ed1681a3a7971242d930f8d4010a [0,1,0,0,0,0|2,0,1]=4 3 B11R1.41 C#Cc1ccccc1NCO 532d489a589d820655ff93e6d3923ee7 [0,1,0,0,0,0|2,0,1]=4 4 B11R1.41 C#Cc1ccccc1OCC e55ca83db98c6cd8c92017813d1dcdf9 [0,1,0,0,0,0|1,0,1]=3 5 B11R1.41 C#Cc1ccccc1OCF fcceee65d25afeec83b3f1dec1e37343 [0,1,0,0,0,0|1,0,1]=3 6 B11R1.41 C#Cc1cccnc1NC=O f9f0435cbb2442e708d21cc8fefbab07 [0,1,0,0,0,0|2,0,1]=4 7 B11R1.41 C#Cc1cccnc1OCC ceba8b1560054ce48c3418f144612606 [0,1,0,0,0,0|2,0,1]=4 8 B11R1.41 C#Cc1cccnc1OCF 570c58c4d137f4ba0932385d69b94c09 [0,1,0,0,0,0|2,0,1]=4 9 B11R1.41 C#Cc1ccncc1NC=O fcf4d5d5e66e3a099035e3806566d6b8 [0,1,0,0,0,0|2,0,1]=4 10 B11R1.41 C#Cc1cnccc1NC=O 6b3179307dc744ab3578d96a8d55b532 [0,1,0,0,0,0|2,0,1]=4 11 B11R1.41 C=Cc1ccccc1NC=O 318fa617b79be5fa4723a8d8c79b7c87 [0,1,0,0,0,0|1,0,1]=3 12 B11R1.41 C=Cc1ccccc1NCC ec194b268fe8e15778f10ea46223acd3 [0,1,0,0,0,0|2,0,0]=3 13 B11R1.41 C=Cc1ccccc1NCF e1d772a81a28d52162abcfc9b546d2db [0,1,0,0,0,0|2,0,0]=3 14 B11R1.41 C=Cc1ccccc1NCO 17fc793b737ab84db871f1fe7f91f62d [0,1,0,0,0,0|2,0,0]=3 15 B11R1.41 C=Cc1ccccc1OCC dd5acf9fe1868c85263d9d9b388077e8 [0,1,0,0,0,0|1,0,0]=2 16 B11R1.41 C=Cc1ccccc1OCF 3a83b1e091c8fcb96ef72b4b0e164b48 [0,1,0,0,0,0|1,0,0]=2 17 B11R1.41 C=Cc1ncccc1NC=O f06ac0d926f03852ca9c2a478204d4b9 [0,1,0,0,0,0|2,0,1]=4 18 B11R1.41 C=Cc1ncccc1NCC ca681695476fa9b7a0657e26bc0893a3 [0,1,0,0,0,0|3,0,0]=4 19 B11R1.41 C=Cc1ncccc1NCF 5d1af1cd7235cfa5ce70b6ebe651fea3 [0,1,0,0,0,0|3,0,0]=4 20 B11R1.41 C=Cc1ncccc1NCO 39c3e0d7296da6328190bca745d58d63 [0,1,0,0,0,0|3,0,0]=4 21 B11R1.41 CCNc1ccccc1C#N fc77f06323de57cc4085d4e74e9650e1 [0,1,0,0,0,0|2,0,1]=4 22 B11R1.41 CCNc1ccccc1C=O e407661523fe9d010b54d3988947bb3c [0,1,0,0,0,0|1,0,0]=2 23 B11R1.41 CCNc1ccccc1CBr 1a25fd2ca550267ae33acf2354d0c157 [0,1,0,0,0,0|2,0,1]=4 24 B11R1.41 CCNc1ccccc1CO 4035540dd97cd74f8c59f14dfc02b508 [0,1,0,0,0,0|1,0,2]=4 25 B11R1.41 CCNc1ccccc1CS 857fe074d2067c39dab459d2d66017dd [0,1,0,0,0,0|1,1,1]=4 26 B11R1.41 CCNc1ccccc1OC 8c89fe15ce85f76394fb1aa757740a1c [0,1,0,0,0,0|1,0,1]=3 27 B11R1.41 CCNc1ccccc1SC 8301e9206b5b8b6e1c109b1aba8950e7 [0,1,0,0,0,0|1,1,1]=4 28 B11R1.41 CCNc1cccnc1C=O 8d4bc9194d31c64022b57aa4d071af2d [0,1,0,0,0,0|2,0,0]=3 29 B11R1.41 CCNc1cccnc1OC 6c16951aa28eb8640f69e778236dcc64 [0,1,0,0,0,0|2,0,1]=4 30 B11R1.41 CCNc1ccncc1C=O 9f6ff7b8b70df1c06d12a1b90e5b1bb5 [0,1,0,0,0,0|2,0,0]=3 31 B11R1.41 CCNc1ccncc1OC 3313bc5c228c9c40165220fe938e863a [0,1,0,0,0,0|2,0,1]=4 32 B11R1.41 CCNc1cnccc1C=O 6746ceea4d47995b69b40f9ae8f3bb8c [0,1,0,0,0,0|2,0,0]=3 33 B11R1.41 CCNc1cnccc1OC 51fb80c50003e132548cb040425ab69f [0,1,0,0,0,0|2,0,1]=4 34 B11R1.41 CCNc1cncnc1C=O 617bc6aad46fd3404918762f4ae41abf [0,1,0,0,0,0|3,0,0]=4 35 B11R1.41 CCNc1ncccc1C=O 5a449483c403682224d71ac4f5832a05 [0,1,0,0,0,0|2,0,0]=3 36 B11R1.41 CCNc1ncccc1OC e11a6d486ebd6d3676b1c4bdb22a578b [0,1,0,0,0,0|2,0,1]=4 37 B11R1.41 CCNc1nccnc1C=O c7e35837c65b46e7218e074b67e54192 [0,1,0,0,0,0|3,0,0]=4 38 B11R1.41 CCNc1ncncc1C=O 7de5c8ce6c55f36df368b8fabeaf0d96 [0,1,0,0,0,0|3,0,0]=4 39 B11R1.41 CCOc1ccccc1C#N 274d7e9e696288e93f3c87c8056c1161 [0,1,0,0,0,0|1,0,1]=3 40 B11R1.41 CCOc1ccccc1C=O 3b9e1c80fdd444a8b433211ec89c2bc9 [0,1,0,0,0,0|0,0,0]=1 41 B11R1.41 CCOc1ccccc1CC c0cbeca9621d471e16db2adc053bd410 [0,1,0,0,0,0|1,0,1]=3 42 B11R1.41 CCOc1ccccc1OC 051be9d5b460756062ccc8d982b07057 [0,1,0,0,0,0|1,0,1]=3 43 B11R1.41 CCOc1ccccc1SC c24a0786968dd5cf74c95cd95ac55a28 [0,1,0,0,0,0|2,0,0]=3 44 B11R1.41 CCOc1cccnc1C#N 009b63be258069a5967a7fc273d45faf [0,1,0,0,0,0|2,0,1]=4 45 B11R1.41 CCOc1cccnc1C=O c2376d9c6a6d5f8b110bd9b2dd5a23ed [0,1,0,0,0,0|1,0,0]=2 46 B11R1.41 CCOc1cccnc1CC c989c2c26e1ed5cf83633d96ad9aa2bc [0,1,0,0,0,0|2,0,1]=4 47 B11R1.41 CCOc1cccnc1OC 7bbc4184d60a18d7ecb599265150ad82 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.41 CCOc1ccncc1C#N 207c4d8c14cc982d823a361f7198de87 [0,1,0,0,0,0|2,0,1]=4 49 B11R1.41 CCOc1ccncc1C=O 0fc0822fdc8ca058e513ffd7980cfcaa [0,1,0,0,0,0|1,0,0]=2 50 B11R1.41 CCOc1ccncc1OC a740279be40d0f31c3005b62af7bcf78 [0,1,0,0,0,0|2,0,1]=4 51 B11R1.41 CCOc1cnccc1C#N 70884ebb1fe4ef8eddac1e8b647cafa1 [0,1,0,0,0,0|2,0,1]=4 52 B11R1.41 CCOc1cnccc1C=O 8bb02853c9b6837327c068b1f2319320 [0,1,0,0,0,0|1,0,0]=2 53 B11R1.41 CCOc1cnccc1CC d45825b62adff4e1e492c0028e3db421 [0,1,0,0,0,0|2,0,1]=4 54 B11R1.41 CCOc1cnccc1OC 84ff5bf498b03126f70faf68ea6bbd6b [0,1,0,0,0,0|2,0,1]=4 55 B11R1.41 CCOc1ncccc1CC 36d68d57d658301e72d95866a9d02ecb [0,1,0,0,0,0|2,0,1]=4 56 B11R1.41 CCc1ccccc1NC#N 00fce41f872188325923eca6b6d5569f [0,1,0,0,0,0|2,0,1]=4 57 B11R1.41 CCc1ccccc1NC=O f5899686188b5c72f9d67644802900c5 [0,1,0,0,0,0|1,0,0]=2 58 B11R1.41 CCc1ccccc1OCF ce74522c0890c2ed5828036318cd1d2e [0,1,0,0,0,0|1,0,1]=3 59 B11R1.41 CCc1cccnc1NC=O baacbae494772eaee75a08d76aa1493d [0,1,0,0,0,0|2,0,0]=3 60 B11R1.41 CCc1cccnc1OCF 3eefab2b48a89bee2b2b93a0e9133bfc [0,1,0,0,0,0|2,0,1]=4 61 B11R1.41 CCc1ccncc1OCF 7fd00fa55f1155fde91d77c8ad4c264a [0,1,0,0,0,0|2,0,1]=4 62 B11R1.41 CCc1ncccc1NC=O e4a1bdcac4f3d8f0d050248a3ef929dc [0,1,0,0,0,0|2,0,0]=3 63 B11R1.41 CCc1ncccc1OCF f627c6330784b0d07ff7a1315ca5f79c [0,1,0,0,0,0|2,0,1]=4 64 B11R1.41 CCc1nccnc1NC=O 619ab142ddd8ffd8cc79e691509afd80 [0,1,0,0,0,0|3,0,0]=4 65 B11R1.41 CCc1ncncc1NC=O 4d820321008b8dfc86be5742f124441d [0,1,0,0,0,0|3,0,0]=4 66 B11R1.41 COc1ccccc1NC=O 5fc84704980d9dcf62fe3b3995a48842 [0,1,0,0,0,0|0,0,0]=1 67 B11R1.41 COc1cccnc1NC=O 1073bb2c85ac4f083b790bfe38269bcc [0,1,0,0,0,0|1,0,0]=2 68 B11R1.41 COc1cccnc1NCF 3a6e5ca8090104495fe461a606e395b5 [0,1,0,0,0,0|2,0,1]=4 69 B11R1.41 COc1cccnc1NCO e23e4c22743c8e0c967f498dec8a68f5 [0,1,0,0,0,0|1,0,2]=4 70 B11R1.41 COc1ccncc1NC=O 1075d96dc7fef24a106c7d7c0e4ea902 [0,1,0,0,0,0|1,0,0]=2 71 B11R1.41 COc1ccncc1NCF e8de67b5db7f5f4af8617a94eff2579e [0,1,0,0,0,0|2,0,1]=4 72 B11R1.41 COc1ccncc1NCO 798a72b6b7fa83a0fb97c38cefca14a9 [0,1,0,0,0,0|1,0,2]=4 73 B11R1.41 COc1ccncc1OCF 71258417d94d7ce1352dc35661b40606 [0,1,0,0,0,0|2,0,1]=4 74 B11R1.41 COc1cnccc1NC=O 617a9cb7630271e33ed34a3af74e4f7e [0,1,0,0,0,0|1,0,0]=2 75 B11R1.41 COc1cnccc1NCF 8240d559edefb11fc04f451b0712bcd5 [0,1,0,0,0,0|2,0,1]=4 76 B11R1.41 COc1cnccc1NCO ae2fd4619a5595053a51a322bfcb8cf1 [0,1,0,0,0,0|1,0,2]=4 77 B11R1.41 COc1cnccc1OCF 03d4dd27163e6ab951d391ca7d58223c [0,1,0,0,0,0|2,0,1]=4 78 B11R1.41 COc1cncnc1NC=O 87ed53f3a18a0ddbe5dede27afff8ecf [0,1,0,0,0,0|2,0,0]=3 79 B11R1.41 COc1ncccc1NC=O 45cc258c26141c552f0a2d949667fe9b [0,1,0,0,0,0|1,0,0]=2 80 B11R1.41 COc1ncccc1NCF a2fb2d52c35bfabb8a75ff60ad07d7c8 [0,1,0,0,0,0|2,0,1]=4 81 B11R1.41 COc1ncccc1NCO ef5fe630a16e11fd0b5a7f2f24f2ad4a [0,1,0,0,0,0|1,0,2]=4 82 B11R1.41 COc1ncccc1OCF d872d46a6c658a85d7985f2c8ad56695 [0,1,0,0,0,0|2,0,1]=4 83 B11R1.41 COc1nccnc1NC=O 7a05052076c50d6256b37a426b38925a [0,1,0,0,0,0|2,0,0]=3 84 B11R1.41 COc1nnccc1NC=O a992c4459a86c648c0b22e2279426a86 [0,1,0,0,0,0|2,0,0]=3 85 B11R1.41 CSc1ccccc1NC=O fa4e9943b11c2155ce9d6d52b976e411 [0,1,0,0,0,0|0,1,0]=2 86 B11R1.41 CSc1ccccc1NCO 5f4ee4b2deba125b7ab7cfc90f82e981 [0,1,0,0,0,0|0,1,2]=4 87 B11R1.41 CSc1ccccc1OCF a99f3dce74256724cedac33d64f72cf2 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.41 CSc1cccnc1NC=O c91ce8577500e233852ca41f6946409b [0,1,0,0,0,0|1,1,0]=3 89 B11R1.41 CSc1cnccc1NC=O a24d9460de290c2ba3cbe7dca095c9e2 [0,1,0,0,0,0|1,1,0]=3 90 B11R1.41 FCNc1ccccc1CBr 4006548ac3c711654d640f5c55cd3183 [0,1,0,0,0,0|2,0,1]=4 91 B11R1.41 FCNc1ccccc1CS b73220df9ea6b4d7b07042c4a9a9f29b [0,1,0,0,0,0|1,1,1]=4 92 B11R1.41 N#Cc1ccccc1NC=O 95aa3649ec9793627ca5a7291342d980 [0,1,0,0,0,0|2,0,0]=3 93 B11R1.41 N#Cc1ccccc1NCF fd5d70bd11025a7311c9cee82bdd92ee [0,1,0,0,0,0|2,0,1]=4 94 B11R1.41 N#Cc1ccccc1NCO ff29998289f408c82ae75577dd699535 [0,1,0,0,0,0|2,0,1]=4 95 B11R1.41 N#Cc1ccccc1OCF 1d1a3c01342a3619259e50f6f9e88bba [0,1,0,0,0,0|1,0,1]=3 96 B11R1.41 N#Cc1cccnc1NC=O f8bf9402ffb8775b8ada971702f4978e [0,1,0,0,0,0|3,0,0]=4 97 B11R1.41 N#Cc1ccncc1NC=O bca246ead1e61fdc433cc1799fc07c00 [0,1,0,0,0,0|3,0,0]=4 98 B11R1.41 N#Cc1ccncc1OCF 5144ca9b64bd9eaaac8a5d8f196dabf6 [0,1,0,0,0,0|2,0,1]=4 99 B11R1.41 N#Cc1cnccc1NC=O ca1bedeb575fe2f6259b4421d874b370 [0,1,0,0,0,0|3,0,0]=4 100 B11R1.41 N#Cc1cnccc1OCF 0dcd6ae202311d5191ed700612796686 [0,1,0,0,0,0|2,0,1]=4 101 B11R1.41 N#Cc1ncccc1NC=O c020eff9dbf1421c2ab7fba251742c93 [0,1,0,0,0,0|3,0,0]=4 102 B11R1.41 N#Cc1ncccc1OCF 5c0d45386783879bdd71064a2edc7bcf [0,1,0,0,0,0|2,0,1]=4 103 B11R1.41 O=CNc1ccccc1C=O 497f54404d9bc48b9253f4f69faf4a1b [0,1,0,0,0,0|1,0,1]=3 104 B11R1.41 O=CNc1ccccc1CBr 6b66b04122f1f90d5b0ad48ef5d07b7b [0,1,0,0,0,0|2,0,0]=3 105 B11R1.41 O=CNc1ccccc1CO bc6eb11e23bc211022f1c9b04c7ae372 [0,1,0,0,0,0|2,0,0]=3 106 B11R1.41 O=CNc1ccccc1CS df89ad1b8ca7782231dcd30623c96112 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.41 O=CNc1cccnc1C=O d80d7c19f5e5a0bb77f647c89c4352af [0,1,0,0,0,0|2,0,1]=4 108 B11R1.41 O=CNc1cccnc1CCl 668b91e42832828028122ce78c9851eb [0,1,0,0,0,0|3,0,0]=4 109 B11R1.41 O=CNc1cccnc1CO 9dbd7f6688e5cea477c7b7c616617b11 [0,1,0,0,0,0|3,0,0]=4 110 B11R1.41 O=CNc1ccncc1CO 2c0283e41b636611efc6d0c3ec102b9b [0,1,0,0,0,0|3,0,0]=4 111 B11R1.41 O=CNc1cnccc1C=O c67256f0f71abd6e591f2dd7746963ad [0,1,0,0,0,0|2,0,1]=4 112 B11R1.41 O=CNc1cnccc1CO 5d3bcd006493ffa7af142861bb81be1a [0,1,0,0,0,0|3,0,0]=4 113 B11R1.41 O=CNc1ncccc1C=O 3f8b6f7ab691d8c30ab5242fbd0866a2 [0,1,0,0,0,0|2,0,1]=4 114 B11R1.41 O=CNc1ncccc1CCl 1fd8fccf7acce7d77765a5e1d98cf4c2 [0,1,0,0,0,0|3,0,0]=4 115 B11R1.41 O=CNc1ncccc1CO 950587f3df5f0ba8842371d836934f37 [0,1,0,0,0,0|3,0,0]=4 116 B11R1.41 O=Cc1ccccc1NCF a8f5efab4eedfd991e9e6412c79c5362 [0,1,0,0,0,0|1,0,0]=2 117 B11R1.41 O=Cc1ccccc1NCO 96a55a358a7373757c7afe657f4d514b [0,1,0,0,0,0|1,0,0]=2 118 B11R1.41 O=Cc1ccccc1OCF b0d4c747cb20f2174afbd8b084bad836 [0,1,0,0,0,0|0,0,0]=1 119 B11R1.41 O=Cc1cccnc1NCF c14c285a72d31c42e591a37c6dc294d3 [0,1,0,0,0,0|2,0,0]=3 120 B11R1.41 O=Cc1cccnc1NCO cf4764e8819ee27927fc26e1e84e99eb [0,1,0,0,0,0|2,0,0]=3 121 B11R1.41 O=Cc1ccncc1NCF fe158de8771145c1920efe913bd8e31e [0,1,0,0,0,0|2,0,0]=3 122 B11R1.41 O=Cc1ccncc1NCO 92c362cf275f32f3edf1bfec0892594d [0,1,0,0,0,0|2,0,0]=3 123 B11R1.41 O=Cc1ccncc1OCF fd4470eb2ac6867ba9b195488e5bfa55 [0,1,0,0,0,0|1,0,0]=2 124 B11R1.41 O=Cc1cnccc1NCF 33ed4fc8fe70391da8657351e55a5434 [0,1,0,0,0,0|2,0,0]=3 125 B11R1.41 O=Cc1cnccc1NCO c301e5445ae4f8a92716bab9e79edc95 [0,1,0,0,0,0|2,0,0]=3 126 B11R1.41 O=Cc1cnccc1OCF 4128549c55db527b691ddf5d9d84bb90 [0,1,0,0,0,0|1,0,0]=2 127 B11R1.41 O=Cc1cncnc1NCF b684fe061a42a65cfdb463da7ef4f6f6 [0,1,0,0,0,0|3,0,0]=4 128 B11R1.41 O=Cc1cncnc1NCO 0793878105cef512fe92ec82d8925c54 [0,1,0,0,0,0|3,0,0]=4 129 B11R1.41 O=Cc1ncccc1NCF 8c4ceb281e116a8f25ed3723505bce44 [0,1,0,0,0,0|2,0,0]=3 130 B11R1.41 O=Cc1ncccc1NCO fe826122bfe08f1c3d5adfca5047a3c7 [0,1,0,0,0,0|2,0,0]=3 131 B11R1.41 O=Cc1ncccc1OCF 593934ec80a308fd8caf8ffd1502e696 [0,1,0,0,0,0|1,0,0]=2 132 B11R1.41 O=Cc1nccnc1NCF 36b9a2cd9262d926dc9b31e50fd02d28 [0,1,0,0,0,0|3,0,0]=4 133 B11R1.41 O=Cc1nccnc1NCO 881f3936ea92caecaed8b9b4d9aa3917 [0,1,0,0,0,0|3,0,0]=4 134 B11R1.41 O=Cc1ncncc1NCF 3971bd0ab6125f1b219bb0cd4fd155fe [0,1,0,0,0,0|3,0,0]=4 135 B11R1.41 O=Cc1ncncc1NCO 2ccea10564217ede153068b4787761e4 [0,1,0,0,0,0|3,0,0]=4 136 B11R1.41 OCNc1ccccc1CBr 3b24406b7371fa2881dc8ec2263c9bac [0,1,0,0,0,0|2,0,1]=4 137 B11R1.41 OCNc1ccccc1CO ab1fb8c66784baac30b9b8d46c6a4ddd [0,1,0,0,0,0|1,0,2]=4 138 B11R1.41 OCNc1ccccc1CS fcb5df5f042628a11c8ac2bf8098dfd2 [0,1,0,0,0,0|1,1,1]=4 139 B11R1.41 OCc1ccccc1NCF ba88ed3125b572a48590721d92404cd7 [0,1,0,0,0,0|1,0,2]=4 140 B10R1.4 CCNc1ccccc1Cl 2dfb513d252d373232906f5030075d40 [1,1,0,0,0,0|2,0,0]=4 141 B10R1.4 CCNc1ccccc1F 7ab2c72548cf5934972f59a05bcf3b98 [1,1,0,0,0,0|2,0,0]=4 142 B10R1.4 CCNc1ccccc1I a15e1e777d9cb3c3c67c713eae1f152f [1,1,0,0,0,0|2,0,0]=4 143 B10R1.4 CCOc1c[nH]cnc1=O 0d97be97c3076d07178cdd68cb6e2a14 [1,1,0,0,0,0|2,0,0]=4 144 B10R1.4 CCOc1ccc[nH]c1=S 8c21bc69d2dc6be5a606751c990f45b9 [1,1,0,0,0,0|1,1,0]=4 145 B10R1.4 CCOc1cccc[n+]1[O-] 5e2e6a3eb33be14884bc8c1831a174ad [1,1,0,0,0,0|1,0,1]=4 146 B10R1.4 CCOc1ccccc1C dc9ee1b6b8a241cf6f51757c9fedb385 [1,1,0,0,0,0|0,0,1]=3 147 B10R1.4 CCOc1ccccc1Cl 9b9ed61fe6629f2df6b1eaddc9ec2e8a [1,1,0,0,0,0|1,0,0]=3 148 B10R1.4 CCOc1ccccc1F 41f85306b1c4b7c4daecba5a00d66cce [1,1,0,0,0,0|1,0,0]=3 149 B10R1.4 CCOc1ccccc1I 3bfd90529c85539df6076f624de1f80d [1,1,0,0,0,0|1,0,0]=3 150 B10R1.4 CCOc1cccnc1Br 08b45b24e31de1110a9d86520664a434 [1,1,0,0,0,0|2,0,0]=4 151 B10R1.4 CCOc1cccnc1C 0260c4935677d055d800178e37d974b6 [1,1,0,0,0,0|1,0,1]=4 152 B10R1.4 CCOc1cccnc1Cl 684709ad9eeb4a1f4f9e4a19760d89be [1,1,0,0,0,0|2,0,0]=4 153 B10R1.4 CCOc1cccnc1F eb46cca158e1b62d818714a01a5af0f3 [1,1,0,0,0,0|2,0,0]=4 154 B10R1.4 CCOc1cccnc1I 792b0a09e935918385422ce79b947b91 [1,1,0,0,0,0|2,0,0]=4 155 B10R1.4 CCOc1cccoc1=O 7ff4b51ee01af505d2964258091f5c59 [1,1,0,0,0,0|1,0,0]=3 156 B10R1.4 CCOc1ccncc1Br 55a5d7eb5c6e1589c96bf824d7208a22 [1,1,0,0,0,0|2,0,0]=4 157 B10R1.4 CCOc1ccncc1C 20c8f7e703c3d3baef36021d316a4da0 [1,1,0,0,0,0|1,0,1]=4 158 B10R1.4 CCOc1ccncc1Cl 5e0f3ecd2dfdb5f220c2bf78ed519c55 [1,1,0,0,0,0|2,0,0]=4 159 B10R1.4 CCOc1ccncc1F eea1222228b0061fe90624479072235a [1,1,0,0,0,0|2,0,0]=4 160 B10R1.4 CCOc1cnccc1Br cc65e9d894dca176f1e04b368966ac9b [1,1,0,0,0,0|2,0,0]=4 161 B10R1.4 CCOc1cnccc1C 50b788e4b20e4d60835564cb398dcb8c [1,1,0,0,0,0|1,0,1]=4 162 B10R1.4 CCOc1cnccc1Cl 9252fbdc2aaa496a5df46d8e859e8bec [1,1,0,0,0,0|2,0,0]=4 163 B10R1.4 CCOc1cnccc1F 48497666769166ce90aacce840caeccc [1,1,0,0,0,0|2,0,0]=4 164 B10R1.4 CCOc1cnccc1I b3ec03f0e98ec8d0e34044a0a69fa976 [1,1,0,0,0,0|2,0,0]=4 165 B10R1.4 CCOc1coccc1=O f03228b8de8c0c009e2b1ec644801385 [1,1,0,0,0,0|1,0,0]=3 166 B10R1.4 CCOc1ncccc1Br f4383148a14f49cafea4eeb34cba2f7d [1,1,0,0,0,0|2,0,0]=4 167 B10R1.4 CCOc1ncccc1C e8543da7a575b70db65e7933cc01e850 [1,1,0,0,0,0|1,0,1]=4 168 B10R1.4 CCOc1ncccc1Cl 4590ed1a2376b9070dd9165912ca6275 [1,1,0,0,0,0|2,0,0]=4 169 B10R1.4 CCOc1ncccc1F a8635691cfd51eb96b174213d32b56ee [1,1,0,0,0,0|2,0,0]=4 170 B10R1.4 CCOn1ccccc1=N 066e010845a5f633ef5690a0c60b3ada [1,1,0,0,0,0|2,0,0]=4 171 B10R1.4 CCOn1ccccc1=O 0b23c2e0447fcd6e93837fb5b83fe2d6 [1,1,0,0,0,0|1,0,0]=3 172 B10R1.4 CCOn1ccccc1=S 3f6c47def882e136a1b020f7dbe062b5 [1,1,0,0,0,0|1,1,0]=4 173 B10R1.4 Cc1ccccc1NC#N 7e6eab3f5ed5e6af5d6b2d62b4dc9747 [1,1,0,0,0,0|1,0,1]=4 174 B10R1.4 Cc1ccccc1NC=O 93463d97863750f67f3c00d910f09802 [1,1,0,0,0,0|0,0,0]=2 175 B10R1.4 Cc1ccccc1OCF 8baad2379a58970c56de2a8d01203209 [1,1,0,0,0,0|0,0,1]=3 176 B10R1.4 Cc1cccnc1NC=O eddc5748a2e62b33a5566ebe9e562102 [1,1,0,0,0,0|1,0,0]=3 177 B10R1.4 Cc1cccnc1OCF 5dd471f10667f5296180df2f634c17da [1,1,0,0,0,0|1,0,1]=4 178 B10R1.4 Cc1ccncc1NC=O 480a397461cc81757979891789a47566 [1,1,0,0,0,0|1,0,0]=3 179 B10R1.4 Cc1ccncc1OCF 1f7b2e5a2ad6b56329c1c2b95551e972 [1,1,0,0,0,0|1,0,1]=4 180 B10R1.4 Cc1ccnnc1NC=O 7f3bbd3272e98b7e332e47e9021c45a0 [1,1,0,0,0,0|2,0,0]=4 181 B10R1.4 Cc1cnccc1NC=O 097b7c8f6102fdb97f5ed9ba0f37156f [1,1,0,0,0,0|1,0,0]=3 182 B10R1.4 Cc1cnccc1OCF ff08b5342b953cd9c073ac8ccce03fce [1,1,0,0,0,0|1,0,1]=4 183 B10R1.4 Cc1ncccc1NC=O 7a06f216539d990da9cb44ab6e9b0c87 [1,1,0,0,0,0|1,0,0]=3 184 B10R1.4 Cc1ncccc1OCF 5bc55fc04a01d4a91e7fbd84fd947089 [1,1,0,0,0,0|1,0,1]=4 185 B10R1.4 Cc1nccnc1NC=O 8a484b3cbf5462e9e715573d77acff31 [1,1,0,0,0,0|2,0,0]=4 186 B10R1.4 Cc1ncncc1NC=O e208c53ff6ae6786cc4686d2d6167722 [1,1,0,0,0,0|2,0,0]=4 187 B10R1.4 Cc1nnccc1NC=O 343696ed1d5858faa36f4c0c6c5c96ab [1,1,0,0,0,0|2,0,0]=4 188 B10R1.4 FCNc1ccccc1Cl d9b123aca09542405b035cbfc7a3c90b [1,1,0,0,0,0|2,0,0]=4 189 B10R1.4 FCNc1ccccc1F 0a7d0fadca34184ec755df42efe17064 [1,1,0,0,0,0|2,0,0]=4 190 B10R1.4 FCNc1ccccc1I 5959339ca8fbd24d83e04ddfbe0e0157 [1,1,0,0,0,0|2,0,0]=4 191 B10R1.4 FCNc1ccccc1S d634255285ab47bb94c2bca0b3757d2a [1,1,0,0,0,0|1,1,0]=4 192 B10R1.4 FCOc1ccc[nH]c1=S b35cb1849865ef4be46e1b9c607a01c3 [1,1,0,0,0,0|1,1,0]=4 193 B10R1.4 FCOc1ccccc1Cl a5299ee9d2e64e316b2aa5d3a27153e6 [1,1,0,0,0,0|1,0,0]=3 194 B10R1.4 FCOc1ccccc1F 5806cc0111f0c8f01c1e2cf9018d81c2 [1,1,0,0,0,0|1,0,0]=3 195 B10R1.4 FCOc1ccccc1I decd9faac1634980fd9c104b6a434168 [1,1,0,0,0,0|1,0,0]=3 196 B10R1.4 FCOc1cccnc1Br 61d12b0f266165b87123c22de77ab591 [1,1,0,0,0,0|2,0,0]=4 197 B10R1.4 FCOc1cccnc1Cl a634614515cfce5111bbed326e3d2843 [1,1,0,0,0,0|2,0,0]=4 198 B10R1.4 FCOc1cccnc1F b70e8d0c73b322628c78b1d6ffaf8db3 [1,1,0,0,0,0|2,0,0]=4 199 B10R1.4 FCOc1cccnc1I 600c68a945224bbca21cf419446c3ed1 [1,1,0,0,0,0|2,0,0]=4 200 B10R1.4 FCOc1ccncc1Br 88f2c2ee00293d52ce8667b7f38e242e [1,1,0,0,0,0|2,0,0]=4 201 B10R1.4 FCOc1ccncc1Cl a9babca3a3b0004bcf490c89494733df [1,1,0,0,0,0|2,0,0]=4 202 B10R1.4 FCOc1ccncc1F 1901331dbe91a7a074b09b7ce50cd2a0 [1,1,0,0,0,0|2,0,0]=4 203 B10R1.4 FCOc1cnccc1Br b6ddd33a623297ef528ef66f70dcf680 [1,1,0,0,0,0|2,0,0]=4 204 B10R1.4 FCOc1cnccc1Cl 46db4bc68b6ee4515bf7620379190fa7 [1,1,0,0,0,0|2,0,0]=4 205 B10R1.4 FCOc1cnccc1F 358182ca0e513d2c82bd54056ff120aa [1,1,0,0,0,0|2,0,0]=4 206 B10R1.4 FCOc1cnccc1I e5038112465ba0d6b7a6f8ae789a77ab [1,1,0,0,0,0|2,0,0]=4 207 B10R1.4 FCOc1ncccc1Br 3158c5616a8a0c4303904be077035407 [1,1,0,0,0,0|2,0,0]=4 208 B10R1.4 FCOc1ncccc1Cl 2c7f9a4204d7a10bfe25c8e8ac38c90d [1,1,0,0,0,0|2,0,0]=4 209 B10R1.4 FCOc1ncccc1F 7486a90e33b2c0d774a0bcb0fd24b075 [1,1,0,0,0,0|2,0,0]=4 210 B10R1.4 FCOn1ccccc1=S 4c363b6ba3f3c02b4424a6e03739a83d [1,1,0,0,0,0|1,1,0]=4 211 B10R1.4 N=c1ccccn1OCF 68516716d1662f0cc414e240e36aed9d [1,1,0,0,0,0|2,0,0]=4 212 B10R1.4 O=CNc1cccc[n+]1[O-] 965e0abbb142b0680abb5ad3f95c2305 [1,1,0,0,0,0|1,0,1]=4 213 B10R1.4 O=CNc1ccccc1Cl f50c00cfcaa880ebbb89407e81f8f8d5 [1,1,0,0,0,0|1,0,0]=3 214 B10R1.4 O=CNc1ccccc1F f3282ec2c1421e860906e44973b8a687 [1,1,0,0,0,0|1,0,0]=3 215 B10R1.4 O=CNc1ccccc1I 892dff9976fcab110017d24c58532fbf [1,1,0,0,0,0|1,0,0]=3 216 B10R1.4 O=CNc1ccccc1O a5803dbb8fd09b48d1dac5606f2634e9 [1,1,0,0,0,0|0,0,0]=2 217 B10R1.4 O=CNc1ccccc1S adbd377728039742a9715a2c254499e8 [1,1,0,0,0,0|0,1,0]=3 218 B10R1.4 O=CNc1cccnc1Br 067ed8cd00ae2be37ffcd23d4b813102 [1,1,0,0,0,0|2,0,0]=4 219 B10R1.4 O=CNc1cccnc1Cl 65ed286318dffde1ac22a69c8035c069 [1,1,0,0,0,0|2,0,0]=4 220 B10R1.4 O=CNc1cccnc1F 3f6098c3ee28b0b9240bc4385fc649ef [1,1,0,0,0,0|2,0,0]=4 221 B10R1.4 O=CNc1cccnc1I 554eb10301b8ea5a0631a3d0de1821bb [1,1,0,0,0,0|2,0,0]=4 222 B10R1.4 O=CNc1cccnc1O 2b8662d82921d406bd957c952a352054 [1,1,0,0,0,0|1,0,0]=3 223 B10R1.4 O=CNc1ccncc1Cl 734a66ac7d7f2aa4f2065324b96fe67c [1,1,0,0,0,0|2,0,0]=4 224 B10R1.4 O=CNc1ccncc1F 54f9fb25ed013771f5dfd7f4f63bbf45 [1,1,0,0,0,0|2,0,0]=4 225 B10R1.4 O=CNc1ccncc1I d42bc74a08da7c0623dd1f31e79a9861 [1,1,0,0,0,0|2,0,0]=4 226 B10R1.4 O=CNc1cnccc1Br 175a2e259bf91212e04dc2028b743367 [1,1,0,0,0,0|2,0,0]=4 227 B10R1.4 O=CNc1cnccc1F 93504e3990a6d40804e0070c51f15814 [1,1,0,0,0,0|2,0,0]=4 228 B10R1.4 O=CNc1cnccc1I 69e2f5597c7a113298b91de3b2400640 [1,1,0,0,0,0|2,0,0]=4 229 B10R1.4 O=CNc1cnccc1S e87b0427f473ebba57abc19e02e63ca1 [1,1,0,0,0,0|1,1,0]=4 230 B10R1.4 O=CNc1ncccc1Br 2bfca1acb095df8692524bc64723ba9b [1,1,0,0,0,0|2,0,0]=4 231 B10R1.4 O=CNc1ncccc1Cl 8545ddb1e36e607a772e90cc20b597eb [1,1,0,0,0,0|2,0,0]=4 232 B10R1.4 O=CNc1ncccc1F 2d934af61c68c8c71a4c9194d198930c [1,1,0,0,0,0|2,0,0]=4 233 B10R1.4 O=CNc1ncccc1I cae19cd679f2cd830ea4d1d7d347da28 [1,1,0,0,0,0|2,0,0]=4 234 B10R1.4 O=CNc1ncccc1O 1fdc1f2b7f57339d12939de7ab16180b [1,1,0,0,0,0|1,0,0]=3 235 B10R1.4 O=CNc1nccnc1O 9b1c055dbb00f06f2fbd37bb73cd7aa1 [1,1,0,0,0,0|2,0,0]=4 236 B10R1.4 O=c1ccccn1OCF d215752c228afefd30fcf04512752c26 [1,1,0,0,0,0|1,0,0]=3 237 B10R1.4 O=c1ccocc1OCF 2e426ae009b34598a08dab88f1e7ad2a [1,1,0,0,0,0|1,0,0]=3 238 B10R1.4 O=c1nc[nH]cc1OCF 7f83305615f45b0014dec0c1b657a75f [1,1,0,0,0,0|2,0,0]=4 239 B10R1.4 O=c1occcc1OCF b023a14443ff13f687cd997207eb3b4b [1,1,0,0,0,0|1,0,0]=3 240 B10R1.4 OCNc1ccccc1I 10ade089d4f881d90e5208c43f98902f [1,1,0,0,0,0|2,0,0]=4 241 B10R1.4 [O-][n+]1ccccc1OCF efe755020b864d4adb3a00bc05e56cdc [1,1,0,0,0,0|1,0,1]=4 242 B10R1.5 CCNc1ccsc1C=O 5739aaa524bdea2eacc804608ada4716 [0,1,0,0,1,0|2,0,0]=4 243 B10R1.5 O=Cc1sccc1NCF 15d0bb10eb7ac6cf653d430c0c2a7fa2 [0,1,0,0,1,0|2,0,0]=4 244 B10R1.5 O=Cc1sccc1NCO b58f5e0897b370725bc699ba92f720f0 [0,1,0,0,1,0|2,0,0]=4 245 B12R1.112 C#Cc1cc(ccc1NC=O)C d079cc76ca34c3d96bb61cb78aa51579 [0,2,0,0,0,0|1,0,1]=4 246 B12R1.112 C#Cc1cc(ccc1NC=O)F 13aa39865ec28b261b84412f68c35b49 [0,2,0,0,0,0|1,0,1]=4 247 B12R1.112 C=Cc1cc(ccc1OCC)F 4942aaaf8e45f2ae22aceca30d629d21 [0,2,0,0,0,0|1,0,0]=3 248 B12R1.112 C=Cc1cc(ccc1OCF)F 2795e7203824e0bc5ae693ce2f536abf [0,2,0,0,0,0|1,0,0]=3 249 B12R1.112 CCNc1ccc(cc1C=O)Br b0ab1d0c062d34140eb85a6dd0b275fa [0,2,0,0,0,0|1,0,0]=3 250 B12R1.112 CCNc1ccc(cc1C=O)C 87370bdac011a1859e1de7ff1a0e68a7 [0,2,0,0,0,0|1,0,0]=3 251 B12R1.112 CCNc1ccc(cc1C=O)Cl 43c91930cdf312da637404bdc3852357 [0,2,0,0,0,0|1,0,0]=3 252 B12R1.112 CCNc1ccc(cc1C=O)F 91d03c831ce0b7bfa514f82325b8f562 [0,2,0,0,0,0|1,0,0]=3 253 B12R1.112 CCNc1ccc(cc1C=O)I ece2532d5369912e71a5f2314975e552 [0,2,0,0,0,0|1,0,0]=3 254 B12R1.112 CCNc1ccc(cc1OC)Br 4e31e302348bf2f6827e4cfcaad234b2 [0,2,0,0,0,0|1,0,1]=4 255 B12R1.112 CCNc1ccc(cc1OC)C d23a90e7bd148e0c55ea6af59be97a87 [0,2,0,0,0,0|1,0,1]=4 256 B12R1.112 CCNc1ccc(cc1OC)Cl 88bced5345ef34a0a4403d9178c3230f [0,2,0,0,0,0|1,0,1]=4 257 B12R1.112 CCNc1ccc(cc1OC)F 94e7820b60fb90a8a3853170144d0874 [0,2,0,0,0,0|1,0,1]=4 258 B12R1.112 CCNc1ccc(cc1OC)I edb2a67a93cb8d25030c4ed2e20eafde [0,2,0,0,0,0|1,0,1]=4 259 B12R1.112 CCNc1cnc(cc1C=O)Br 278d0f51778a9dfc99b7e16e2ef40999 [0,2,0,0,0,0|2,0,0]=4 260 B12R1.112 CCNc1ncc(cc1C=O)Br f536e12c733ce8afbc2c94ffd2f1215f [0,2,0,0,0,0|2,0,0]=4 261 B12R1.112 CCNc1ncc(cc1C=O)C 2b35078e59295fe25f2f8c5c531f5ae6 [0,2,0,0,0,0|2,0,0]=4 262 B12R1.112 CCNc1ncc(cc1C=O)Cl 920f7a6d4ece6681a7f8b692b73b13f4 [0,2,0,0,0,0|2,0,0]=4 263 B12R1.112 CCNc1ncc(cc1C=O)F 30f68914e2e4bc88192c85bfbf369f21 [0,2,0,0,0,0|2,0,0]=4 264 B12R1.112 CCNc1ncc(cc1C=O)I 9ad1382092c73bb3d06cb3694f7d09e1 [0,2,0,0,0,0|2,0,0]=4 265 B12R1.112 CCOc1ccc(cc1C#N)Br c18f41c5748b887ef6a0f0cc5bae7805 [0,2,0,0,0,0|1,0,1]=4 266 B12R1.112 CCOc1ccc(cc1C#N)C 4d10a9c2e085c67ca73c9487ea2f2def [0,2,0,0,0,0|1,0,1]=4 267 B12R1.112 CCOc1ccc(cc1C#N)Cl c45d5b6854347eaafcde78da27fe7a17 [0,2,0,0,0,0|1,0,1]=4 268 B12R1.112 CCOc1ccc(cc1C#N)F 6b69592056ec81b480ac7f207e6316ac [0,2,0,0,0,0|1,0,1]=4 269 B12R1.112 CCOc1ccc(cc1C#N)I 8cc873d360ec33698abaa6879e009cc0 [0,2,0,0,0,0|1,0,1]=4 270 B12R1.112 CCOc1ccc(cc1C=O)Br 3a048877f70ee599f7b1997d9d68f161 [0,2,0,0,0,0|0,0,0]=2 271 B12R1.112 CCOc1ccc(cc1C=O)C 12b6664e2ad3ee3247ff2cd3ac210636 [0,2,0,0,0,0|0,0,0]=2 272 B12R1.112 CCOc1ccc(cc1C=O)Cl 32a2c8e33cc7352eb9c330dd7be2dfe1 [0,2,0,0,0,0|0,0,0]=2 273 B12R1.112 CCOc1ccc(cc1C=O)F 66bce88aa9f644790521cea5c9ca4248 [0,2,0,0,0,0|0,0,0]=2 274 B12R1.112 CCOc1ccc(cc1C=O)I 74a64282eca31e397efc8dec6d4b3fc3 [0,2,0,0,0,0|0,0,0]=2 275 B12R1.112 CCOc1ccc(cc1CC)Br 0e9ff406c0ad2e2f88e439bed7e72640 [0,2,0,0,0,0|1,0,1]=4 276 B12R1.112 CCOc1ccc(cc1CC)C 8b31132990056c83a1c4737b2641c195 [0,2,0,0,0,0|1,0,1]=4 277 B12R1.112 CCOc1ccc(cc1CC)Cl e8874d0cc9e3deb05d50ecdf2a6d7a72 [0,2,0,0,0,0|1,0,1]=4 278 B12R1.112 CCOc1ccc(cc1CC)F 30d982422d5414c288e4da947cbf5bfc [0,2,0,0,0,0|1,0,1]=4 279 B12R1.112 CCOc1ccc(cc1OC)Br d2222c966ca15377ae395f7bb616697e [0,2,0,0,0,0|1,0,1]=4 280 B12R1.112 CCOc1ccc(cc1OC)C e1afef5860eb8abe809c4e2cbb88c33c [0,2,0,0,0,0|1,0,1]=4 281 B12R1.112 CCOc1ccc(cc1OC)Cl 03a9a12ef7044bcaff4188e45841eb66 [0,2,0,0,0,0|1,0,1]=4 282 B12R1.112 CCOc1ccc(cc1OC)F 8dd9030bf093b335d33eb4d649e73927 [0,2,0,0,0,0|1,0,1]=4 283 B12R1.112 CCOc1ccc(cc1OC)I f61d40804c646cbe57caf3c55458676f [0,2,0,0,0,0|1,0,1]=4 284 B12R1.112 CCOc1ccc(cc1SC)Cl cae3d95ae8394b478869b045277c4932 [0,2,0,0,0,0|2,0,0]=4 285 B12R1.112 CCOc1ccc(cc1SC)F 30b8751460182f33f39dc55349965049 [0,2,0,0,0,0|2,0,0]=4 286 B12R1.112 CCOc1ccc(nc1C=O)C 96a0809b6649bbd2b15bbb322602346a [0,2,0,0,0,0|1,0,0]=3 287 B12R1.112 CCOc1cnc(cc1C=O)Br 5db0f27003e9fdb68ba4c041339b21b9 [0,2,0,0,0,0|1,0,0]=3 288 B12R1.112 CCOc1cnc(cc1C=O)Cl 6ad5547b92a926606b9d6e53a7503efa [0,2,0,0,0,0|1,0,0]=3 289 B12R1.112 CCc1cc(ccc1NC=O)Br e33734d3abc59ae8be5bc40a743744d4 [0,2,0,0,0,0|1,0,0]=3 290 B12R1.112 CCc1cc(ccc1NC=O)Cl 223d63e5aad708e5318821eb11620419 [0,2,0,0,0,0|1,0,0]=3 291 B12R1.112 CCc1cc(ccc1NC=O)F de860fb962210450d249c3a3d4f7ee17 [0,2,0,0,0,0|1,0,0]=3 292 B12R1.112 CCc1cc(ccc1NC=O)I 935ee9474dbb720d5b919521dc961e84 [0,2,0,0,0,0|1,0,0]=3 293 B12R1.112 CCc1cc(ccc1OCF)C 62ceb034be98e3d56d5361bbe5821736 [0,2,0,0,0,0|1,0,1]=4 294 B12R1.112 CCc1cc(ccc1OCF)Cl 371ee4dbf523f05edcf23eacd04ca743 [0,2,0,0,0,0|1,0,1]=4 295 B12R1.112 CCc1cc(ccc1OCF)F db15cc21b3ed913a36d5eacffe5a7335 [0,2,0,0,0,0|1,0,1]=4 296 B12R1.112 CCc1cc(cnc1NC=O)Br e6f302cafae57bbfbb9e61f90e84f9ed [0,2,0,0,0,0|2,0,0]=4 297 B12R1.112 CCc1cc(ncc1NC=O)Cl 10b00bd5b674a1bb0247051a423ee4e1 [0,2,0,0,0,0|2,0,0]=4 298 B12R1.112 COc1cc(ccc1NC=O)Br 1600ba81fa274ac60636eaaa7a5327fb [0,2,0,0,0,0|0,0,0]=2 299 B12R1.112 COc1cc(ccc1NC=O)C a86e4ac29f99aa70693d63e79e3ad0dd [0,2,0,0,0,0|0,0,0]=2 300 B12R1.112 COc1cc(ccc1NC=O)F d7aa4b803dba50256dc6d8962219234d [0,2,0,0,0,0|0,0,0]=2 301 B12R1.112 COc1cc(ccc1NC=O)I df2c8c6f98fa8a23bfbe1473aca13310 [0,2,0,0,0,0|0,0,0]=2 302 B12R1.112 COc1cc(ccc1NCF)Cl cbaa68739128dd7d82fe9084d9d97769 [0,2,0,0,0,0|1,0,1]=4 303 B12R1.112 COc1cc(ccc1NCF)F eb31cfd636ecf2e64952b722f6e293d6 [0,2,0,0,0,0|1,0,1]=4 304 B12R1.112 COc1cc(ccc1NCF)I d9d8c87fc05364d4c8f5c5ea22b615e4 [0,2,0,0,0,0|1,0,1]=4 305 B12R1.112 COc1cc(ccc1NCO)Br 8c2304e1056283fe1cfae8d6647a46ea [0,2,0,0,0,0|0,0,2]=4 306 B12R1.112 COc1cc(ccc1NCO)C 865b0ec47dc7a5224e2f7cac9a1f008c [0,2,0,0,0,0|0,0,2]=4 307 B12R1.112 COc1cc(ccc1NCO)Cl baa672f3a53e5c10dc476b7c1ba9fda1 [0,2,0,0,0,0|0,0,2]=4 308 B12R1.112 COc1cc(ccc1NCO)F 1de9ed0b12d18eebc0140f03030bf210 [0,2,0,0,0,0|0,0,2]=4 309 B12R1.112 COc1cc(ccc1NCO)I 335a380c335b1a5550047235c5cf75bf [0,2,0,0,0,0|0,0,2]=4 310 B12R1.112 COc1cc(ccc1OCF)C 94b361954d98967aed0df41a163e3a12 [0,2,0,0,0,0|1,0,1]=4 311 B12R1.112 COc1cc(ccc1OCF)Cl 7f4d0255d87372940a3c4dce63898a49 [0,2,0,0,0,0|1,0,1]=4 312 B12R1.112 COc1cc(ccc1OCF)F 4bc1e013fc9be71bfb89c7e2b34f8da7 [0,2,0,0,0,0|1,0,1]=4 313 B12R1.112 COc1cc(ccc1OCF)I c719387cbef28611f99e1f3ff6fadf40 [0,2,0,0,0,0|1,0,1]=4 314 B12R1.112 COc1cc(cnc1NC=O)F 9c915f4caf9d426c284193603c2c2fef [0,2,0,0,0,0|1,0,0]=3 315 B12R1.112 COc1cc(cnc1NC=O)I f2a910ec4bbf4a1c70f4ec9105684f59 [0,2,0,0,0,0|1,0,0]=3 316 B12R1.112 COc1nc(ncc1NC=O)C 45624a0ce08b9262ef48c87f60e190a0 [0,2,0,0,0,0|2,0,0]=4 317 B12R1.112 CSc1cc(ccc1NC=O)Br bd1478ad563323b30fb1d8d31d002590 [0,2,0,0,0,0|0,1,0]=3 318 B12R1.112 CSc1cc(ccc1NC=O)O 6c6bb37a09b638e1fab9c7da3a14dd28 [0,2,0,0,0,0|0,1,0]=3 319 B12R1.112 CSc1cc(ccc1OCF)Cl f7c24743c1819ea80fcc5432cf3d0fa5 [0,2,0,0,0,0|2,0,0]=4 320 B12R1.112 CSc1cc(ccc1OCF)F 32e55529780a9b9862bf131575daf1ff [0,2,0,0,0,0|2,0,0]=4 321 B12R1.112 Cc1ccc(c(c1)C=O)NCF 8d46ea913cd9a8327e2bbab64908a9fb [0,2,0,0,0,0|1,0,0]=3 322 B12R1.112 Cc1ccc(c(c1)C=O)NCO 634e0c48e0441e813f60be190e55e694 [0,2,0,0,0,0|1,0,0]=3 323 B12R1.112 Cc1ccc(c(c1)C=O)OCF b3a1c9932fb582bee6afdfd7a5087ec2 [0,2,0,0,0,0|0,0,0]=2 324 B12R1.112 Cc1ccc(c(c1)CO)NC=O bb4e31d8f4a666d4dd0ceb5fde7ae1be [0,2,0,0,0,0|2,0,0]=4 325 B12R1.112 Cc1ccc(c(n1)C=O)OCF f6db4c899f1f1f1926264d2ddf150f92 [0,2,0,0,0,0|1,0,0]=3 326 B12R1.112 Cc1cnc(c(c1)C=O)NCF a36c26aad78f083bc776fdd20d9b7334 [0,2,0,0,0,0|2,0,0]=4 327 B12R1.112 Cc1cnc(c(c1)C=O)NCO 1c692d3f4c8b5d67997813cbd7de728a [0,2,0,0,0,0|2,0,0]=4 328 B12R1.112 N#Cc1cc(ccc1NC=O)F 719b82c561151ab505965d642ac79085 [0,2,0,0,0,0|2,0,0]=4 329 B12R1.112 N#Cc1cc(ccc1OCF)Cl 3a5233e154f502ad6276c6b5c4e5646c [0,2,0,0,0,0|1,0,1]=4 330 B12R1.112 N#Cc1cc(ccc1OCF)F 9928184a57d0b3d57b549ced7a715f90 [0,2,0,0,0,0|1,0,1]=4 331 B12R1.112 N#Cc1cc(ccc1OCF)I f4f5c118b624fe2a4ea8a2f461d8aced [0,2,0,0,0,0|1,0,1]=4 332 B12R1.112 O=CNc1ccc(cc1C=O)Cl 4099e7df015f69b175ed274632112e60 [0,2,0,0,0,0|1,0,1]=4 333 B12R1.112 O=CNc1ccc(cc1C=O)F fff6819fa4462a83181a73aede3b1e30 [0,2,0,0,0,0|1,0,1]=4 334 B12R1.112 O=CNc1ccc(cc1CO)F 77d6c9a30b056b5561e7d1f7582bc14b [0,2,0,0,0,0|2,0,0]=4 335 B12R1.112 O=CNc1ccc(cc1CO)I 11852c45d657ec056fc35fc547a8b65e [0,2,0,0,0,0|2,0,0]=4 336 B12R1.112 O=Cc1cc(ccc1NCF)Br 8b19cc2c249603f1561fb8ee5c82788c [0,2,0,0,0,0|1,0,0]=3 337 B12R1.112 O=Cc1cc(ccc1NCF)Cl 85b47a730f34e379a99356bd03504c21 [0,2,0,0,0,0|1,0,0]=3 338 B12R1.112 O=Cc1cc(ccc1NCF)F 0b4439f0334031d261eccf37433718ff [0,2,0,0,0,0|1,0,0]=3 339 B12R1.112 O=Cc1cc(ccc1NCF)I 10930ce918bfc53137863e8e9e5c12d5 [0,2,0,0,0,0|1,0,0]=3 340 B12R1.112 O=Cc1cc(ccc1NCO)Br 7c16d1a6e008fbe66739b4027f06dd9d [0,2,0,0,0,0|1,0,0]=3 341 B12R1.112 O=Cc1cc(ccc1NCO)Cl c8bbf91dc7abd024b2e48ecf430c85ce [0,2,0,0,0,0|1,0,0]=3 342 B12R1.112 O=Cc1cc(ccc1NCO)F e651b4cabed3395f3433031450d07b11 [0,2,0,0,0,0|1,0,0]=3 343 B12R1.112 O=Cc1cc(ccc1NCO)I 1d99860a49bde2122b4aabb250d50d03 [0,2,0,0,0,0|1,0,0]=3 344 B12R1.112 O=Cc1cc(ccc1OCF)Br 2a0bd951237557f1057cd7f04aeb710f [0,2,0,0,0,0|0,0,0]=2 345 B12R1.112 O=Cc1cc(ccc1OCF)Cl c14547039318cb882e127d4b8e0155b1 [0,2,0,0,0,0|0,0,0]=2 346 B12R1.112 O=Cc1cc(ccc1OCF)F 62943c3a34311a76f8f2d353d503e70e [0,2,0,0,0,0|0,0,0]=2 347 B12R1.112 O=Cc1cc(ccc1OCF)I f536531c8de7725366974289c4bc6cf9 [0,2,0,0,0,0|0,0,0]=2 348 B12R1.112 O=Cc1cc(cnc1NCF)Br 5c00c3036153a0e5b8bb00db1b4a7394 [0,2,0,0,0,0|2,0,0]=4 349 B12R1.112 O=Cc1cc(cnc1NCF)Cl 10f823c2b7c4b151f856a85030488aa3 [0,2,0,0,0,0|2,0,0]=4 350 B12R1.112 O=Cc1cc(cnc1NCF)F eeb0c4e541e024ac652d40b047a035dc [0,2,0,0,0,0|2,0,0]=4 351 B12R1.112 O=Cc1cc(cnc1NCF)I ce6ddd6643082992f58874eef5f965c9 [0,2,0,0,0,0|2,0,0]=4 352 B12R1.112 O=Cc1cc(cnc1NCO)Br 5b2786d3c3fd8aa4ef4522405e647422 [0,2,0,0,0,0|2,0,0]=4 353 B12R1.112 O=Cc1cc(cnc1NCO)Cl 91c597e098f9a8579e3a83fea4e2fd6c [0,2,0,0,0,0|2,0,0]=4 354 B12R1.112 O=Cc1cc(cnc1NCO)F 4dff6150456c2386e5a33599a5d48889 [0,2,0,0,0,0|2,0,0]=4 355 B12R1.112 O=Cc1cc(cnc1NCO)I 1d7d8b6223cfa05dec33f0c0ccdf0aba [0,2,0,0,0,0|2,0,0]=4 356 B12R1.112 O=Cc1cc(ncc1NCF)Br abfc1e8c3802bf1b115bb1be8f6ab8e5 [0,2,0,0,0,0|2,0,0]=4 357 B12R1.112 O=Cc1cc(ncc1NCO)Br a79a5a48a2cae3bb47efb529692a2dbb [0,2,0,0,0,0|2,0,0]=4 358 B12R1.112 O=Cc1cc(ncc1OCF)Br d32ca519427cbdcd954da81995259369 [0,2,0,0,0,0|1,0,0]=3 359 B12R1.112 O=Cc1cc(ncc1OCF)Cl 58115267154399e19b098d0a60755f15 [0,2,0,0,0,0|1,0,0]=3 360 B12R1.268 C#Cc1ccc(cc1NC=O)F bd5e1dabe72b1c8c29e7df2f5cfd365c [0,2,0,0,0,0|1,0,1]=4 361 B12R1.268 C=Cc1ccc(cc1OCC)Br 4a6c1b2a84c6b9940c3cb522d5997887 [0,2,0,0,0,0|1,0,0]=3 362 B12R1.268 C=Cc1ccc(cc1OCF)Br 63126ec50a96921596e513649c2218f7 [0,2,0,0,0,0|1,0,0]=3 363 B12R1.268 CCNc1cc(ccc1C=O)Br 81a7b6ba4d5794887fe75458353f9aae [0,2,0,0,0,0|1,0,0]=3 364 B12R1.268 CCNc1cc(ccc1C=O)C 2ca0703fa84b6589eb103cda1585c2c3 [0,2,0,0,0,0|1,0,0]=3 365 B12R1.268 CCNc1cc(ccc1C=O)Cl b68c1c09b523e4bf81d455fe7a6e3c34 [0,2,0,0,0,0|1,0,0]=3 366 B12R1.268 CCNc1cc(ccc1C=O)F 2e426af8416c8dbbe8cef362ff459cf7 [0,2,0,0,0,0|1,0,0]=3 367 B12R1.268 CCNc1cc(ccc1C=O)I 4e9aaf65828583b9ac7e6f6f3393929e [0,2,0,0,0,0|1,0,0]=3 368 B12R1.268 CCNc1cc(ccc1OC)Br ccb3b4d8ff6538c35dc39ff2d71afb7e [0,2,0,0,0,0|1,0,1]=4 369 B12R1.268 CCNc1cc(ccc1OC)C 39aed3078197feccaf46d9b5a8ec9610 [0,2,0,0,0,0|1,0,1]=4 370 B12R1.268 CCNc1cc(ccc1OC)Cl 119891248fabc3cde01cfd329d18d130 [0,2,0,0,0,0|1,0,1]=4 371 B12R1.268 CCNc1cc(ccc1OC)F df5744dca9252261e41c928027bb33c5 [0,2,0,0,0,0|1,0,1]=4 372 B12R1.268 CCNc1cc(ccc1OC)I 20d2043a1bd6afbc1e9ab7f3e2b87ae1 [0,2,0,0,0,0|1,0,1]=4 373 B12R1.268 CCNc1cc(cnc1C=O)Br 86ead72527233f73020fea54f64ecd84 [0,2,0,0,0,0|2,0,0]=4 374 B12R1.268 CCNc1cc(cnc1C=O)F 6f2f489ab5cf064fadc32643b559f762 [0,2,0,0,0,0|2,0,0]=4 375 B12R1.268 CCNc1cc(ncc1C=O)Br edae3690acc4083f6c50253b45dca5c0 [0,2,0,0,0,0|2,0,0]=4 376 B12R1.268 CCNc1cc(ncc1C=O)Cl a4c533e672e6c9b9094ce510290cae74 [0,2,0,0,0,0|2,0,0]=4 377 B12R1.268 CCNc1nc(ccc1C=O)Br 2bc692b32e733c9838acd3a3e24dabc2 [0,2,0,0,0,0|2,0,0]=4 378 B12R1.268 CCNc1nc(ccc1C=O)C 49e6353aea2eed18bd3c53d168b9c17a [0,2,0,0,0,0|2,0,0]=4 379 B12R1.268 CCNc1nc(ccc1C=O)Cl 4a62cd238a63319690bf36a1cae42225 [0,2,0,0,0,0|2,0,0]=4 380 B12R1.268 CCNc1nc(ccc1C=O)F c5e237cdc99a23520d900d4773d77e8a [0,2,0,0,0,0|2,0,0]=4 381 B12R1.268 CCOc1cc(ccc1C#N)Br 5b2e1d6426dbe1676ad222e9858f3a50 [0,2,0,0,0,0|1,0,1]=4 382 B12R1.268 CCOc1cc(ccc1C#N)C 3c1df181b23c2f91f97ff39272db2df4 [0,2,0,0,0,0|1,0,1]=4 383 B12R1.268 CCOc1cc(ccc1C#N)Cl 486199ae5bef88cbe970a72f79491621 [0,2,0,0,0,0|1,0,1]=4 384 B12R1.268 CCOc1cc(ccc1C#N)F 2c21e1417ef9c7315fc15bdf49b4ad6b [0,2,0,0,0,0|1,0,1]=4 385 B12R1.268 CCOc1cc(ccc1C#N)I 56ba68a8f1e8a04065eebd298f3ebee1 [0,2,0,0,0,0|1,0,1]=4 386 B12R1.268 CCOc1cc(ccc1C=O)Br 60994c1ce75f0e3149c108dc2b78b32a [0,2,0,0,0,0|0,0,0]=2 387 B12R1.268 CCOc1cc(ccc1C=O)C 6dd3e7ba76c874b3cc08db439f57aede [0,2,0,0,0,0|0,0,0]=2 388 B12R1.268 CCOc1cc(ccc1C=O)Cl ae6cd349b2a96059f6d65aad9ce88900 [0,2,0,0,0,0|0,0,0]=2 389 B12R1.268 CCOc1cc(ccc1C=O)F ae34705ee953c178e2966757c9b3c11d [0,2,0,0,0,0|0,0,0]=2 390 B12R1.268 CCOc1cc(ccc1C=O)I 2d019d0403e34423cc74fe40ff2658cb [0,2,0,0,0,0|0,0,0]=2 391 B12R1.268 CCOc1cc(ccc1CC)Br 39f6fe5fd2b99e16ae481a0b98f7f6eb [0,2,0,0,0,0|1,0,1]=4 392 B12R1.268 CCOc1cc(ccc1CC)C d9275bba9af5dce7e38a40948cc95a55 [0,2,0,0,0,0|1,0,1]=4 393 B12R1.268 CCOc1cc(ccc1OC)Br 693a68e83116fae0e214e9c891fc2ada [0,2,0,0,0,0|1,0,1]=4 394 B12R1.268 CCOc1cc(ccc1OC)C 5df4414bf5363dcaf76df5084d1ca08f [0,2,0,0,0,0|1,0,1]=4 395 B12R1.268 CCOc1cc(ccc1OC)Cl eb366a39dac3fe8cafab689a7a6517e6 [0,2,0,0,0,0|1,0,1]=4 396 B12R1.268 CCOc1cc(ccc1OC)F be61a708ef7b82d9cc7f4ad8d3b6d9fb [0,2,0,0,0,0|1,0,1]=4 397 B12R1.268 CCOc1cc(ccc1OC)I 18fa643fb331499de688f0df3866fbc4 [0,2,0,0,0,0|1,0,1]=4 398 B12R1.268 CCOc1cc(ccc1SC)Br 307d73b2b549e8e7371892f1e52915a8 [0,2,0,0,0,0|2,0,0]=4 399 B12R1.268 CCOc1cc(ccc1SC)F 2aa05bc6031d37e5ab23e1d8f2651082 [0,2,0,0,0,0|2,0,0]=4 400 B12R1.268 CCOc1cc(cnc1C=O)Br 071c4b107e1174053840fa7a8c163a53 [0,2,0,0,0,0|1,0,0]=3 401 B12R1.268 CCOc1cc(cnc1C=O)C fb745b67b4730480b5e3f4e4f83f52fb [0,2,0,0,0,0|1,0,0]=3 402 B12R1.268 CCOc1cc(ncc1C=O)Cl 1a56ea427f7e0d4bfe298d3ed5088355 [0,2,0,0,0,0|1,0,0]=3 403 B12R1.268 CCOc1nc(ccc1C=O)Br eca8815cf0070e94c2604e317732cd05 [0,2,0,0,0,0|1,0,0]=3 404 B12R1.268 CCc1ccc(cc1NC=O)Br 8737cb077009ee1f0817102668f18396 [0,2,0,0,0,0|1,0,0]=3 405 B12R1.268 CCc1ccc(cc1NC=O)Cl 461cda2eba3828ce8938e6d8c287c12f [0,2,0,0,0,0|1,0,0]=3 406 B12R1.268 CCc1ccc(cc1OCF)Br 7bc269b59eee6b723c8fb99da3d242e5 [0,2,0,0,0,0|1,0,1]=4 407 B12R1.268 CCc1ccc(cc1OCF)C 42896bd072db7b0642dba5db7363926a [0,2,0,0,0,0|1,0,1]=4 408 B12R1.268 CCc1ccc(nc1NC=O)C 01c403c2ae34664b2eb0e26d9902991b [0,2,0,0,0,0|2,0,0]=4 409 B12R1.268 CCc1ncc(cc1NC=O)Br 71835027d005b9ceeead52481d0b21c7 [0,2,0,0,0,0|2,0,0]=4 410 B12R1.268 COc1ccc(cc1NC=O)C 7a7441908f06dfba271b17a3023e9bd4 [0,2,0,0,0,0|0,0,0]=2 411 B12R1.268 COc1ccc(cc1NC=O)Cl 1ca69dd07bf59db7736b0fb82682e85c [0,2,0,0,0,0|0,0,0]=2 412 B12R1.268 COc1ccc(cc1NC=O)F 33056a9d2f95ad362c159415d75a6e50 [0,2,0,0,0,0|0,0,0]=2 413 B12R1.268 COc1ccc(cc1NC=O)I 5f7a4ef034955ce33c0d8bbee3974a03 [0,2,0,0,0,0|0,0,0]=2 414 B12R1.268 COc1ccc(cc1NCF)Cl 2ca0f1abc3cc9d00f9340ed42a2791eb [0,2,0,0,0,0|1,0,1]=4 415 B12R1.268 COc1ccc(cc1NCF)F 7f79db27573803658b4488c91dba8bb7 [0,2,0,0,0,0|1,0,1]=4 416 B12R1.268 COc1ccc(cc1NCF)I 454b8f631a15e61c54d53142c4cad6f5 [0,2,0,0,0,0|1,0,1]=4 417 B12R1.268 COc1ccc(cc1NCO)Br bd55be87040c459d885edec61939b007 [0,2,0,0,0,0|0,0,2]=4 418 B12R1.268 COc1ccc(cc1NCO)C 3f1052ddbaec0a614306a172eec14234 [0,2,0,0,0,0|0,0,2]=4 419 B12R1.268 COc1ccc(cc1NCO)Cl 9e1fdb85aad4cbac1164fdb28901c28d [0,2,0,0,0,0|0,0,2]=4 420 B12R1.268 COc1ccc(cc1NCO)F b5cc84555feac52bd606610e0011ce97 [0,2,0,0,0,0|0,0,2]=4 421 B12R1.268 COc1ccc(cc1NCO)I b46665b5077c48a403e99df4e2cc63fa [0,2,0,0,0,0|0,0,2]=4 422 B12R1.268 COc1ccc(cc1OCF)Cl d30a6128e8adf3bff2e7e64352c20da4 [0,2,0,0,0,0|1,0,1]=4 423 B12R1.268 COc1ccc(cc1OCF)F b82e38d8ed319dde93d40870ea96ac41 [0,2,0,0,0,0|1,0,1]=4 424 B12R1.268 COc1ccc(cc1OCF)I 1de2738c279cddc304cedd7ee4d8bef5 [0,2,0,0,0,0|1,0,1]=4 425 B12R1.268 COc1ccc(nc1NC=O)F 05a1f06bcfe3ee82f8bfcc4832fee478 [0,2,0,0,0,0|1,0,0]=3 426 B12R1.268 COc1cnc(nc1NC=O)Cl f7666b15bfab1d72d6a8feaec9d96fef [0,2,0,0,0,0|2,0,0]=4 427 B12R1.268 COc1ncc(cc1NC=O)Cl ca14c0892546db2f938571d5385e8e42 [0,2,0,0,0,0|1,0,0]=3 428 B12R1.268 COc1ncc(cc1NC=O)F 73d64a7926fa6ddd195ddc5e90441d56 [0,2,0,0,0,0|1,0,0]=3 429 B12R1.268 CSc1ccc(cc1NC=O)Br 46e6c4ca5e1729bda27b08a7e968aefb [0,2,0,0,0,0|0,1,0]=3 430 B12R1.268 CSc1ccc(cc1NC=O)Cl cd7cb90f77137f76c66129df001c884a [0,2,0,0,0,0|0,1,0]=3 431 B12R1.268 CSc1ccc(cc1OCF)F d3b9026cc47d9cb2c6ea33996a69f50d [0,2,0,0,0,0|2,0,0]=4 432 B12R1.268 Cc1ccc(c(c1)NC=O)CO 17e2f5340f8b9ee5c03476226912cbad [0,2,0,0,0,0|2,0,0]=4 433 B12R1.268 Cc1ccc(c(c1)NCF)C=O 57bcd8e1508cb8ef4064b0322bb90bcc [0,2,0,0,0,0|1,0,0]=3 434 B12R1.268 Cc1ccc(c(c1)NCO)C=O 0b966161378544cc3c9a82f28a8dd93a [0,2,0,0,0,0|1,0,0]=3 435 B12R1.268 Cc1ccc(c(c1)OCF)C=O f0938f8cdd72f23e4b59fbcac6656ea8 [0,2,0,0,0,0|0,0,0]=2 436 B12R1.268 Cc1ccc(c(n1)NCF)C=O fdfcbee9dad44d80ab2d772698529591 [0,2,0,0,0,0|2,0,0]=4 437 B12R1.268 Cc1ccc(c(n1)NCO)C=O d957a0053503bdb5be69456c7021ceb6 [0,2,0,0,0,0|2,0,0]=4 438 B12R1.268 Cc1cnc(c(c1)OCF)C=O 14e5ec1bcc55904117a50c0d6cb62d8e [0,2,0,0,0,0|1,0,0]=3 439 B12R1.268 N#Cc1ccc(cc1OCF)Cl de049a34c5353c9275a906a353143fa9 [0,2,0,0,0,0|1,0,1]=4 440 B12R1.268 N#Cc1ccc(cc1OCF)F 68e5b100c96e8f15106b3138ae2203e7 [0,2,0,0,0,0|1,0,1]=4 441 B12R1.268 N#Cc1ccc(cc1OCF)I d30bd94a4e9644e15fefbe622502b4b2 [0,2,0,0,0,0|1,0,1]=4 442 B12R1.268 O=CNc1cc(ccc1CO)Br 232d8364b0bcb098f1a8c728b43c5614 [0,2,0,0,0,0|2,0,0]=4 443 B12R1.268 O=CNc1cc(ccc1CO)Cl a65cf2a14852999d2156a3bddb1cbba3 [0,2,0,0,0,0|2,0,0]=4 444 B12R1.268 O=CNc1cc(ccc1CO)F fc257f3871f9c0d146b77837c33da278 [0,2,0,0,0,0|2,0,0]=4 445 B12R1.268 O=Cc1ccc(cc1NCF)Br 851e38fd587b092c463b984db06e4772 [0,2,0,0,0,0|1,0,0]=3 446 B12R1.268 O=Cc1ccc(cc1NCF)Cl 0e1ee85d69b6e830a7e04348b9cb4437 [0,2,0,0,0,0|1,0,0]=3 447 B12R1.268 O=Cc1ccc(cc1NCF)F 98ad090541cd40e108fb660259156a57 [0,2,0,0,0,0|1,0,0]=3 448 B12R1.268 O=Cc1ccc(cc1NCF)I 9c4635450ee2e8dfb06c42990b881434 [0,2,0,0,0,0|1,0,0]=3 449 B12R1.268 O=Cc1ccc(cc1NCO)Br ab354b04e4d40c8992409ffa11adb52a [0,2,0,0,0,0|1,0,0]=3 450 B12R1.268 O=Cc1ccc(cc1NCO)Cl e8fd2a70ee5b5a647b849b8b7b30c1cd [0,2,0,0,0,0|1,0,0]=3 451 B12R1.268 O=Cc1ccc(cc1NCO)F d8af39399bac214b835ca467e8879250 [0,2,0,0,0,0|1,0,0]=3 452 B12R1.268 O=Cc1ccc(cc1NCO)I 16c8124f363d806cf77c0daa345c4713 [0,2,0,0,0,0|1,0,0]=3 453 B12R1.268 O=Cc1ccc(cc1OCF)Br 1bbf2c96c3ab390e88b4a08fda3d1d1b [0,2,0,0,0,0|0,0,0]=2 454 B12R1.268 O=Cc1ccc(cc1OCF)Cl 5713e5a57d4cf8dda54bdbef6d30c98c [0,2,0,0,0,0|0,0,0]=2 455 B12R1.268 O=Cc1ccc(cc1OCF)F 69c8f103b35aa3fdc566da4ab9c670c6 [0,2,0,0,0,0|0,0,0]=2 456 B12R1.268 O=Cc1ccc(cc1OCF)I 330b27b4f2fb3d1b686308a3776cc12b [0,2,0,0,0,0|0,0,0]=2 457 B12R1.268 O=Cc1ccc(nc1NCF)Br 3593b5ddd3aa0226b3f6cf480397aec1 [0,2,0,0,0,0|2,0,0]=4 458 B12R1.268 O=Cc1ccc(nc1NCF)Cl 5ac923950d51f624789e70588f4040eb [0,2,0,0,0,0|2,0,0]=4 459 B12R1.268 O=Cc1ccc(nc1NCF)F b722a2f1525cd734ab4dfe9d0e512473 [0,2,0,0,0,0|2,0,0]=4 460 B12R1.268 O=Cc1ccc(nc1NCO)Br aab39f1cacd7fbaf5ad5d267b70a1b11 [0,2,0,0,0,0|2,0,0]=4 461 B12R1.268 O=Cc1ccc(nc1NCO)Cl bdc6f03c8710e3a1e45ed4c6f5c792fa [0,2,0,0,0,0|2,0,0]=4 462 B12R1.268 O=Cc1ccc(nc1NCO)F 58bda6b89a205e37f7608cca6cb6cb3e [0,2,0,0,0,0|2,0,0]=4 463 B12R1.268 O=Cc1ccc(nc1OCF)Br 5b56fb237733cbfb4db46c334edcb48b [0,2,0,0,0,0|1,0,0]=3 464 B12R1.268 O=Cc1cnc(cc1NCF)Br 0eff148f0cd3363fcebe82bcaac0fad4 [0,2,0,0,0,0|2,0,0]=4 465 B12R1.268 O=Cc1cnc(cc1NCF)Cl 7f2e53bbc8bea22450a9ba4451a26d60 [0,2,0,0,0,0|2,0,0]=4 466 B12R1.268 O=Cc1cnc(cc1NCO)Br af2f684c061c5f71eaf128920fd57c1d [0,2,0,0,0,0|2,0,0]=4 467 B12R1.268 O=Cc1cnc(cc1NCO)Cl ffd0c90193e11154214ecfff23b03494 [0,2,0,0,0,0|2,0,0]=4 468 B12R1.268 O=Cc1cnc(cc1OCF)Cl 66aa485edf5e86ff16e9e75d9338b83c [0,2,0,0,0,0|1,0,0]=3 469 B12R1.268 O=Cc1ncc(cc1NCF)Br d78c3f1a2b10463eeba91bb0365235c8 [0,2,0,0,0,0|2,0,0]=4 470 B12R1.268 O=Cc1ncc(cc1NCF)F ebd833f9747f44cd42e966f37ecfa339 [0,2,0,0,0,0|2,0,0]=4 471 B12R1.268 O=Cc1ncc(cc1NCO)Br dd22bb43e06ed1055927e9f803cf61c8 [0,2,0,0,0,0|2,0,0]=4 472 B12R1.268 O=Cc1ncc(cc1NCO)F bf7166a5dad026b2c031e03836021ec6 [0,2,0,0,0,0|2,0,0]=4 473 B12R1.268 O=Cc1ncc(cc1OCF)Br 76a386666f033c05a540c58079df2b7b [0,2,0,0,0,0|1,0,0]=3 474 B12R1.75 C#Cc1ccccc1NC(=O)C 4461b1ad79a205576b1537ba0b7a1c45 [0,2,0,0,0,0|1,0,1]=4 475 B12R1.75 C#Cc1ccccc1OC(C)C 5fb2785bb6f1845ea9d7399e4082f45c [0,2,0,0,0,0|1,0,1]=4 476 B12R1.75 C=Cc1ccccc1NC(=O)C 5268ea1e42747cbde59451b14da60f4f [0,2,0,0,0,0|1,0,1]=4 477 B12R1.75 C=Cc1ccccc1NC(C)C 995e7d4374b987994664cf5d8c4bc074 [0,2,0,0,0,0|2,0,0]=4 478 B12R1.75 C=Cc1ccccc1OC(C)C d531882f2c23a56b1654c2b774a48133 [0,2,0,0,0,0|1,0,0]=3 479 B12R1.75 CC(=O)Nc1ccccc1C#N 2b065c1cfe22afa5c24515fcd18283bd [0,2,0,0,0,0|2,0,0]=4 480 B12R1.75 CC(=O)Nc1ccccc1C=O 01849de0c2afbf0fd1bfd5cf138f712d [0,2,0,0,0,0|1,0,0]=3 481 B12R1.75 CC(=O)Nc1ccccc1CBr f4be17e173403bc79c7519660c99e8f1 [0,2,0,0,0,0|2,0,0]=4 482 B12R1.75 CC(=O)Nc1ccccc1CO b89646b9773d96392fa1223dcb029965 [0,2,0,0,0,0|2,0,0]=4 483 B12R1.75 CC(=O)Nc1ccccc1CS bed3f5860b5c74a89ab9fd435ab53256 [0,2,0,0,0,0|2,0,0]=4 484 B12R1.75 CC(=O)Nc1cccnc1C=O 6031952e06d6c3dd5c06d5d1b8d673a4 [0,2,0,0,0,0|2,0,0]=4 485 B12R1.75 CC(=O)Nc1ccncc1C=O 961f6e5fd62d0ac320cfe0b5ca1140de [0,2,0,0,0,0|2,0,0]=4 486 B12R1.75 CC(=O)Nc1cnccc1C=O 2608aae37a3d6d24f0b46632f1e228ee [0,2,0,0,0,0|2,0,0]=4 487 B12R1.75 CC(=O)Nc1ncccc1C=O 6e25b5e5e31525a78fff539b1428d3c6 [0,2,0,0,0,0|2,0,0]=4 488 B12R1.75 CC(C)Nc1ccccc1C=O 1ea42160d99500f2f247d1c323ae97a3 [0,2,0,0,0,0|1,0,0]=3 489 B12R1.75 CC(C)Nc1cccnc1C=O 5ec6675e6fed52e68b1387f0ab900277 [0,2,0,0,0,0|2,0,0]=4 490 B12R1.75 CC(C)Nc1ccncc1C=O c4af4efc2cd74cf3784cf42246f68eee [0,2,0,0,0,0|2,0,0]=4 491 B12R1.75 CC(C)Nc1cnccc1C=O 5a7b45adb419ddf911e82d9031356bb3 [0,2,0,0,0,0|2,0,0]=4 492 B12R1.75 CC(C)Nc1ncccc1C=O 10b88dd469e8cd7cf3eec994d0cb0812 [0,2,0,0,0,0|2,0,0]=4 493 B12R1.75 CC(C)Oc1ccccc1C#N 7149e888e8961e276dfd552220244434 [0,2,0,0,0,0|1,0,1]=4 494 B12R1.75 CC(C)Oc1ccccc1C=O fc188e20ae7067ec467c46f7640666a7 [0,2,0,0,0,0|0,0,0]=2 495 B12R1.75 CC(C)Oc1cccnc1C=O 1a364e417b83d5b80cfc81df9ddcb05b [0,2,0,0,0,0|1,0,0]=3 496 B12R1.75 CC(C)Oc1ccncc1C=O 42756f9261d3595fa83342ea9344a293 [0,2,0,0,0,0|1,0,0]=3 497 B12R1.75 CC(C)Oc1cnccc1C=O 47cc2fcdb40f808589b853bff2ac8dc0 [0,2,0,0,0,0|1,0,0]=3 498 B12R1.75 CCc1ccccc1NC(=O)C ab6d65e3c5537181bc992814e45b99ca [0,2,0,0,0,0|1,0,0]=3 499 B12R1.75 CCc1ccccc1OC(C)C b797575d38ba5b9ee07e898e057c7852 [0,2,0,0,0,0|1,0,1]=4 500 B12R1.75 CCc1cccnc1NC(=O)C 5ccd1bf58f9b882d77c50aec55d4911a [0,2,0,0,0,0|2,0,0]=4 501 B12R1.75 CCc1ncccc1NC(=O)C db64c5f0d2a0a4e9f29bef143a21de04 [0,2,0,0,0,0|2,0,0]=4 502 B12R1.75 COc1ccccc1NC(=O)C 99183408a901862594abd2438e5d4ddd [0,2,0,0,0,0|0,0,0]=2 503 B12R1.75 COc1ccccc1OC(C)C c1dcbb1f48c176cca0a792de0db2234a [0,2,0,0,0,0|1,0,1]=4 504 B12R1.75 COc1cccnc1NC(=O)C 7bb307565036758aca5788b4766577f3 [0,2,0,0,0,0|1,0,0]=3 505 B12R1.75 COc1ccncc1NC(=O)C 8ca24f8e614c196f055cf3a0e562d8f4 [0,2,0,0,0,0|1,0,0]=3 506 B12R1.75 COc1ncccc1NC(=O)C b95ce8608e7584ac0e928bcb0dafd19f [0,2,0,0,0,0|1,0,0]=3 507 B12R1.75 COc1nccnc1NC(=O)C 00d3269abe5d841944f3330f5000bfc7 [0,2,0,0,0,0|2,0,0]=4 508 B12R1.75 COc1nnccc1NC(=O)C 47c3d4b2bbdb1cd0a7b8cbe4032ba736 [0,2,0,0,0,0|2,0,0]=4 509 B12R1.75 CSc1ccccc1NC(=O)C 963646d8f23d85ca9001073ee0217f48 [0,2,0,0,0,0|0,1,0]=3 510 B12R1.75 CSc1ccccc1OC(C)C 8232f49eaf6b0b7ba6b339a5985799c9 [0,2,0,0,0,0|2,0,0]=4 511 B12R1.75 CSc1cccnc1NC(=O)C cc756f9c41be633c33187cccb11de533 [0,2,0,0,0,0|1,1,0]=4 512 B12R1.77 C=Cc1ccccc1N(C)CC ae2b8a92e7975c44d201387facfe0b22 [0,2,0,0,0,0|2,0,0]=4 513 B12R1.77 CCN(C)c1ccccc1C=O b61af2b44e4bec341cbb42b2de40b6a9 [0,2,0,0,0,0|1,0,0]=3 514 B12R1.77 CCN(C)c1ccncc1C=O aea20da01e08b37dc0bab0afe89d655e [0,2,0,0,0,0|2,0,0]=4 515 B12R1.77 CCN(C)c1ncccc1C=O ed958e38ba483acb4ed536ffcf7b1f2b [0,2,0,0,0,0|2,0,0]=4 516 B12R1.77 CN(C=O)c1ccccc1C#N 71ff76bcf1cbcb15efaff7b4eb5a6015 [0,2,0,0,0,0|2,0,0]=4 517 B12R1.77 CN(C=O)c1ccccc1C=O cd922dbb460fa7d4d1f00b1614a29368 [0,2,0,0,0,0|1,0,0]=3 518 B12R1.77 CN(C=O)c1ccccc1CO 33b9761b76a0ad5428caca9639a49664 [0,2,0,0,0,0|2,0,0]=4 519 B12R1.77 CN(C=O)c1ncccc1C=O bb0e54878ed2e11a5fdc0e169cfdd4bb [0,2,0,0,0,0|2,0,0]=4 520 B12R1.77 CN(CF)c1ccccc1C=O 86f34b36cb4ecb25585e4dc05546e5f9 [0,2,0,0,0,0|1,0,0]=3 521 B12R1.77 CN(CF)c1ncccc1C=O c22e2c48a09ed009cebb6a03f91554c0 [0,2,0,0,0,0|2,0,0]=4 522 B12R1.77 CN(CO)c1ccccc1C=O 3a76e9c26d13fa2ac1247dbdff0b292e [0,2,0,0,0,0|1,0,0]=3 523 B12R1.77 CN(CO)c1ncccc1C=O 908c9694d0aef989c0c9dc15a7549e03 [0,2,0,0,0,0|2,0,0]=4 524 B12R1.77 COc1ccccc1N(C)C=O 4af8c019a4275dbca8d5be3630675a44 [0,2,0,0,0,0|0,0,0]=2 525 B12R1.77 COc1ccccc1N(C)CO b8ccba502c96bb9830d13c6d7f1618df [0,2,0,0,0,0|0,0,2]=4 526 B12R1.77 COc1cncnc1N(C)C=O 712761f138f7158122d7ae4a4a3e590d [0,2,0,0,0,0|2,0,0]=4 527 B12R1.121 C#CCNc1ccccc1C=C 9b712ed329844ec8627c1e74b1a5f78f [0,2,0,0,0,0|2,0,0]=4 528 B12R1.121 C#CCNc1ccccc1C=O 9a47caa30bf3deff9ed83c3c087c43c4 [0,2,0,0,0,0|1,0,0]=3 529 B12R1.121 C#CCNc1ccccc1OC 28aa9f52f04c543983ab6742e09ab50d [0,2,0,0,0,0|1,0,1]=4 530 B12R1.121 C#CCNc1cccnc1C=O cc983f4f24a4e4b6269752295c28b3fb [0,2,0,0,0,0|2,0,0]=4 531 B12R1.121 C#CCNc1ccncc1C=O e32a503b0c2f95cc2a0c4bbb43ce27f3 [0,2,0,0,0,0|2,0,0]=4 532 B12R1.121 C#CCNc1cnccc1C=O f4f4d7c3f2ff4479b1a29f0228912afa [0,2,0,0,0,0|2,0,0]=4 533 B12R1.121 C#CCNc1ncccc1C=O 6ecc90b468a2ac9193153fa51c00a1f2 [0,2,0,0,0,0|2,0,0]=4 534 B12R1.121 C#CCOc1ccccc1C#C 5df4bc9f2aad00ad376af56e364935e0 [0,2,0,0,0,0|1,0,1]=4 535 B12R1.121 C#CCOc1ccccc1C#N fb731f9601fa85f4901559b14cb0fa00 [0,2,0,0,0,0|1,0,1]=4 536 B12R1.121 C#CCOc1ccccc1C=C 1cdb06343037d12721ae34d86a0a1d61 [0,2,0,0,0,0|1,0,0]=3 537 B12R1.121 C#CCOc1ccccc1C=O b73850b7cac830349d784a24350233bc [0,2,0,0,0,0|0,0,0]=2 538 B12R1.121 C#CCOc1ccccc1CC f1e58feffa6c2b56d6ac4bc217a4d6af [0,2,0,0,0,0|1,0,1]=4 539 B12R1.121 C#CCOc1ccccc1OC 696447bf1d8c48d2d8e04e8ce92e791b [0,2,0,0,0,0|1,0,1]=4 540 B12R1.121 C#CCOc1ccccc1SC 6051d74605af6067e5cacb5d5d1b4d71 [0,2,0,0,0,0|2,0,0]=4 541 B12R1.121 C#CCOc1cccnc1C=O 61b2684aa589521db27abad432a5d0a3 [0,2,0,0,0,0|1,0,0]=3 542 B12R1.121 C#CCOc1ccncc1C=O 3afa0dcbeec94090a3da9e0b5bb601a1 [0,2,0,0,0,0|1,0,0]=3 543 B12R1.121 C#CCOc1cnccc1C=O 48b8a8f18455ca54579ef94819e8f18d [0,2,0,0,0,0|1,0,0]=3 544 B12R1.121 C#Cc1ccccc1COCC 3f4d3e90467b2e7bc1cb19fe841f1865 [0,2,0,0,0,0|1,0,1]=4 545 B12R1.121 C#Cc1ccccc1COCF 8246e2b02d2226fd1bb894b64ef4a5c5 [0,2,0,0,0,0|1,0,1]=4 546 B12R1.121 C#Cc1ccccc1NCC=O c1c80b1eb798ed76f35e0285c0f7fc00 [0,2,0,0,0,0|1,0,1]=4 547 B12R1.121 C#Cc1ccccc1NCOC 5fe4ba4cb588520b4743c1f3ec820f18 [0,2,0,0,0,0|1,0,1]=4 548 B12R1.121 C#Cc1ccccc1OCC#N b9dabfdb2725cf08912b4cdc14c4f513 [0,2,0,0,0,0|1,0,1]=4 549 B12R1.121 C#Cc1ccccc1OCC=C cd3b5c4ec27f2f4c66b0816c16637690 [0,2,0,0,0,0|1,0,1]=4 550 B12R1.121 C#Cc1ccccc1OCC=O 937fef7b042a4b25d67632cea250d71b [0,2,0,0,0,0|1,0,1]=4 551 B12R1.121 C#Cc1ccccc1OCCC a4f7d5986feb93828e0ed01e136164da [0,2,0,0,0,0|1,0,1]=4 552 B12R1.121 C#Cc1ccccc1OCCF 0c12bc2befb14bee69e766e51e95a810 [0,2,0,0,0,0|1,0,1]=4 553 B12R1.121 C#Cc1ccccc1OCCS 3550bca538d993c578484f12801e7060 [0,2,0,0,0,0|1,0,1]=4 554 B12R1.121 C#Cc1ccccc1OCOC ee47023b58d47b3f17fe6228233fb042 [0,2,0,0,0,0|1,0,1]=4 555 B12R1.121 C#Cc1ccccc1OCSC 0a79cca06adb122558107c8b3fd5173d [0,2,0,0,0,0|1,0,1]=4 556 B12R1.121 C=CCNc1ccccc1C=C af8b0acc3d0214f2d6465b68d4a2bf7a [0,2,0,0,0,0|2,0,0]=4 557 B12R1.121 C=CCNc1ccccc1C=O ff95dab245d21298d6e93bd4c9f1507b [0,2,0,0,0,0|1,0,0]=3 558 B12R1.121 C=CCNc1ccccc1CC 99242fc7c6e82bf858e087ff7ebaf822 [0,2,0,0,0,0|2,0,0]=4 559 B12R1.121 C=CCNc1ccccc1OC 600c4864e94814f923ef363b0890136b [0,2,0,0,0,0|1,0,0]=3 560 B12R1.121 C=CCNc1ccccc1SC 08265587cdfe269c75e001e24f24dc5f [0,2,0,0,0,0|1,1,0]=4 561 B12R1.121 C=CCNc1cccnc1C=O 415a979b1d28114bb9616e08a4398304 [0,2,0,0,0,0|2,0,0]=4 562 B12R1.121 C=CCNc1cccnc1OC a110e9955e8756fe4ad5e8607c92389e [0,2,0,0,0,0|2,0,0]=4 563 B12R1.121 C=CCNc1ccncc1C=O 4fc49ee5e1211939803129b1711a2b6a [0,2,0,0,0,0|2,0,0]=4 564 B12R1.121 C=CCNc1ccncc1OC 995837b44dfff58cac460314605353ad [0,2,0,0,0,0|2,0,0]=4 565 B12R1.121 C=CCNc1cnccc1C=O 3b49c9c87af72150a127f9678756dcd0 [0,2,0,0,0,0|2,0,0]=4 566 B12R1.121 C=CCNc1cnccc1OC c3f9114644663a91428c5f544ef0c569 [0,2,0,0,0,0|2,0,0]=4 567 B12R1.121 C=CCNc1ncccc1C=O c9ee7de4016d0729690689f5815e2a27 [0,2,0,0,0,0|2,0,0]=4 568 B12R1.121 C=CCNc1ncccc1OC cd041acd5853e7f119afbfad979f5849 [0,2,0,0,0,0|2,0,0]=4 569 B12R1.121 C=CCOc1ccccc1C#N d4854660595e47082b0694b7332f762a [0,2,0,0,0,0|1,0,1]=4 570 B12R1.121 C=CCOc1ccccc1C=C f6802d0f81b09587f57ddefc2e299dc1 [0,2,0,0,0,0|1,0,0]=3 571 B12R1.121 C=CCOc1ccccc1C=O b6f8c953eab593fe0ac3822ccd2698a7 [0,2,0,0,0,0|0,0,0]=2 572 B12R1.121 C=CCOc1ccccc1CC 33bab0a8ab5a5f1e40fe6bb0d8268a53 [0,2,0,0,0,0|1,0,1]=4 573 B12R1.121 C=CCOc1ccccc1OC 0923a765e34f8c98d85221c0e78732aa [0,2,0,0,0,0|1,0,0]=3 574 B12R1.121 C=CCOc1ccccc1SC a01e04ff8e11bff58b2cde874231c8d3 [0,2,0,0,0,0|1,1,0]=4 575 B12R1.121 C=CCOc1cccnc1C=O 9f00a8cdd4c857fd83f6c0a594d4ae06 [0,2,0,0,0,0|1,0,0]=3 576 B12R1.121 C=CCOc1cccnc1OC 2309b4554d588cedf505f76304e349c0 [0,2,0,0,0,0|2,0,0]=4 577 B12R1.121 C=CCOc1ccncc1C=O 3f990086ca2976246ab140ab9ccc32a7 [0,2,0,0,0,0|1,0,0]=3 578 B12R1.121 C=CCOc1ccncc1OC 8517ef26bff3661517df2f50ecb0dc6e [0,2,0,0,0,0|2,0,0]=4 579 B12R1.121 C=CCOc1cnccc1C=O 78b97203d8a93f78601e01c4c0022909 [0,2,0,0,0,0|1,0,0]=3 580 B12R1.121 C=CCOc1cnccc1OC e2d5d301e3f5ebbddfd09d59d63f713a [0,2,0,0,0,0|2,0,0]=4 581 B12R1.121 C=Cc1ccccc1COCC 450d58f9aa08ac26b17a63c03dda207e [0,2,0,0,0,0|1,0,0]=3 582 B12R1.121 C=Cc1ccccc1COCF 068f9fabb51d683d92e1110a3e9a89c1 [0,2,0,0,0,0|1,0,0]=3 583 B12R1.121 C=Cc1ccccc1NCC#N aaee5b9ee4a3d4994ba91d5f129ac696 [0,2,0,0,0,0|2,0,0]=4 584 B12R1.121 C=Cc1ccccc1NCC=O b5d95046fdd2b1da912a39101d8d89da [0,2,0,0,0,0|1,0,1]=4 585 B12R1.121 C=Cc1ccccc1NCCBr be7a417011cb37a17687bc150752a587 [0,2,0,0,0,0|2,0,0]=4 586 B12R1.121 C=Cc1ccccc1NCCC 393733931c90fefa8f24f7aff42f74b7 [0,2,0,0,0,0|2,0,0]=4 587 B12R1.121 C=Cc1ccccc1NCCF c016956e97db15ff1da01120a08088f5 [0,2,0,0,0,0|2,0,0]=4 588 B12R1.121 C=Cc1ccccc1NCCI eeea14b5a6d44cb77fa2c5a8428c2d09 [0,2,0,0,0,0|2,0,0]=4 589 B12R1.121 C=Cc1ccccc1NCCO dec5f70e08194b4940ff6fa7dc3b9ff6 [0,2,0,0,0,0|2,0,0]=4 590 B12R1.121 C=Cc1ccccc1NCCS 987e6bf054c6313875b5ba27f6fd1476 [0,2,0,0,0,0|2,0,0]=4 591 B12R1.121 C=Cc1ccccc1NCOC 29412ee07e90b4fc64aa7c39016304f5 [0,2,0,0,0,0|1,0,0]=3 592 B12R1.121 C=Cc1ccccc1NCSC b178866127f76af53989981ecd9b9ef2 [0,2,0,0,0,0|1,1,0]=4 593 B12R1.121 C=Cc1ccccc1OCC#N 76b4bb3e7963b40996ad8943e258316c [0,2,0,0,0,0|1,0,0]=3 594 B12R1.121 C=Cc1ccccc1OCC=O f298e760762b6efc8ae8e3e300ab6bd5 [0,2,0,0,0,0|1,0,0]=3 595 B12R1.121 C=Cc1ccccc1OCCC d64cceb48d34bd593308e20fdb8200e9 [0,2,0,0,0,0|1,0,0]=3 596 B12R1.121 C=Cc1ccccc1OCCF 481723a34629b3821419aaa1a63c2695 [0,2,0,0,0,0|1,0,0]=3 597 B12R1.121 C=Cc1ccccc1OCCS f5bb2bfe91adbbd3b74ef63cb8f1eadf [0,2,0,0,0,0|1,0,0]=3 598 B12R1.121 C=Cc1ccccc1OCOC abc36c026478894e162a6fe06b17f2c2 [0,2,0,0,0,0|1,0,0]=3 599 B12R1.121 C=Cc1ccccc1OCSC d09fb02750a7673eed0c9edbef0f6056 [0,2,0,0,0,0|1,0,0]=3 600 B12R1.121 C=Cc1ncccc1NCOC bc5389daf8ae46056396d51a3a95bf60 [0,2,0,0,0,0|2,0,0]=4 601 B12R1.121 CCCNc1ccccc1C=O d39fa7b2696866eb4a1bc9c52327bd08 [0,2,0,0,0,0|1,0,0]=3 602 B12R1.121 CCCNc1ccccc1OC d2dcbfb7fdcae7a60fb5172054dc4ef1 [0,2,0,0,0,0|1,0,1]=4 603 B12R1.121 CCCNc1cccnc1C=O cf2670c0134220a4485e07be063a4c25 [0,2,0,0,0,0|2,0,0]=4 604 B12R1.121 CCCNc1ccncc1C=O e4c99fc4310e6130c531d5e68a64fbbd [0,2,0,0,0,0|2,0,0]=4 605 B12R1.121 CCCNc1cnccc1C=O 8a5cbff61a238f6142b0a5364a82812b [0,2,0,0,0,0|2,0,0]=4 606 B12R1.121 CCCNc1ncccc1C=O 34e8f7ec9231ec60a7b4ff1563d2cf4c [0,2,0,0,0,0|2,0,0]=4 607 B12R1.121 CCCOc1ccccc1C#N 5839737f2357762bfdd93be09ee4484c [0,2,0,0,0,0|1,0,1]=4 608 B12R1.121 CCCOc1ccccc1C=O 96e764f50eca112b9923d943250c3345 [0,2,0,0,0,0|0,0,0]=2 609 B12R1.121 CCCOc1ccccc1CC 0fb4b6e8cb3dd80fa6a8ce889b16416b [0,2,0,0,0,0|1,0,1]=4 610 B12R1.121 CCCOc1ccccc1OC e1a8f477385f7131998a3a6295c0d0ee [0,2,0,0,0,0|1,0,1]=4 611 B12R1.121 CCCOc1ccccc1SC b2283a47a3ea4715fd2e4736f48b48da [0,2,0,0,0,0|2,0,0]=4 612 B12R1.121 CCCOc1cccnc1C=O 476cf7a734c7147eeb57e8bc428a0de5 [0,2,0,0,0,0|1,0,0]=3 613 B12R1.121 CCCOc1ccncc1C=O 23c98526fac210dbc6700040d7c46724 [0,2,0,0,0,0|1,0,0]=3 614 B12R1.121 CCCOc1cnccc1C=O fb9e1832b2044ba0cf899fa70dcba334 [0,2,0,0,0,0|1,0,0]=3 615 B12R1.121 CCNCc1ccccc1OC c267ee69e078172dcb8af018da305189 [0,2,0,0,0,0|1,0,1]=4 616 B12R1.121 CCOCc1ccccc1C#N a7dce0509c7ec48871f6c0ac5628c2e6 [0,2,0,0,0,0|1,0,1]=4 617 B12R1.121 CCOCc1ccccc1CC aae357a9f1ec25325b62c78eca4b1963 [0,2,0,0,0,0|1,0,1]=4 618 B12R1.121 CCOCc1ccccc1OC 5bb7bbe2e4f0450c635782da56d7e647 [0,2,0,0,0,0|0,0,2]=4 619 B12R1.121 CCOCc1ccccc1SC cea9660c927d54e423fd0e4fd560b596 [0,2,0,0,0,0|2,0,0]=4 620 B12R1.121 CCc1ccccc1CNC=O 29166ffbb7ca4dcf8eb359a7163d5d9f [0,2,0,0,0,0|1,0,0]=3 621 B12R1.121 CCc1ccccc1COCF 657925cbdb2285a5cc93e430027ca6cb [0,2,0,0,0,0|1,0,1]=4 622 B12R1.121 CCc1ccccc1NCC=O 3da968cc471f7515b7e0b02e1bf1150a [0,2,0,0,0,0|1,0,0]=3 623 B12R1.121 CCc1ccccc1NCOC 042eeb269b0df618d7d6f2598cc467bb [0,2,0,0,0,0|1,0,1]=4 624 B12R1.121 CCc1ccccc1OCC#N 5d0cbbdb0f7fe7476d493b3cadfd7f3f [0,2,0,0,0,0|1,0,1]=4 625 B12R1.121 CCc1ccccc1OCC=O d5e0a1e22e40189a133c48dd5e8e663c [0,2,0,0,0,0|1,0,0]=3 626 B12R1.121 CCc1ccccc1OCCF 5e0b23e59a8e77c1d232b20601cc9a53 [0,2,0,0,0,0|1,0,1]=4 627 B12R1.121 CCc1ccccc1OCCS b9fb2c7fcb11b63a00396449bae4fae7 [0,2,0,0,0,0|1,0,1]=4 628 B12R1.121 CCc1ccccc1OCSC 83fd1085b2fcaac32032fa7856c32ad2 [0,2,0,0,0,0|1,0,1]=4 629 B12R1.121 CCc1cccnc1NCC=O 66e34a0f9e6d9d8f723aae30375425ea [0,2,0,0,0,0|2,0,0]=4 630 B12R1.121 CCc1cccnc1OCC=O 26651c6be7121c3d45cfe0fb394ab38a [0,2,0,0,0,0|2,0,0]=4 631 B12R1.121 CCc1ccncc1OCC=O 70f1986e41979f3bedc3ef28309c7e20 [0,2,0,0,0,0|2,0,0]=4 632 B12R1.121 CCc1ncccc1NCC=O 5356c3b5e83375c08fdd261d477d80a8 [0,2,0,0,0,0|2,0,0]=4 633 B12R1.121 CCc1ncccc1OCC=O d6aeab300326c687550621a6aa604f3d [0,2,0,0,0,0|2,0,0]=4 634 B12R1.121 COCNc1ccccc1C#N efc6352fd36baa83e43a9df80b51f0f3 [0,2,0,0,0,0|1,0,1]=4 635 B12R1.121 COCNc1ccccc1C=O 70afd880ba2765b002a0d595de24b5bd [0,2,0,0,0,0|0,0,0]=2 636 B12R1.121 COCNc1ccccc1CBr c6e5ba88c62ec4d8b10e4b35b95f9f6c [0,2,0,0,0,0|1,0,1]=4 637 B12R1.121 COCNc1ccccc1CO fd0275a8af8afb8428d4cb054d68dcf3 [0,2,0,0,0,0|0,0,2]=4 638 B12R1.121 COCNc1ccccc1CS 7dd8b18041eeb88a6084cb8265ff173d [0,2,0,0,0,0|0,1,1]=4 639 B12R1.121 COCNc1ccccc1OC 86db96cbb2aeddf567e03b2d683c3a70 [0,2,0,0,0,0|0,0,2]=4 640 B12R1.121 COCNc1ccccc1SC 0b55bcd8f1dccc2689b2725b902d7db3 [0,2,0,0,0,0|2,0,0]=4 641 B12R1.121 COCNc1cccnc1C=O 1dcdbf0985212609235fbf1bf028c8d6 [0,2,0,0,0,0|1,0,0]=3 642 B12R1.121 COCNc1ccncc1C=O 08787fb60db1e8f1f7084dd3aee3ac81 [0,2,0,0,0,0|1,0,0]=3 643 B12R1.121 COCNc1cnccc1C=O d87f0481e0e9bade6a6b4864da828178 [0,2,0,0,0,0|1,0,0]=3 644 B12R1.121 COCNc1cncnc1C=O ce3d55e441073064573363ff17afe040 [0,2,0,0,0,0|2,0,0]=4 645 B12R1.121 COCNc1ncccc1C=O 083dd5dec5554be96a261e4bfbdad267 [0,2,0,0,0,0|1,0,0]=3 646 B12R1.121 COCNc1nccnc1C=O 732f803c955fb3376269c718c547a798 [0,2,0,0,0,0|2,0,0]=4 647 B12R1.121 COCNc1ncncc1C=O a61c715cd5f4ec1648d476ee8d324301 [0,2,0,0,0,0|2,0,0]=4 648 B12R1.121 COCOc1ccccc1C#N cc8f6685dbcd8980d43bef8fec8601e2 [0,2,0,0,0,0|1,0,1]=4 649 B12R1.121 COCOc1ccccc1C=O f735e2f3f525a620387fbe462a72b8d7 [0,2,0,0,0,0|0,0,0]=2 650 B12R1.121 COCOc1ccccc1OC 8016083eed1bdc26c60f5c3b50822424 [0,2,0,0,0,0|0,0,2]=4 651 B12R1.121 COCOc1ccccc1SC 2ed2b7b33a8d11d5841fc80be08be58f [0,2,0,0,0,0|2,0,0]=4 652 B12R1.121 COCOc1cccnc1C=O 0b0f7d05bc9c165fbc0be5fa5f87a1c9 [0,2,0,0,0,0|1,0,0]=3 653 B12R1.121 COCOc1ccncc1C=O 2963b08c51c466b80124b0b7ed5ff0d8 [0,2,0,0,0,0|1,0,0]=3 654 B12R1.121 COCOc1cnccc1C=O e5e9371e2e088ff39c7f8bef6748fdcc [0,2,0,0,0,0|1,0,0]=3 655 B12R1.121 COc1ccccc1CNC#N 29bba104561676de565e58f1a7527f68 [0,2,0,0,0,0|1,0,1]=4 656 B12R1.121 COc1ccccc1CNC=O 9bd7444e584abb076dc91bbd9538283a [0,2,0,0,0,0|0,0,0]=2 657 B12R1.121 COc1ccccc1CNCF 50419350685bc850fbb3495175568c8a [0,2,0,0,0,0|1,0,1]=4 658 B12R1.121 COc1ccccc1CNCO 34f4426dd7db36c67f879aa2b90e6c86 [0,2,0,0,0,0|0,0,2]=4 659 B12R1.121 COc1ccccc1COCF d9d945265660f30b4d06ff39656c8df6 [0,2,0,0,0,0|0,0,2]=4 660 B12R1.121 COc1ccccc1NCC#N 001851d71bf92d88a1ae089c6885bc6a [0,2,0,0,0,0|1,0,1]=4 661 B12R1.121 COc1ccccc1NCC=O 24b9d9a449709e0dee4c80f4be1d0b13 [0,2,0,0,0,0|0,0,0]=2 662 B12R1.121 COc1ccccc1NCCF d489ad0b0b8a3fe9fb1e65f15e818344 [0,2,0,0,0,0|1,0,1]=4 663 B12R1.121 COc1ccccc1NCCO ac556398a45591da6bb76b6a5b37f457 [0,2,0,0,0,0|0,0,2]=4 664 B12R1.121 COc1ccccc1NCCS ba0119d07914fb0e11741681ec8bb375 [0,2,0,0,0,0|0,1,1]=4 665 B12R1.121 COc1ccccc1OCC#N 7f82ecc9a7b9d117fb611bb769306c5d [0,2,0,0,0,0|1,0,1]=4 666 B12R1.121 COc1ccccc1OCC=O 281f7dac8840c1b7a8fcb5fd40bc3417 [0,2,0,0,0,0|0,0,0]=2 667 B12R1.121 COc1ccccc1OCCS 6519eac93f874a8614a651992d96eeb0 [0,2,0,0,0,0|0,1,1]=4 668 B12R1.121 COc1ccccc1OCSC 6f79e6b6a8b0b9409aba7319297e6c30 [0,2,0,0,0,0|0,1,1]=4 669 B12R1.121 COc1cccnc1CNC=O ac11f5c97c50dfbc57bfe8d8911621af [0,2,0,0,0,0|1,0,0]=3 670 B12R1.121 COc1cccnc1NCC=O cc38a8bcbb448881c9d5210b46334e76 [0,2,0,0,0,0|1,0,0]=3 671 B12R1.121 COc1ccncc1NCC=O ea324a72c042ebd612c82aa38ccb0aa1 [0,2,0,0,0,0|1,0,0]=3 672 B12R1.121 COc1ccncc1OCC=O d80375eb2e22047db1e828a1fe6b81d8 [0,2,0,0,0,0|1,0,0]=3 673 B12R1.121 COc1cnccc1CNC=O 4839cb95c1c3825f25c5f1f97401eb42 [0,2,0,0,0,0|1,0,0]=3 674 B12R1.121 COc1cnccc1NCC=O e4eb09a78055ccd8885e2d3c05241160 [0,2,0,0,0,0|1,0,0]=3 675 B12R1.121 COc1cnccc1OCC=O 9946084a4c371d763dd14a37afad5a62 [0,2,0,0,0,0|1,0,0]=3 676 B12R1.121 COc1cncnc1NCC=O 73a07920848f1a902dd560b2ea1c46a4 [0,2,0,0,0,0|2,0,0]=4 677 B12R1.121 COc1ncccc1CNC=O b4ae057f68e3b8242025c2b16640b6a3 [0,2,0,0,0,0|1,0,0]=3 678 B12R1.121 COc1ncccc1NCC=O 7519b01dfb01f747c74667554aa8b7d7 [0,2,0,0,0,0|1,0,0]=3 679 B12R1.121 COc1ncccc1OCC=O 1a128e9bc4b1d1efed48addcf51eb70d [0,2,0,0,0,0|1,0,0]=3 680 B12R1.121 COc1nccnc1CNC=O 2f976ce3adfc5db74d5f732032188361 [0,2,0,0,0,0|2,0,0]=4 681 B12R1.121 COc1nccnc1NCC=O 0116e4d69acee5c5ac712e4b94382523 [0,2,0,0,0,0|2,0,0]=4 682 B12R1.121 COc1ncncc1NCC=O 8ec0164a6e51f4fa22f8aadf2bfe992d [0,2,0,0,0,0|2,0,0]=4 683 B12R1.121 COc1nnccc1NCC=O c807307d3fab0bf92b1a5076673f1811 [0,2,0,0,0,0|2,0,0]=4 684 B12R1.121 CSCNc1ccccc1C=O ca4fc5441f1db2d061e35da97d20fe96 [0,2,0,0,0,0|0,1,0]=3 685 B12R1.121 CSCNc1cccnc1C=O a6a9944f49358554da4f740e3ed06c6d [0,2,0,0,0,0|1,1,0]=4 686 B12R1.121 CSCNc1ccncc1C=O 025fe7b1f9f31487275aeabcbe214b40 [0,2,0,0,0,0|1,1,0]=4 687 B12R1.121 CSCNc1cnccc1C=O 55a319779e4cd8c56a2a4f4a083b7a9d [0,2,0,0,0,0|1,1,0]=4 688 B12R1.121 CSCNc1ncccc1C=O 9d2b143055728604e2136e3d991aae5a [0,2,0,0,0,0|1,1,0]=4 689 B12R1.121 CSCOc1ccccc1C#N 8038f85266719812f20e65f1d3cb2290 [0,2,0,0,0,0|1,0,1]=4 690 B12R1.121 CSCOc1ccccc1C=O 3a3adafb01ffc02caa6ffe802d0fd229 [0,2,0,0,0,0|0,0,0]=2 691 B12R1.121 CSCOc1ccccc1SC c9916d7b3422d2ac3675f18dfeae3624 [0,2,0,0,0,0|2,0,0]=4 692 B12R1.121 CSCOc1cccnc1C=O 948356936a232e4a49ded24b7808b60f [0,2,0,0,0,0|1,0,0]=3 693 B12R1.121 CSCOc1ccncc1C=O a4e62fc4c56189ed24e8565bd8d733a5 [0,2,0,0,0,0|1,0,0]=3 694 B12R1.121 CSCOc1cnccc1C=O b5485d27f28fff7a741130de2e531bb2 [0,2,0,0,0,0|1,0,0]=3 695 B12R1.121 CSc1ccccc1CNC=O 960ae67e0e16bc546b90ff7b3be670cc [0,2,0,0,0,0|0,1,0]=3 696 B12R1.121 CSc1ccccc1COCF dccafa330f719f5f1a0f27f4f85cff46 [0,2,0,0,0,0|2,0,0]=4 697 B12R1.121 CSc1ccccc1NCC=O e53615a1b49e651c03aede4c49403c9e [0,2,0,0,0,0|0,1,0]=3 698 B12R1.121 CSc1ccccc1OCC#N 0d84c1ccbb7418602bdcb880778c7e92 [0,2,0,0,0,0|2,0,0]=4 699 B12R1.121 CSc1ccccc1OCC=O 175e3529ee8a056454894094294bb1dc [0,2,0,0,0,0|0,1,0]=3 700 B12R1.121 CSc1ccccc1OCCF 1b6ade813984679c483d381bd4f418ed [0,2,0,0,0,0|2,0,0]=4 701 B12R1.121 CSc1ccccc1OCCS 179e3fad5f6722ac83c96cd98b6fe486 [0,2,0,0,0,0|2,0,0]=4 702 B12R1.121 CSc1cccnc1NCC=O e25ef4158454655e5ecaf05bab24ad8b [0,2,0,0,0,0|1,1,0]=4 703 B12R1.121 CSc1cnccc1NCC=O 97bbfcf19d79cb2f23538af323758508 [0,2,0,0,0,0|1,1,0]=4 704 B12R1.121 N#CCNc1ccccc1C=O b0ad3a91a8b64c6e54553f4e89298599 [0,2,0,0,0,0|1,0,0]=3 705 B12R1.121 N#CCNc1cccnc1C=O a51ee64d822886adc29d119834e58a26 [0,2,0,0,0,0|2,0,0]=4 706 B12R1.121 N#CCNc1ccncc1C=O a1c6436a856b8f7621e2b6f5159bee96 [0,2,0,0,0,0|2,0,0]=4 707 B12R1.121 N#CCNc1cnccc1C=O c3dfdea58431f03052a94c106d97337a [0,2,0,0,0,0|2,0,0]=4 708 B12R1.121 N#CCNc1ncccc1C=O a61ae96640f007f53e1897ed21744ef4 [0,2,0,0,0,0|2,0,0]=4 709 B12R1.121 N#CCOc1ccccc1C#N 10e8ea8c5d7fb70b5dec9b8644fd96fa [0,2,0,0,0,0|1,0,1]=4 710 B12R1.121 N#CCOc1ccccc1C=O 4b138a5abddc277730c129328dedf3a3 [0,2,0,0,0,0|0,0,0]=2 711 B12R1.121 N#CCOc1cccnc1C=O 38a1a149c9526ff51dd2f325928ef4af [0,2,0,0,0,0|1,0,0]=3 712 B12R1.121 N#CCOc1ccncc1C=O dffc0b8fd049c0a03dbc06d6089d10ec [0,2,0,0,0,0|1,0,0]=3 713 B12R1.121 N#CCOc1cnccc1C=O 052142c962b795a342151faa78244696 [0,2,0,0,0,0|1,0,0]=3 714 B12R1.121 N#CNCc1ccccc1C=O 4aa9e0d7dacb835627d23d6fefa2363c [0,2,0,0,0,0|1,0,1]=4 715 B12R1.121 N#Cc1ccccc1CNC=O 1f451a9328c29491f75e2fb63e15fea7 [0,2,0,0,0,0|2,0,0]=4 716 B12R1.121 N#Cc1ccccc1COCF aaacd1bda808abf7eacc26ba1b690a17 [0,2,0,0,0,0|1,0,1]=4 717 B12R1.121 N#Cc1ccccc1NCC=O d4612fe3a5230b534049190dc54df43d [0,2,0,0,0,0|2,0,0]=4 718 B12R1.121 N#Cc1ccccc1OCC=O f82379a041ec6d1a29aa10f27d58f140 [0,2,0,0,0,0|1,0,1]=4 719 B12R1.121 N#Cc1ccccc1OCCF 28cac85c4400cae85ab589fff2b616e7 [0,2,0,0,0,0|1,0,1]=4 720 B12R1.121 N#Cc1ccccc1OCCS 137dfdbb63490e18a2798080cc26a9af [0,2,0,0,0,0|1,0,1]=4 721 B12R1.121 O=CCNc1ccccc1C=O 5ef6d185752fca8620198bb10b6b54a2 [0,2,0,0,0,0|1,0,0]=3 722 B12R1.121 O=CCNc1ccccc1CBr ee3d250a626aa202e0e6e7d928f95dcf [0,2,0,0,0,0|2,0,0]=4 723 B12R1.121 O=CCNc1ccccc1CO 4dac89f1d8dbd1354f77950c817e5cc8 [0,2,0,0,0,0|2,0,0]=4 724 B12R1.121 O=CCNc1ccccc1CS 2eb7dee656c98a5fe01d76c9dd58c6fd [0,2,0,0,0,0|2,0,0]=4 725 B12R1.121 O=CCNc1cccnc1C=O 0a703325a9d83184f1cc39c576ef9c4d [0,2,0,0,0,0|2,0,0]=4 726 B12R1.121 O=CCNc1ccncc1C=O 8499966f4dc5c8355450ea2d9d569ecc [0,2,0,0,0,0|2,0,0]=4 727 B12R1.121 O=CCNc1cnccc1C=O 5970b0ab975050ea18bdedc561c4f44c [0,2,0,0,0,0|2,0,0]=4 728 B12R1.121 O=CCNc1ncccc1C=O e17e7a75ee6c4a2a69bf5eaaa7c0d384 [0,2,0,0,0,0|2,0,0]=4 729 B12R1.121 O=CCOc1ccccc1C=O 87118b40169471413eb87c9f5d61c028 [0,2,0,0,0,0|0,0,0]=2 730 B12R1.121 O=CCOc1cccnc1C=O 495b55a613d76840d370cf86f5730199 [0,2,0,0,0,0|1,0,0]=3 731 B12R1.121 O=CCOc1ccncc1C=O 58286a319c91f1dcad974e4cc2c1ddfb [0,2,0,0,0,0|1,0,0]=3 732 B12R1.121 O=CCOc1cnccc1C=O b8ff5e11408e3b4cf25df3ef82337bf7 [0,2,0,0,0,0|1,0,0]=3 733 B12R1.121 O=CNCc1ccccc1CO 6d04f0839dae8005847214a5a977ed36 [0,2,0,0,0,0|2,0,0]=4 734 B12R1.121 O=Cc1ccccc1NCCBr ee692c847ba8c4c45e74090cf9edf291 [0,2,0,0,0,0|1,0,0]=3 735 B12R1.121 O=Cc1ccccc1NCCF 9c97b534dbd28733ca8877d841254240 [0,2,0,0,0,0|1,0,0]=3 736 B12R1.121 O=Cc1ccccc1NCCO 80ed5c955f6e50322fba50849bd20ac1 [0,2,0,0,0,0|1,0,0]=3 737 B12R1.121 O=Cc1ccccc1NCCS 2bac830f5ec31ce8d54dc22d90d9c870 [0,2,0,0,0,0|1,0,0]=3 738 B12R1.121 O=Cc1ccccc1OCCF 65163197d55b21043ccdfdb992a3a53d [0,2,0,0,0,0|0,0,0]=2 739 B12R1.121 O=Cc1ccccc1OCCS 6beb11d9e2cf59082b859f20c74bc0f0 [0,2,0,0,0,0|0,0,0]=2 740 B12R1.121 O=Cc1cccnc1NCCBr 1d060666d08e30e67bb1034ac7c6a423 [0,2,0,0,0,0|2,0,0]=4 741 B12R1.121 O=Cc1cccnc1NCCF 70fe74fe30bc53463a4d1ac7af5f0863 [0,2,0,0,0,0|2,0,0]=4 742 B12R1.121 O=Cc1cccnc1NCCI 2d354dd0f0fae0c2021c66c015123394 [0,2,0,0,0,0|2,0,0]=4 743 B12R1.121 O=Cc1cccnc1NCCO cda26d9d09b6cbe9761c61a3a26bf121 [0,2,0,0,0,0|2,0,0]=4 744 B12R1.121 O=Cc1cccnc1NCCS 0658bad9b3c70d6c384710906e351571 [0,2,0,0,0,0|2,0,0]=4 745 B12R1.121 O=Cc1ccncc1NCCF 63601223244f8d97f765708a1a2a92d1 [0,2,0,0,0,0|2,0,0]=4 746 B12R1.121 O=Cc1ccncc1NCCO 5b9a12b398b78bd7ff1f172d90b4d29b [0,2,0,0,0,0|2,0,0]=4 747 B12R1.121 O=Cc1ccncc1NCCS ccc853b890938bf6ebefa4e894655489 [0,2,0,0,0,0|2,0,0]=4 748 B12R1.121 O=Cc1ccncc1OCCF bdb7888a901126c53c7bcf7ad572a0c4 [0,2,0,0,0,0|1,0,0]=3 749 B12R1.121 O=Cc1ccncc1OCCS ac575403c4ce3aa893a68eacdd4855d2 [0,2,0,0,0,0|1,0,0]=3 750 B12R1.121 O=Cc1cnccc1NCCF 3f866ed674baa26e0d19fd4346d868df [0,2,0,0,0,0|2,0,0]=4 751 B12R1.121 O=Cc1cnccc1NCCO 9cc884630fb8f303a40fd72ad5025e2a [0,2,0,0,0,0|2,0,0]=4 752 B12R1.121 O=Cc1cnccc1NCCS f7d8fef5efa06755c2bd0e5e175db489 [0,2,0,0,0,0|2,0,0]=4 753 B12R1.121 O=Cc1cnccc1OCCF 31f562d04941a94337364a26e463024c [0,2,0,0,0,0|1,0,0]=3 754 B12R1.121 O=Cc1cnccc1OCCS 48de079113f1ba854de60cfde3612eb6 [0,2,0,0,0,0|1,0,0]=3 755 B12R1.121 O=Cc1ncccc1NCCF 19bbd6d08a66edb4997f16ca9e8cd911 [0,2,0,0,0,0|2,0,0]=4 756 B12R1.121 O=Cc1ncccc1NCCO c3753a4107c5594bce3b07696eaebcce [0,2,0,0,0,0|2,0,0]=4 757 B12R1.121 O=Cc1ncccc1NCCS ce59af5f75fe9a3fb1d220a246947e09 [0,2,0,0,0,0|2,0,0]=4 758 B12R1.121 O=Cc1ncccc1OCCF 7fcd67652c348f6cf2c30c63cdd7f1e4 [0,2,0,0,0,0|1,0,0]=3 759 B12R1.121 O=Cc1ncccc1OCCS f1160917910d5942a13d85b80beaa462 [0,2,0,0,0,0|1,0,0]=3 760 B12R1.169 C/C=C/c1ccccc1OCC c554b6786a2d8bcd2751f78b45e76eca [0,2,0,0,0,0|1,0,0]=3 761 B12R1.169 C/C=C/c1ccccc1OCF c985106dab80d92f60de0b2fa9f000ec [0,2,0,0,0,0|1,0,0]=3 762 B12R1.169 C=CCc1ccccc1OCC 8b8d3fd5897fef7ace6755f2ee256c29 [0,2,0,0,0,0|1,0,0]=3 763 B12R1.169 C=CCc1ccccc1OCF b32600658f815e6709129498fa29a90f [0,2,0,0,0,0|1,0,0]=3 764 B12R1.169 CCCc1ccccc1NC=O d0d61eaa4bed105faa2f766e8da0842f [0,2,0,0,0,0|1,0,0]=3 765 B12R1.169 CCCc1ccccc1OCC 0c51353843a67f92765b9753c74a7d56 [0,2,0,0,0,0|1,0,1]=4 766 B12R1.169 CCCc1ccccc1OCF 243a27342a4359a34cc76f8ca2feb342 [0,2,0,0,0,0|1,0,1]=4 767 B12R1.169 CCNc1ccccc1COC 43b65a30e9c3f8fee0af684c99ddc186 [0,2,0,0,0,0|1,0,1]=4 768 B12R1.169 CCNc1ccccc1OCC 7013a76d7fe32d0db81451f52e4aca4b [0,2,0,0,0,0|1,0,1]=4 769 B12R1.169 CCOc1ccccc1CC#N 7e252d3add15c8d6b15b9425aadafe3b [0,2,0,0,0,0|1,0,1]=4 770 B12R1.169 CCOc1ccccc1COC be2316702a410d9188c4af345b824343 [0,2,0,0,0,0|0,0,2]=4 771 B12R1.169 CCOc1ccccc1CSC 05e4ee7b43080569f25ad979c6783e8a [0,2,0,0,0,0|0,1,1]=4 772 B12R1.169 CCOc1ccccc1NC=O adb75588c20ed4f0caaed6b0ec82d3f7 [0,2,0,0,0,0|0,0,0]=2 773 B12R1.169 CCOc1ccccc1NCF 6c3249a83f09f3f96ea5af3d353f4bab [0,2,0,0,0,0|1,0,1]=4 774 B12R1.169 CCOc1ccccc1OCC d9f7a91f46ee83059e52140d7976de21 [0,2,0,0,0,0|1,0,1]=4 775 B12R1.169 CCOc1ccccc1OCF d29a2f482618899382f1d6be9b321a50 [0,2,0,0,0,0|1,0,1]=4 776 B12R1.169 CCOc1ccccc1SCC 0ff17b45dec8453feecef222ca791b7d [0,2,0,0,0,0|1,0,1]=4 777 B12R1.169 CCOc1cccnc1NC=O 6ac02d3cf640175dbf27f7f4f4401429 [0,2,0,0,0,0|1,0,0]=3 778 B12R1.169 CCOc1ccncc1NC=O 536d814e545ecc87347c857cf2e56b49 [0,2,0,0,0,0|1,0,0]=3 779 B12R1.169 CCOc1cnccc1NC=O 5733d835f5a71743405640a25f13785e [0,2,0,0,0,0|1,0,0]=3 780 B12R1.169 CCOc1cncnc1NC=O b95a10d3d5d485ac2d4bbfcc3d0812de [0,2,0,0,0,0|2,0,0]=4 781 B12R1.169 CCOc1ncccc1NC=O 220d1bde392971ffae8b485a7d6ca58f [0,2,0,0,0,0|1,0,0]=3 782 B12R1.169 CCOc1nccnc1NC=O d14b2385db2ef22ad4d8494a586c6376 [0,2,0,0,0,0|2,0,0]=4 783 B12R1.169 CCOc1ncncc1NC=O e0a5d3ded9cbeb571fb83aaca6d1c2fc [0,2,0,0,0,0|2,0,0]=4 784 B12R1.169 CCSc1ccccc1NC=O 93e4101f585f2917407e8437b6aa87db [0,2,0,0,0,0|0,1,0]=3 785 B12R1.169 CCSc1ccccc1OCF c7445e3bbd228748f6a9c6c280b6ce67 [0,2,0,0,0,0|1,0,1]=4 786 B12R1.169 COCc1ccccc1NC=O 9918ce0bba6c2e91682cf8e3da767eec [0,2,0,0,0,0|0,0,0]=2 787 B12R1.169 COCc1ccccc1NCF ab459062601cf33c305c8006dba5ce57 [0,2,0,0,0,0|1,0,1]=4 788 B12R1.169 COCc1ccccc1NCO cb466a9758bf98a13388eb24095a47b6 [0,2,0,0,0,0|0,0,2]=4 789 B12R1.169 COCc1ccccc1OCF f5041bdd47e88504ffd42a709154a02f [0,2,0,0,0,0|0,0,2]=4 790 B12R1.169 CSCc1ccccc1NC=O 5dc941bc643cd192f91097b08a2fd48a [0,2,0,0,0,0|0,1,0]=3 791 B12R1.169 CSCc1ccccc1OCF e4e8c2b6705b73427fd3a6f130664e4c [0,2,0,0,0,0|0,1,1]=4 792 B12R1.169 N#CCc1ccccc1NC=O c4d5fff1cba0abe295cf437a62733c90 [0,2,0,0,0,0|1,0,1]=4 793 B12R1.169 N#CCc1ccccc1OCF 829cbdec3707ac6274190c13b48e86b6 [0,2,0,0,0,0|1,0,1]=4 794 B12R1.169 N#CNc1ccccc1CC=O 9402889e55c40aa0e22131e18099dcca [0,2,0,0,0,0|1,0,1]=4 795 B12R1.169 O=CNc1ccccc1CCO c92dc30b57c13638df27621efe7922c6 [0,2,0,0,0,0|1,0,0]=3 796 B12R1.169 O=CNc1ccncc1CCF 3e5f08729dedd41e32021b12d368b800 [0,2,0,0,0,0|2,0,0]=4 797 B12R1.169 O=CNc1ccncc1CCO d6d9d8e005258ed19e0d406306414d03 [0,2,0,0,0,0|2,0,0]=4 798 B12R1.169 O=CNc1ncccc1CCO 07dab9a9157f25ac801472683fa6cb08 [0,2,0,0,0,0|2,0,0]=4 799 B12R1.283 C=C(C)c1ccccc1NC=O 038325992cb0e480c7830b00c0d215ca [0,2,0,0,0,0|1,0,0]=3 800 B12R1.283 C=C(C)c1ccccc1NCC ea0e505bed19cf1b742d99e81e2a19c1 [0,2,0,0,0,0|2,0,0]=4 801 B12R1.283 C=C(C)c1ccccc1NCO 3d1250da869bdc6ad48e5c2ed6fc95b8 [0,2,0,0,0,0|2,0,0]=4 802 B12R1.283 CC(=O)c1ccccc1NC#N 6b213f3e195624c4f884296dc7c4d64f [0,2,0,0,0,0|1,0,1]=4 803 B12R1.283 CC(=O)c1ccccc1NC=O 65ad97c1be5d66dfc92bd52ddf345d07 [0,2,0,0,0,0|1,0,0]=3 804 B12R1.283 CC(=O)c1ccccc1NCF 1ab72f8578521c110c575d66405b41a2 [0,2,0,0,0,0|1,0,0]=3 805 B12R1.283 CC(=O)c1ccccc1NCO d2e1f2231008fa0aa6673cb43185414d [0,2,0,0,0,0|1,0,0]=3 806 B12R1.283 CC(=O)c1ccccc1OCF 57e0947b71fc32a997b474f3cb66ed64 [0,2,0,0,0,0|0,0,0]=2 807 B12R1.283 CC(=O)c1cccnc1NC=O 6c6ac0ea755743b9bc95e9d6e31eb171 [0,2,0,0,0,0|2,0,0]=4 808 B12R1.283 CC(=O)c1cccnc1NCF c35e4fc64ad0f6c682612db9b36baae5 [0,2,0,0,0,0|2,0,0]=4 809 B12R1.283 CC(=O)c1cccnc1NCO aef6d79ed02160dd4319b2531e0459b1 [0,2,0,0,0,0|2,0,0]=4 810 B12R1.283 CC(=O)c1ccncc1NC=O 33026ed2f39f761a0ea789967cd5d221 [0,2,0,0,0,0|2,0,0]=4 811 B12R1.283 CC(=O)c1ccncc1NCF f727cb388969ea220cd76d1a1e3fd8ed [0,2,0,0,0,0|2,0,0]=4 812 B12R1.283 CC(=O)c1ccncc1NCO 9240a9d17cf684f551f3d38ef25f7e78 [0,2,0,0,0,0|2,0,0]=4 813 B12R1.283 CC(=O)c1ccncc1OCF d0746831fbd351448298f182cfdaff12 [0,2,0,0,0,0|1,0,0]=3 814 B12R1.283 CC(=O)c1cnccc1NC=O 39fcf15fa77b7e5b9311417059e5b0cd [0,2,0,0,0,0|2,0,0]=4 815 B12R1.283 CC(=O)c1cnccc1NCF c616f3751f5aeb895004151b3321e9bb [0,2,0,0,0,0|2,0,0]=4 816 B12R1.283 CC(=O)c1cnccc1NCO 30a52b49b6d0ffb88c46cd5b9d6d76f7 [0,2,0,0,0,0|2,0,0]=4 817 B12R1.283 CC(=O)c1ncccc1NC=O 4d28563199a65e85eed1d49e9310c953 [0,2,0,0,0,0|2,0,0]=4 818 B12R1.283 CC(=O)c1ncccc1NCF 67547632163730f77af206fb9c60d5b8 [0,2,0,0,0,0|2,0,0]=4 819 B12R1.283 CC(=O)c1ncccc1NCO 61c165b8e70519b61a2d5216b4a0c39e [0,2,0,0,0,0|2,0,0]=4 820 B12R1.283 CC(=O)c1ncccc1OCF 965cfc8dfe34eef9a7d9eb7d3794e9e0 [0,2,0,0,0,0|1,0,0]=3 821 B12R1.283 CC(C)c1ccccc1NC=O beeab38b9e7f358931ec6464e28ff581 [0,2,0,0,0,0|1,0,0]=3 822 B12R1.283 CC(C)c1cccnc1NC=O 44d38c528953998964f35f0f6de0b70f [0,2,0,0,0,0|2,0,0]=4 823 B12R1.283 CC(C)c1ccncc1NC=O 72522788d37b9cf3d1dea5d9463540bb [0,2,0,0,0,0|2,0,0]=4 824 B12R1.283 CC(C)c1cnccc1NC=O d878c2d49fb1366e7a482f56b31b13d1 [0,2,0,0,0,0|2,0,0]=4 825 B12R1.283 CC(C)c1ncccc1NC=O ff5594f7b7a976652151e3059c9c8274 [0,2,0,0,0,0|2,0,0]=4 826 B12R1.283 CC(O)c1ccccc1NC=O a4511194fe8bb871cfe710c709b12ca3 [0,2,0,0,0,0|1,0,0]=3 827 B12R1.283 CCNc1ccccc1C(=O)C 70fd1d8c924ed02da7b250b50c87efa2 [0,2,0,0,0,0|1,0,0]=3 828 B12R1.283 CCNc1ccccc1C(=O)N 1926739e42140aaaa1381ff498dce0ea [0,2,0,0,0,0|1,0,0]=3 829 B12R1.283 CCNc1ccccc1C(=S)N 3c6b7df5b2f800d7213516d189a173ee [0,2,0,0,0,0|1,1,0]=4 830 B12R1.283 CCNc1ccccc1S(=O)C eea31bb6479fbda957125f4f29daefac [0,2,0,0,0,0|2,0,0]=4 831 B12R1.283 CCNc1ccccc1[N+](=O)[O-] b210ffceb4721294afb7b7b5e5df16ed [0,2,0,0,0,0|2,0,0]=4 832 B12R1.283 CCNc1cccnc1C(=O)C a302b5ac9f7dca10b1f4e7b92f67cad4 [0,2,0,0,0,0|2,0,0]=4 833 B12R1.283 CCNc1cccnc1C(=O)N 0598b602d8fd5dd0e55e91c7b5787e7b [0,2,0,0,0,0|2,0,0]=4 834 B12R1.283 CCNc1cccnc1C(=O)O dc915199c0e30814045c51f5f9d2cdac [0,2,0,0,0,0|2,0,0]=4 835 B12R1.283 CCNc1ccncc1C(=O)C 1bb8292919ccdda1d4c5d2effd59dd23 [0,2,0,0,0,0|2,0,0]=4 836 B12R1.283 CCNc1ccncc1C(=O)N b76ee50bd8bb4e379e724e9668603f3f [0,2,0,0,0,0|2,0,0]=4 837 B12R1.283 CCNc1ccncc1C(=O)O b1248b142e3558208eecd69c94c2419a [0,2,0,0,0,0|2,0,0]=4 838 B12R1.283 CCNc1cnccc1C(=O)C 220418558fcf44b67c42a89b44668a1c [0,2,0,0,0,0|2,0,0]=4 839 B12R1.283 CCNc1cnccc1C(=O)N ff724fc5139a59da98b4e57a237624a9 [0,2,0,0,0,0|2,0,0]=4 840 B12R1.283 CCNc1cnccc1C(=O)O 02d8c1c81d521a5f24367412280d51b5 [0,2,0,0,0,0|2,0,0]=4 841 B12R1.283 CCNc1ncccc1C(=O)C bd99c7d7e7fffc79d9dc62042e9b30b5 [0,2,0,0,0,0|2,0,0]=4 842 B12R1.283 CCNc1ncccc1C(=O)N 76f0d1d44d0a6f90c2232789d542b19b [0,2,0,0,0,0|2,0,0]=4 843 B12R1.283 CCNc1ncccc1C(=O)O f102b82bd6d48d57eee0f84b2648bada [0,2,0,0,0,0|2,0,0]=4 844 B12R1.283 CCOc1ccccc1C(=O)C 714020703c7343bf4297a0ea0ff54652 [0,2,0,0,0,0|0,0,0]=2 845 B12R1.283 CCOc1ccccc1C(=O)N 3f06cd2d07f6811aa6f09c5cc570f689 [0,2,0,0,0,0|0,0,0]=2 846 B12R1.283 CCOc1ccccc1C(=O)O 6b1a5e508cb085c6b35ea5df73a75644 [0,2,0,0,0,0|0,0,0]=2 847 B12R1.283 CCOc1ccccc1C(=S)N 11e34ad711690f54faefeeae54a41f10 [0,2,0,0,0,0|0,1,0]=3 848 B12R1.283 CCOc1ccccc1C(C)C 3ecf5d5e788f989f77b4d846d3c677c5 [0,2,0,0,0,0|1,0,1]=4 849 B12R1.283 CCOc1ccccc1N(C)C fa0ec1081196786492dcfd65bbae8082 [0,2,0,0,0,0|2,0,0]=4 850 B12R1.283 CCOc1ccccc1S(=O)C e5b7eef15aa9fbeb7e7a68972b3e7fbc [0,2,0,0,0,0|1,0,0]=3 851 B12R1.283 CCOc1ccccc1[N+](=O)[O-] d8d272214d54d9eefe49a9bce35db8dd [0,2,0,0,0,0|1,0,0]=3 852 B12R1.283 CCOc1cccnc1C(=O)C c37ff750f0bc9c3082979457f99ba362 [0,2,0,0,0,0|1,0,0]=3 853 B12R1.283 CCOc1cccnc1C(=O)N 78621c1e03134234e9e226036539949a [0,2,0,0,0,0|1,0,0]=3 854 B12R1.283 CCOc1cccnc1C(=O)O f573e257407c1f9b919d1c95aee1d945 [0,2,0,0,0,0|1,0,0]=3 855 B12R1.283 CCOc1cccnc1[N+](=O)[O-] 9cf146ab76d079b3d186efcd07728c1d [0,2,0,0,0,0|2,0,0]=4 856 B12R1.283 CCOc1ccncc1C(=O)N df71e374bd5e35f657d432f407950042 [0,2,0,0,0,0|1,0,0]=3 857 B12R1.283 CCOc1ccncc1C(=O)O adbc21efef717d8df8cb151f07d20290 [0,2,0,0,0,0|1,0,0]=3 858 B12R1.283 CCOc1ccncc1[N+](=O)[O-] a83f90bf800de1d928217b0d9e2cd3a9 [0,2,0,0,0,0|2,0,0]=4 859 B12R1.283 CCOc1cnccc1C(=O)C 9eedc705f2ddd56796529136a8fdeefb [0,2,0,0,0,0|1,0,0]=3 860 B12R1.283 CCOc1cnccc1C(=O)N cf5e9e0da5b5d29ad793346b16c75dda [0,2,0,0,0,0|1,0,0]=3 861 B12R1.283 CCOc1cnccc1C(=O)O 94430487aa2eb034137044d53b52c591 [0,2,0,0,0,0|1,0,0]=3 862 B12R1.283 CCOc1cnccc1[N+](=O)[O-] 8590b9459f936914ee20a74bf19a14a9 [0,2,0,0,0,0|2,0,0]=4 863 B12R1.283 CCOc1ncccc1C(=O)N 401540195c4d9a982da8dd1e274713b0 [0,2,0,0,0,0|1,0,0]=3 864 B12R1.283 CCOc1ncccc1C(=O)O 6df1f7b7a95317b99239972f7ee74542 [0,2,0,0,0,0|1,0,0]=3 865 B12R1.283 CCOc1ncccc1[N+](=O)[O-] 6b127f8dc9e5d4ab7960d47a5cc0358c [0,2,0,0,0,0|2,0,0]=4 866 B12R1.283 CCOc1nccnc1C(=O)N 4278199bf3c897b67026994daf924604 [0,2,0,0,0,0|2,0,0]=4 867 B12R1.283 CCOc1nccnc1C(=O)O 429c6256fbc6c9d7f7a85edc14aad9bb [0,2,0,0,0,0|2,0,0]=4 868 B12R1.283 CCOc1ncncc1C(=O)N 8ba54004374c303615f8495062f40e15 [0,2,0,0,0,0|2,0,0]=4 869 B12R1.283 CN(C)c1ccccc1NC=O d856fa8e5480b28b7d365cf9066dee8a [0,2,0,0,0,0|1,0,0]=3 870 B12R1.283 CN(C)c1ccccc1OCF f3cc86310260f123fa78d02e84ef43a8 [0,2,0,0,0,0|2,0,0]=4 871 B12R1.283 CN(C)c1cccnc1NC=O df929930f65f82d6c565a07fe8e6c8cb [0,2,0,0,0,0|2,0,0]=4 872 B12R1.283 CS(=O)c1ccccc1NC=O e0dea8bd449b1b038a9d6801f6b56167 [0,2,0,0,0,0|0,1,0]=3 873 B12R1.283 CS(=O)c1ccccc1NCF e6615b033a0c59bf6c7d3df4f3857cab [0,2,0,0,0,0|2,0,0]=4 874 B12R1.283 CS(=O)c1ccccc1NCO ca823a79432117d8c8d773289a1d2a38 [0,2,0,0,0,0|2,0,0]=4 875 B12R1.283 CS(=O)c1ccccc1OCF a370fd5ca440460a46a8b29d69bfae50 [0,2,0,0,0,0|1,0,0]=3 876 B12R1.283 NC(=O)c1ccccc1NC=O 0b75641490b24ddec9794b556ca45baa [0,2,0,0,0,0|1,0,1]=4 877 B12R1.283 NC(=O)c1ccccc1NCF 999e3be166919e2bc82fd9b8646c8368 [0,2,0,0,0,0|1,0,0]=3 878 B12R1.283 NC(=O)c1ccccc1NCO d223710b227e500ab63dce453fa45091 [0,2,0,0,0,0|1,0,0]=3 879 B12R1.283 NC(=O)c1ccccc1OCF 0632446d00c301f090c2f21f5db82ce6 [0,2,0,0,0,0|0,0,0]=2 880 B12R1.283 NC(=O)c1cccnc1NCF 3aceba8ae8e3563b22f581546c8fb38e [0,2,0,0,0,0|2,0,0]=4 881 B12R1.283 NC(=O)c1cccnc1NCO d2aa487d04a042aeb6863c73416e66a8 [0,2,0,0,0,0|2,0,0]=4 882 B12R1.283 NC(=O)c1cccnc1OCF a4225d8c91938b533ac4e7b0e9dc0a9d [0,2,0,0,0,0|1,0,0]=3 883 B12R1.283 NC(=O)c1ccncc1NCF f92d18170dc5d02440b204bb3646de8e [0,2,0,0,0,0|2,0,0]=4 884 B12R1.283 NC(=O)c1ccncc1NCO e31cbd19061033f82bceb1f506bcbe90 [0,2,0,0,0,0|2,0,0]=4 885 B12R1.283 NC(=O)c1ccncc1OCF 1e7359965fa40bbcfd9ef3b9e92a50df [0,2,0,0,0,0|1,0,0]=3 886 B12R1.283 NC(=O)c1cnccc1NCF 5c8ea198c84e05965e39e1d83da67340 [0,2,0,0,0,0|2,0,0]=4 887 B12R1.283 NC(=O)c1cnccc1NCO 032fa468c640f0b5474bf572b69bce4f [0,2,0,0,0,0|2,0,0]=4 888 B12R1.283 NC(=O)c1cnccc1OCF ea77b2142a1755e33be4e29da92ce639 [0,2,0,0,0,0|1,0,0]=3 889 B12R1.283 NC(=O)c1cncnc1OCF f69ee42f67154823223e06b5d4b899b8 [0,2,0,0,0,0|2,0,0]=4 890 B12R1.283 NC(=O)c1ncccc1NCF 15bae419c00caea40a4ec0bd93fc5666 [0,2,0,0,0,0|2,0,0]=4 891 B12R1.283 NC(=O)c1ncccc1NCO 671968e7a114bb0c30a9acf631403562 [0,2,0,0,0,0|2,0,0]=4 892 B12R1.283 NC(=O)c1ncccc1OCF 601e2b32af8b4438ac40ba30fd8e3b55 [0,2,0,0,0,0|1,0,0]=3 893 B12R1.283 NC(=O)c1nccnc1OCF dc6bb256321329cfc7cbb7cf4a13ba45 [0,2,0,0,0,0|2,0,0]=4 894 B12R1.283 NC(=S)c1ccccc1NC=O 862bd4d24af0f8a804cbd159f0a0f017 [0,2,0,0,0,0|2,0,0]=4 895 B12R1.283 NC(=S)c1ccccc1NCF 9ce06288b6ea80f85dd913cb1523f89a [0,2,0,0,0,0|1,1,0]=4 896 B12R1.283 NC(=S)c1ccccc1NCO 37e2a7e498e31d34813b5d6a176d6abe [0,2,0,0,0,0|1,1,0]=4 897 B12R1.283 NC(=S)c1ccccc1OCF fae9ffb099040173fa547296eb3059c1 [0,2,0,0,0,0|0,1,0]=3 898 B12R1.283 O=C(O)c1ccccc1OCF 843c9abf5ce75df7059a281ce20ab8dc [0,2,0,0,0,0|0,0,0]=2 899 B12R1.283 O=C(O)c1cccnc1NCF e0182c1845f3eba521344c6c099b10d2 [0,2,0,0,0,0|2,0,0]=4 900 B12R1.283 O=C(O)c1cccnc1NCO fda77951b7fc5a12ce57a854c1413f3e [0,2,0,0,0,0|2,0,0]=4 901 B12R1.283 O=C(O)c1cccnc1OCF 04986612fe8735b5039c9bbe74b7efc4 [0,2,0,0,0,0|1,0,0]=3 902 B12R1.283 O=C(O)c1ccncc1NCF ff623450ae60b322206f28737da720c4 [0,2,0,0,0,0|2,0,0]=4 903 B12R1.283 O=C(O)c1ccncc1NCO 2fac94c0a0719b08ca0ee68cb63ad067 [0,2,0,0,0,0|2,0,0]=4 904 B12R1.283 O=C(O)c1ccncc1OCF 12950696e7e00cd4dce2e50859aced23 [0,2,0,0,0,0|1,0,0]=3 905 B12R1.283 O=C(O)c1cnccc1NCF d3788cf76fbb22893c3aea5d2579f511 [0,2,0,0,0,0|2,0,0]=4 906 B12R1.283 O=C(O)c1cnccc1NCO 84705730d23be1d3fa1f22b71fce820e [0,2,0,0,0,0|2,0,0]=4 907 B12R1.283 O=C(O)c1cnccc1OCF cf2aa97a1295857fe3fc64912dcce16d [0,2,0,0,0,0|1,0,0]=3 908 B12R1.283 O=C(O)c1ncccc1NCF c68ffed3b82ee2b5bcf88703e53770b8 [0,2,0,0,0,0|2,0,0]=4 909 B12R1.283 O=C(O)c1ncccc1NCO a369cba976010587cb1e1c6cfe9c4f27 [0,2,0,0,0,0|2,0,0]=4 910 B12R1.283 O=C(O)c1ncccc1OCF e6c1b4a5b96f8db86e4f13a9aef6edd4 [0,2,0,0,0,0|1,0,0]=3 911 B12R1.283 O=C(O)c1nccnc1OCF 10a77e6c03cd7920b16b91878b8997af [0,2,0,0,0,0|2,0,0]=4 912 B12R1.283 O=CNc1ccccc1C(F)F 61890a4104ad92103ba44e62c31a113e [0,2,0,0,0,0|2,0,0]=4 913 B12R1.283 O=[N+]([O-])c1ccccc1NCF 0167178bf88eebb07a8f689a458b20e2 [0,2,0,0,0,0|2,0,0]=4 914 B12R1.283 O=[N+]([O-])c1cccnc1OCF c0ef075359f73607011591d27687f44c [0,2,0,0,0,0|2,0,0]=4 915 B12R1.283 O=[N+]([O-])c1ccncc1OCF 9cc77f1ab62d380d0c0b16b96c200960 [0,2,0,0,0,0|2,0,0]=4 916 B12R1.283 O=[N+]([O-])c1cnccc1OCF 0851065481de0c9d8baae05b9da4fcae [0,2,0,0,0,0|2,0,0]=4 917 B12R1.283 O=[N+]([O-])c1ncccc1OCF 96a5002a3accafd4f0b5988f0447df62 [0,2,0,0,0,0|2,0,0]=4 918 B12R1.542 C#Cc1c(cccc1NC=O)F c345d1ab938ca47197cb3738c0274f9d [0,2,0,0,0,0|1,0,1]=4 919 B12R1.542 C=Cc1c(ccnc1OCC)Br 6e4d92cfb9b096e9636ef2fa2cfe051a [0,2,0,0,0,0|2,0,0]=4 920 B12R1.542 C=Cc1c(ccnc1OCC)Cl d91acb49e5e673275b83bede769e7b6b [0,2,0,0,0,0|2,0,0]=4 921 B12R1.542 C=Cc1c(ccnc1OCC)F 2286afda2d2a3852cf0065b77c2d102d [0,2,0,0,0,0|2,0,0]=4 922 B12R1.542 C=Cc1c(ccnc1OCC)I 14c7658edae6ec9c8aa9ca5751690684 [0,2,0,0,0,0|2,0,0]=4 923 B12R1.542 C=Cc1c(ccnc1OCF)Br 1d6090457f230309bccefa59c2ef037f [0,2,0,0,0,0|2,0,0]=4 924 B12R1.542 C=Cc1c(ccnc1OCF)Cl 56de0949cab96cdd06a4f2e4947f53ab [0,2,0,0,0,0|2,0,0]=4 925 B12R1.542 C=Cc1c(ccnc1OCF)F 99cb11ef266105bce2f57916dbb9aec0 [0,2,0,0,0,0|2,0,0]=4 926 B12R1.542 C=Cc1c(ccnc1OCF)I 7e70ddf03807a63e591b8ebeab45e5a4 [0,2,0,0,0,0|2,0,0]=4 927 B12R1.542 CCNc1cccc(c1C=O)Br 6d6d7a391e56a70ff4667b5a0afdefae [0,2,0,0,0,0|1,0,0]=3 928 B12R1.542 CCNc1cccc(c1C=O)C 7e9263eb214af7178e577f89a0ad76d3 [0,2,0,0,0,0|1,0,0]=3 929 B12R1.542 CCNc1cccc(c1C=O)Cl 088f5536c3087d64a94746610626a8f0 [0,2,0,0,0,0|1,0,0]=3 930 B12R1.542 CCNc1cccc(c1C=O)F c034fa71cc149ff3fecd1c5f9a41b642 [0,2,0,0,0,0|1,0,0]=3 931 B12R1.542 CCNc1cccc(c1C=O)I 4eadc6026c16ee9dd38e47ea0cf4f30a [0,2,0,0,0,0|1,0,0]=3 932 B12R1.542 CCNc1cccc(c1OC)C f66a857a57aec34cfd714340c2a4bb32 [0,2,0,0,0,0|1,0,1]=4 933 B12R1.542 CCNc1cccc(c1OC)Cl 725f14791042b903439232b3c6f57f8c [0,2,0,0,0,0|1,0,1]=4 934 B12R1.542 CCNc1cccc(c1OC)F fd552258e92025087ae8d5b15f8ecb72 [0,2,0,0,0,0|1,0,1]=4 935 B12R1.542 CCNc1ccnc(c1C=O)Cl a8632824ee1b04ff4132b844372cc0ba [0,2,0,0,0,0|2,0,0]=4 936 B12R1.542 CCNc1ccnc(c1C=O)F 9bd2f28a0d82ef2bd987f4c64e919c8a [0,2,0,0,0,0|2,0,0]=4 937 B12R1.542 CCNc1cncc(c1C=O)Cl 49c4a8e4cbcc1aaba71f64880596dd3d [0,2,0,0,0,0|2,0,0]=4 938 B12R1.542 CCNc1nccc(c1C=O)C b106c4bf52743bce82e738fde0e81446 [0,2,0,0,0,0|2,0,0]=4 939 B12R1.542 CCNc1nccc(c1C=O)Cl ebe9fd76a71ad7e7b10595d7f9ae7913 [0,2,0,0,0,0|2,0,0]=4 940 B12R1.542 CCOc1cccc(c1C#N)C 995d8a73954ce6d5a4963a8eeeb3e53d [0,2,0,0,0,0|1,0,1]=4 941 B12R1.542 CCOc1cccc(c1C#N)Cl 5d185d4755d71c90e8235852e22dc508 [0,2,0,0,0,0|1,0,1]=4 942 B12R1.542 CCOc1cccc(c1C#N)I 73d920f5c2bdd6d1163fe7a18e459591 [0,2,0,0,0,0|1,0,1]=4 943 B12R1.542 CCOc1cccc(c1C=O)Br 17e2002469a41fe45cae60f07379798c [0,2,0,0,0,0|0,0,0]=2 944 B12R1.542 CCOc1cccc(c1C=O)C eb8e850c7f34fbf070bf9a3229e0da07 [0,2,0,0,0,0|0,0,0]=2 945 B12R1.542 CCOc1cccc(c1C=O)Cl 0a37fb7f629211405394a48615214fcb [0,2,0,0,0,0|0,0,0]=2 946 B12R1.542 CCOc1cccc(c1C=O)F b32cd1a5547b198435b4ba0f55050411 [0,2,0,0,0,0|0,0,0]=2 947 B12R1.542 CCOc1cccc(c1C=O)I af520461e332f9ca698616dfcba12165 [0,2,0,0,0,0|0,0,0]=2 948 B12R1.542 CCOc1cccc(c1CC)Cl 10f882aad66515561d66cc7700fc94f7 [0,2,0,0,0,0|1,0,1]=4 949 B12R1.542 CCOc1cccc(c1OC)C 739b20fd9160a9ca4145a6dacd6dc702 [0,2,0,0,0,0|1,0,1]=4 950 B12R1.542 CCOc1cccc(c1OC)Cl ee2cb4cf62363143d056638bbbe1c69f [0,2,0,0,0,0|1,0,1]=4 951 B12R1.542 CCOc1cccc(c1OC)F c6fa6a4db5b3c3f216313dc0914eec82 [0,2,0,0,0,0|1,0,1]=4 952 B12R1.542 CCOc1cccc(c1OC)I 19b4dc84424338cd39f69a797dc222d0 [0,2,0,0,0,0|1,0,1]=4 953 B12R1.542 CCOc1cccc(c1SC)Br a085779473f23e92c376118754a40c23 [0,2,0,0,0,0|2,0,0]=4 954 B12R1.542 CCOc1cccc(c1SC)C d34123277279dc08459b3852ed6c2309 [0,2,0,0,0,0|2,0,0]=4 955 B12R1.542 CCOc1cccc(c1SC)Cl 1dfd8175e924725f169596d7cc2e2c50 [0,2,0,0,0,0|2,0,0]=4 956 B12R1.542 CCOc1cccc(c1SC)F 80f369aac207300b940e5dbff82f9150 [0,2,0,0,0,0|2,0,0]=4 957 B12R1.542 CCOc1ccnc(c1C=O)Br 6a739c8792e6411723711f46dde81f49 [0,2,0,0,0,0|1,0,0]=3 958 B12R1.542 CCOc1nccc(c1C=O)I bd412306b578d661c5a1cee23feb3125 [0,2,0,0,0,0|1,0,0]=3 959 B12R1.542 CCc1c(cccc1NC=O)C 6c3f00f2a88520e5b4255c0ae08feb91 [0,2,0,0,0,0|1,0,0]=3 960 B12R1.542 CCc1c(cccc1OCF)Cl b3bdb9afdf60d7cbca96d8091f560277 [0,2,0,0,0,0|1,0,1]=4 961 B12R1.542 COc1c(cccc1NC=O)Br 2502e32d188961f27201c74dd76599ce [0,2,0,0,0,0|0,0,0]=2 962 B12R1.542 COc1c(cccc1NC=O)C cc138f26dd53e98b064654b852518adb [0,2,0,0,0,0|0,0,0]=2 963 B12R1.542 COc1c(cccc1NC=O)Cl 4662b450a05c3bce330e0b01f38ed985 [0,2,0,0,0,0|0,0,0]=2 964 B12R1.542 COc1c(cccc1NC=O)F 532bf47bebb026d7af228a53669f154d [0,2,0,0,0,0|0,0,0]=2 965 B12R1.542 COc1c(cccc1NC=O)O c2b971e3e20856be1d3ad0d331f4ac39 [0,2,0,0,0,0|0,0,0]=2 966 B12R1.542 COc1c(cccc1NCF)C 07ed590877514414e1a0b9eec4d6200c [0,2,0,0,0,0|1,0,1]=4 967 B12R1.542 COc1c(cccc1NCF)Cl 174979db194cb334ac8c1fcafff9e011 [0,2,0,0,0,0|1,0,1]=4 968 B12R1.542 COc1c(cccc1NCF)F c02c75534b99816cdf8ad89b8e73b7cd [0,2,0,0,0,0|1,0,1]=4 969 B12R1.542 COc1c(cccc1NCO)C 267f373d7cb1a189f0af3f641dceb1b4 [0,2,0,0,0,0|0,0,2]=4 970 B12R1.542 COc1c(cccc1NCO)F 4cca492756326e476d64e9092a993191 [0,2,0,0,0,0|0,0,2]=4 971 B12R1.542 COc1c(cccc1OCF)C 129f9b9df828fe271cae8239de0be01f [0,2,0,0,0,0|1,0,1]=4 972 B12R1.542 COc1c(cccc1OCF)Cl b3d023911b4f9539a6930d73faa91a5e [0,2,0,0,0,0|1,0,1]=4 973 B12R1.542 COc1c(cccc1OCF)I fdfad196b5617e6c977a36ba10b3a805 [0,2,0,0,0,0|1,0,1]=4 974 B12R1.542 COc1c(ccnc1C)NC=O 8295c1db6d686ea3f3735cee28927360 [0,2,0,0,0,0|1,0,0]=3 975 B12R1.542 COc1c(ccnc1Cl)NC=O 185e8cbd19a3396b83cbaeaad8fb4162 [0,2,0,0,0,0|1,0,0]=3 976 B12R1.542 COc1c(ccnc1NC=O)Br 154152e48b8dc199de90a3f300a01703 [0,2,0,0,0,0|1,0,0]=3 977 B12R1.542 COc1c(ccnc1NC=O)Cl 014e2d51ab117d3d0aae3de32413f3b5 [0,2,0,0,0,0|1,0,0]=3 978 B12R1.542 COc1c(ccnc1NC=O)F 9ca03229fa6b25057082421081bd32ab [0,2,0,0,0,0|1,0,0]=3 979 B12R1.542 COc1c(cncc1NC=O)Cl 2526873d8fecc5378abeb67ebe7d3083 [0,2,0,0,0,0|1,0,0]=3 980 B12R1.542 COc1c(ncnc1NC=O)Cl 7fade5d162fba997fbbc61887acfbc9a [0,2,0,0,0,0|2,0,0]=4 981 B12R1.542 CSc1c(cccc1NC=O)Cl f37ea647c87925fe90b854c878b30e51 [0,2,0,0,0,0|0,1,0]=3 982 B12R1.542 CSc1c(cccc1OCF)Br 0748b39fa080c099955005c88b59ab88 [0,2,0,0,0,0|2,0,0]=4 983 B12R1.542 CSc1c(cccc1OCF)C 058844329e45050cba0f6d577ec759c9 [0,2,0,0,0,0|2,0,0]=4 984 B12R1.542 CSc1c(cccc1OCF)Cl eb4760b390630ab809ee70bd5df1274c [0,2,0,0,0,0|2,0,0]=4 985 B12R1.542 CSc1c(cccc1OCF)F 3a5e38e088707c0a7e3dfd91b8d9c8e3 [0,2,0,0,0,0|2,0,0]=4 986 B12R1.542 Cc1cccc(c1C#N)NC=O 2a42d56b04064e8059eebba7809fdd9f [0,2,0,0,0,0|2,0,0]=4 987 B12R1.542 Cc1cccc(c1C#N)OCF ee59cb4bad3a6f93fc4dfca626d90a24 [0,2,0,0,0,0|1,0,1]=4 988 B12R1.542 Cc1cccc(c1C=O)NC#N 6a43ab18de44d0067d7eff8e2518ddf6 [0,2,0,0,0,0|1,0,1]=4 989 B12R1.542 Cc1cccc(c1C=O)NC=O cc3e01ef7af49d7f294ef6fed647610c [0,2,0,0,0,0|1,0,1]=4 990 B12R1.542 Cc1cccc(c1C=O)NCF 525a57e6edb185db3ce440840ffbdce2 [0,2,0,0,0,0|1,0,0]=3 991 B12R1.542 Cc1cccc(c1C=O)NCO 640d80d4255fad23e116c96a621283eb [0,2,0,0,0,0|1,0,0]=3 992 B12R1.542 Cc1cccc(c1C=O)OCF 25fece5f2615d08e57cf8e666a9f9a75 [0,2,0,0,0,0|0,0,0]=2 993 B12R1.542 Cc1cccc(c1CO)NC=O af5d133c4bf00f3c6b20db4e772e5601 [0,2,0,0,0,0|2,0,0]=4 994 B12R1.542 Cc1ccnc(c1C=O)NCF 1dd6e2303e7e22168af5e52e35640e5d [0,2,0,0,0,0|2,0,0]=4 995 B12R1.542 Cc1ccnc(c1C=O)NCO e29b798339271ac54998dc0cd8dc72af [0,2,0,0,0,0|2,0,0]=4 996 B12R1.542 N#CNc1cccc(c1C=O)F c8d827128a8c39152af14f405bd7c643 [0,2,0,0,0,0|1,0,1]=4 997 B12R1.542 N#Cc1c(cccc1NC=O)Br 9ccc0138efe8f061debf1797b9847b6c [0,2,0,0,0,0|2,0,0]=4 998 B12R1.542 N#Cc1c(cccc1NC=O)Cl b7b674f93e1e5d1d9d30ca8ea8f3b33a [0,2,0,0,0,0|2,0,0]=4 999 B12R1.542 N#Cc1c(cccc1NC=O)F 50cc18ff25647066639d42cac1a4f74c [0,2,0,0,0,0|2,0,0]=4 1000 B12R1.542 N#Cc1c(cccc1NC=O)I 17fdb28c4154a114438fd21c390a8772 [0,2,0,0,0,0|2,0,0]=4 1001 B12R1.542 N#Cc1c(cccc1NC=O)O 20d11b9209a266d377712c607090a4bd [0,2,0,0,0,0|2,0,0]=4 1002 B12R1.542 N#Cc1c(cccc1OCF)Cl a881ebf4665c203b9b7e9a9373634654 [0,2,0,0,0,0|1,0,1]=4 1003 B12R1.542 N#Cc1c(cccc1OCF)F f0bd9f083ab8a0332e2289d18b935417 [0,2,0,0,0,0|1,0,1]=4 1004 B12R1.542 N#Cc1c(cccc1OCF)I 9660286fe86c0a1b4c36a30e2db97211 [0,2,0,0,0,0|1,0,1]=4 1005 B12R1.542 O=CNc1cccc(c1C=O)Br bf8b0ee9afdd10b484c40f8dca933af7 [0,2,0,0,0,0|1,0,1]=4 1006 B12R1.542 O=CNc1cccc(c1C=O)Cl 67d59f05f9695b8e6716ed82507e192c [0,2,0,0,0,0|1,0,1]=4 1007 B12R1.542 O=CNc1cccc(c1C=O)F 879c9a73b0dc2fed38f6f03a46780be4 [0,2,0,0,0,0|1,0,1]=4 1008 B12R1.542 O=CNc1cccc(c1C=O)I 4177640bbcf32e071f9a04274b044908 [0,2,0,0,0,0|1,0,1]=4 1009 B12R1.542 O=CNc1cccc(c1CO)Br 1874c6544bb86490c455d1b9425ed48e [0,2,0,0,0,0|2,0,0]=4 1010 B12R1.542 O=CNc1cccc(c1CO)Cl bfc7b7eed077a006af242b142dad35ce [0,2,0,0,0,0|2,0,0]=4 1011 B12R1.542 O=CNc1cccc(c1CO)F 783dc35d64b385889d7c1f831116f405 [0,2,0,0,0,0|2,0,0]=4 1012 B12R1.542 O=Cc1c(cccc1NCF)Br 54ff4282bddeee0eb2d29bf06fd6fdae [0,2,0,0,0,0|1,0,0]=3 1013 B12R1.542 O=Cc1c(cccc1NCF)Cl 609e0b485be0c9fc06be9e67964e89b0 [0,2,0,0,0,0|1,0,0]=3 1014 B12R1.542 O=Cc1c(cccc1NCF)F 0f9332582f085150ca73ca9d867ed165 [0,2,0,0,0,0|1,0,0]=3 1015 B12R1.542 O=Cc1c(cccc1NCF)I 64efd1b85c0b820a69038589b858daa4 [0,2,0,0,0,0|1,0,0]=3 1016 B12R1.542 O=Cc1c(cccc1NCO)Br ed44ef47beb5a996d6ff27e140d0b837 [0,2,0,0,0,0|1,0,0]=3 1017 B12R1.542 O=Cc1c(cccc1NCO)Cl 62c20d0f3ca5c45a876245175a012253 [0,2,0,0,0,0|1,0,0]=3 1018 B12R1.542 O=Cc1c(cccc1NCO)F 42734af8201ead616e02b7ac7d3c9f19 [0,2,0,0,0,0|1,0,0]=3 1019 B12R1.542 O=Cc1c(cccc1NCO)I c7aa053cade8d7569b785736c56282d2 [0,2,0,0,0,0|1,0,0]=3 1020 B12R1.542 O=Cc1c(cccc1OCF)Br 245c703ecda00db08f48a70ad2c1015d [0,2,0,0,0,0|0,0,0]=2 1021 B12R1.542 O=Cc1c(cccc1OCF)Cl 194426dba081219b510f00fac5254a65 [0,2,0,0,0,0|0,0,0]=2 1022 B12R1.542 O=Cc1c(cccc1OCF)F 718c6c2b019ece41e356635b86b3a6f1 [0,2,0,0,0,0|0,0,0]=2 1023 B12R1.542 O=Cc1c(cccc1OCF)I 03c2a94c9e8b549d08fae68742d83d4b [0,2,0,0,0,0|0,0,0]=2 1024 B12R1.542 O=Cc1c(ccnc1Br)OCF b2ae1b3b57c8f557dfaf6bbf6ce9ba2b [0,2,0,0,0,0|1,0,0]=3 1025 B12R1.542 O=Cc1c(ccnc1Cl)NCF 342e91bcf933d2843f3841be0d23435b [0,2,0,0,0,0|2,0,0]=4 1026 B12R1.542 O=Cc1c(ccnc1Cl)NCO ad3ff9ecefeedd36a15fe67e42fb50d3 [0,2,0,0,0,0|2,0,0]=4 1027 B12R1.542 O=Cc1c(ccnc1F)NCF 92199fe9a0742221f7d66c3b7e733f5f [0,2,0,0,0,0|2,0,0]=4 1028 B12R1.542 O=Cc1c(ccnc1F)NCO 1b0c3e0e4eb7edc6fb45de8b7255fee5 [0,2,0,0,0,0|2,0,0]=4 1029 B12R1.542 O=Cc1c(ccnc1NCF)Cl 0ea12f98a35a4c8a9989fd2dc01e7b30 [0,2,0,0,0,0|2,0,0]=4 1030 B12R1.542 O=Cc1c(ccnc1NCO)Cl e7d140be6b3202a2c6f4364003f9156f [0,2,0,0,0,0|2,0,0]=4 1031 B12R1.542 O=Cc1c(ccnc1OCF)I b7e4efa13f69ee2177a4724d4d6cb25a [0,2,0,0,0,0|1,0,0]=3 1032 B12R1.542 O=Cc1c(cncc1NCF)Cl c46200d3a910634c23f0c9436d724ba3 [0,2,0,0,0,0|2,0,0]=4 1033 B12R1.542 O=Cc1c(cncc1NCO)Cl a579f6ad3a885d4eede5dab263b51e28 [0,2,0,0,0,0|2,0,0]=4 1034 B12R1.1112 C#Cc1cccc(c1OCC)C c08b589b4e2f50cb821a47533b027672 [0,2,0,0,0,0|1,0,1]=4 1035 B12R1.1112 C#Cc1cccc(c1OCF)C 818f8698debc19845f2f0945e03d42c4 [0,2,0,0,0,0|1,0,1]=4 1036 B12R1.1112 CCNc1c(cccc1C=O)Br eac215eef4944bad95e4cac0824f7e0e [0,2,0,0,0,0|1,0,0]=3 1037 B12R1.1112 CCNc1c(cccc1C=O)C d2743d37e2071eec0ed887ccebb66913 [0,2,0,0,0,0|1,0,0]=3 1038 B12R1.1112 CCNc1c(cccc1C=O)Cl 59aa3ee0a7f744600ccc135236022203 [0,2,0,0,0,0|1,0,0]=3 1039 B12R1.1112 CCNc1c(cccc1C=O)F ea8a60bff6b92fdd889229b0bae0f083 [0,2,0,0,0,0|1,0,0]=3 1040 B12R1.1112 CCNc1c(cccc1C=O)I 06d26d0f040c759424f2b5ef0a7f02be [0,2,0,0,0,0|1,0,0]=3 1041 B12R1.1112 CCNc1c(cccc1OC)C 43730b2c3a0485b3dcdb7cf1fd276828 [0,2,0,0,0,0|1,0,1]=4 1042 B12R1.1112 CCNc1c(cccc1OC)Cl 7ac1d2a01b1092e7e94fb5edb22b1b90 [0,2,0,0,0,0|1,0,1]=4 1043 B12R1.1112 CCNc1c(cccc1OC)F 5a05ce03827ad643472b5da581927564 [0,2,0,0,0,0|1,0,1]=4 1044 B12R1.1112 CCNc1c(cccc1OC)I 951234c465ea8efb2fe74188d33b1a4a [0,2,0,0,0,0|1,0,1]=4 1045 B12R1.1112 CCNc1c(cccc1OC)S 8c5bac2faaf79f709207ead50c36dbc2 [0,2,0,0,0,0|1,0,1]=4 1046 B12R1.1112 CCNc1c(cncc1C=O)Br fc7abe25ba9305facf424cf5a054af15 [0,2,0,0,0,0|2,0,0]=4 1047 B12R1.1112 CCNc1c(cncc1C=O)Cl 7d48376fabf0164cb14025be2c6e2066 [0,2,0,0,0,0|2,0,0]=4 1048 B12R1.1112 CCOc1c(cccc1C#N)Br 80f907f151abfd5d8481946d2e8192aa [0,2,0,0,0,0|1,0,1]=4 1049 B12R1.1112 CCOc1c(cccc1C#N)C 6e9e18c2bb3971efd4a62be062f0af2c [0,2,0,0,0,0|1,0,1]=4 1050 B12R1.1112 CCOc1c(cccc1C#N)Cl 42963e1a2536fc7a9c1cb59bfd5fdeb1 [0,2,0,0,0,0|1,0,1]=4 1051 B12R1.1112 CCOc1c(cccc1C#N)F 21aeaabb86bb0604a0e142101f938059 [0,2,0,0,0,0|1,0,1]=4 1052 B12R1.1112 CCOc1c(cccc1C=O)Br 8fc43fd732bab230d95808d3e9b6ac44 [0,2,0,0,0,0|0,0,0]=2 1053 B12R1.1112 CCOc1c(cccc1C=O)C 6f6ca30cc3723e9d2725cf6a545123a2 [0,2,0,0,0,0|0,0,0]=2 1054 B12R1.1112 CCOc1c(cccc1C=O)Cl cf71c7cec43255d88b193fff37516b31 [0,2,0,0,0,0|0,0,0]=2 1055 B12R1.1112 CCOc1c(cccc1C=O)F 0163de76c2486022411a90692e84e9fc [0,2,0,0,0,0|0,0,0]=2 1056 B12R1.1112 CCOc1c(cccc1C=O)I 2ba5a3b7d5d34035e5ee5c35b0747c8d [0,2,0,0,0,0|0,0,0]=2 1057 B12R1.1112 CCOc1c(cccc1CC)Br 062942e852ebff9bed736ae2eac4f6e9 [0,2,0,0,0,0|1,0,1]=4 1058 B12R1.1112 CCOc1c(cccc1CC)C eb4937b8d908671e2163bc0bff8f17a4 [0,2,0,0,0,0|1,0,1]=4 1059 B12R1.1112 CCOc1c(cccc1OC)C 1faf74a5eec6308b931771c74798a389 [0,2,0,0,0,0|1,0,1]=4 1060 B12R1.1112 CCOc1c(cccc1OC)Cl b9e950e038d36369374ab1303aca0786 [0,2,0,0,0,0|1,0,1]=4 1061 B12R1.1112 CCOc1c(cccc1OC)F 9de2b1a48e8f5e1288bb1687a5b92abf [0,2,0,0,0,0|1,0,1]=4 1062 B12R1.1112 CCOc1c(cccc1OC)I d44ba4049ec0de54281d5ba4423bc027 [0,2,0,0,0,0|1,0,1]=4 1063 B12R1.1112 CCOc1c(cccc1SC)Cl 9aad10840199d03634dea95f728b93d8 [0,2,0,0,0,0|2,0,0]=4 1064 B12R1.1112 CCOc1c(cccc1SC)F e99b98a741ac7e8b81affa3c30190c38 [0,2,0,0,0,0|2,0,0]=4 1065 B12R1.1112 CCOc1c(cccc1SC)I ec7d19a580aa781015e4e4a789ce51f8 [0,2,0,0,0,0|2,0,0]=4 1066 B12R1.1112 CCOc1c(ccnc1Br)C=O 647f574aea97a694f8e14dd5abdad7de [0,2,0,0,0,0|1,0,0]=3 1067 B12R1.1112 CCOc1c(ccnc1Cl)C=O 1d85e045e22175fc118c057e76210c0a [0,2,0,0,0,0|1,0,0]=3 1068 B12R1.1112 CCOc1c(ccnc1F)C=O 10284991629fc51d3e162c5e94aec6f1 [0,2,0,0,0,0|1,0,0]=3 1069 B12R1.1112 CCOc1c(cncc1C=O)Br fab98ebbdcea97303be0d22470034d2b [0,2,0,0,0,0|1,0,0]=3 1070 B12R1.1112 CCc1cccc(c1NC=O)C bc13543a7d48f7c3474df014a0221817 [0,2,0,0,0,0|1,0,0]=3 1071 B12R1.1112 CCc1cccc(c1OCF)Br 3a35efedd80dd5ca11e82f01005d6bca [0,2,0,0,0,0|1,0,1]=4 1072 B12R1.1112 CCc1cccc(c1OCF)C 15dfc916b2328cbd229af1db3dea4cdd [0,2,0,0,0,0|1,0,1]=4 1073 B12R1.1112 CCc1nccc(c1NC=O)C 4509faa1a3988ab8c52c69109fde5293 [0,2,0,0,0,0|2,0,0]=4 1074 B12R1.1112 COc1cccc(c1NC=O)I 880f89b15bf7b13eeb4ce76925405140 [0,2,0,0,0,0|0,0,0]=2 1075 B12R1.1112 COc1cccc(c1NCO)C 974c8d3094b0458567b3833960664b44 [0,2,0,0,0,0|0,0,2]=4 1076 B12R1.1112 COc1cccc(c1NCO)Cl 86e9a2729ef60dcafcfa7bf49af3087a [0,2,0,0,0,0|0,0,2]=4 1077 B12R1.1112 COc1cccc(c1NCO)F b1b63b340dd1ebc1468c3ec962f9f2b0 [0,2,0,0,0,0|0,0,2]=4 1078 B12R1.1112 COc1cccc(c1NCO)I 0ce090ca281744d490e43dae59c0bb73 [0,2,0,0,0,0|0,0,2]=4 1079 B12R1.1112 COc1cccc(c1NCO)S 83a32981a3edd7e7251904fa3cf73b1f [0,2,0,0,0,0|0,0,2]=4 1080 B12R1.1112 COc1cccc(c1OCF)C 766dad076a6975209247ce817032978d [0,2,0,0,0,0|1,0,1]=4 1081 B12R1.1112 COc1cccc(c1OCF)Cl b4425868447afa662cbaa43b6b1f5bec [0,2,0,0,0,0|1,0,1]=4 1082 B12R1.1112 COc1cccc(c1OCF)I 2fbb45fadcacf8b3c65891cdcc2c0001 [0,2,0,0,0,0|1,0,1]=4 1083 B12R1.1112 COc1nccc(c1NC=O)F 0044a6302feea5105c35908efb503d7e [0,2,0,0,0,0|1,0,0]=3 1084 B12R1.1112 CSc1cccc(c1NC=O)F d2d2c53a105c3a13d88572530e73825e [0,2,0,0,0,0|0,1,0]=3 1085 B12R1.1112 CSc1cccc(c1OCF)Cl 20d62f73c96de4f64b736634adc12238 [0,2,0,0,0,0|2,0,0]=4 1086 B12R1.1112 CSc1cccc(c1OCF)F b567157d845943a37c011d1a8f84aee3 [0,2,0,0,0,0|2,0,0]=4 1087 B12R1.1112 CSc1cccc(c1OCF)I 99a5c642a3de20f2885eea4e00984056 [0,2,0,0,0,0|2,0,0]=4 1088 B12R1.1112 Cc1cccc(c1NC=O)CO 2aac61ede77b48e11955df63bfee6133 [0,2,0,0,0,0|2,0,0]=4 1089 B12R1.1112 Cc1cccc(c1NCF)C=O ea8698a93bc4788d2fd403a41362f3ff [0,2,0,0,0,0|1,0,0]=3 1090 B12R1.1112 Cc1cccc(c1NCO)C=O 5b0c138d58e02a93320f3696aa7e9ed8 [0,2,0,0,0,0|1,0,0]=3 1091 B12R1.1112 Cc1cccc(c1OCF)C#N de8faaf9cdd4954f0c7df7c306672c1f [0,2,0,0,0,0|1,0,1]=4 1092 B12R1.1112 Cc1cccc(c1OCF)C=O 2433915b7635996b672483f4e1c279ab [0,2,0,0,0,0|0,0,0]=2 1093 B12R1.1112 N#Cc1cccc(c1OCF)Br fd83e24ecc3d1cdbaa151d9f55820ef2 [0,2,0,0,0,0|1,0,1]=4 1094 B12R1.1112 N#Cc1cccc(c1OCF)Cl 5962f623ba4b2ac2a17d155f3b9a1f36 [0,2,0,0,0,0|1,0,1]=4 1095 B12R1.1112 N#Cc1cccc(c1OCF)F f70b6407a37d24c7795c522c42c5337e [0,2,0,0,0,0|1,0,1]=4 1096 B12R1.1112 O=CNc1c(cccc1CO)Cl 69306710fd971b13c5e4264ed71ddbaf [0,2,0,0,0,0|2,0,0]=4 1097 B12R1.1112 O=CNc1c(cccc1CO)F 4f0ca86aa775a73acb3c0cb925707b46 [0,2,0,0,0,0|2,0,0]=4 1098 B12R1.1112 O=Cc1cccc(c1NCF)Br 2ccf182e31d17f52be551167aac48224 [0,2,0,0,0,0|1,0,0]=3 1099 B12R1.1112 O=Cc1cccc(c1NCF)Cl 07be2c718b9e1d1b6b181ebdbdc70517 [0,2,0,0,0,0|1,0,0]=3 1100 B12R1.1112 O=Cc1cccc(c1NCF)F dff8c87f540526a7d9d69e6156244097 [0,2,0,0,0,0|1,0,0]=3 1101 B12R1.1112 O=Cc1cccc(c1NCF)I a47de8dbc69b6f3b5c01a919c86f8739 [0,2,0,0,0,0|1,0,0]=3 1102 B12R1.1112 O=Cc1cccc(c1NCO)Br 15d0074280ef5c30e2f4007efdebe16e [0,2,0,0,0,0|1,0,0]=3 1103 B12R1.1112 O=Cc1cccc(c1NCO)Cl 0f56a19612beb1a39bdacc20a82d4e30 [0,2,0,0,0,0|1,0,0]=3 1104 B12R1.1112 O=Cc1cccc(c1NCO)F e6163bbb667e4125a2338d15884e7559 [0,2,0,0,0,0|1,0,0]=3 1105 B12R1.1112 O=Cc1cccc(c1NCO)I 56a9609ce632f47b6583483336cf3386 [0,2,0,0,0,0|1,0,0]=3 1106 B12R1.1112 O=Cc1cccc(c1OCF)Br a6711b93e638a53e38fe3c8f91761a0d [0,2,0,0,0,0|0,0,0]=2 1107 B12R1.1112 O=Cc1cccc(c1OCF)Cl c1ef4de3f5bb900ce01f36179a07bd35 [0,2,0,0,0,0|0,0,0]=2 1108 B12R1.1112 O=Cc1cccc(c1OCF)F a5cfb05be9d7bd65017e05f9ae96a6ef [0,2,0,0,0,0|0,0,0]=2 1109 B12R1.1112 O=Cc1cccc(c1OCF)I ce504d0c30d159c179db805dba3afb4f [0,2,0,0,0,0|0,0,0]=2 1110 B12R1.1112 O=Cc1ccnc(c1OCF)Br 8d470c955711bcfb3becf02382f5bc36 [0,2,0,0,0,0|1,0,0]=3 1111 B12R1.1112 O=Cc1ccnc(c1OCF)Cl 758771c2ef9bb96415935a6a0f7af3fb [0,2,0,0,0,0|1,0,0]=3 1112 B12R1.1112 O=Cc1ccnc(c1OCF)F 377714ad02642b8c86f98ca7b46a11bd [0,2,0,0,0,0|1,0,0]=3 1113 B12R1.1112 O=Cc1cncc(c1NCF)Br 5651a3d720af200fbc4b622594599e27 [0,2,0,0,0,0|2,0,0]=4 1114 B12R1.1112 O=Cc1cncc(c1NCF)Cl 122a66c9087ddb1bb2f36eaf1a08b687 [0,2,0,0,0,0|2,0,0]=4 1115 B12R1.1112 O=Cc1cncc(c1NCO)Br f9aead170245c86a0446c4f6ce276a65 [0,2,0,0,0,0|2,0,0]=4 1116 B12R1.1112 O=Cc1cncc(c1NCO)Cl 33a4c8ce48b86f949c9cd80c8f4e23d6 [0,2,0,0,0,0|2,0,0]=4 1117 B12R1.1112 O=Cc1cncc(c1OCF)Br af8f88ff6b187be7d8e930cf0cc06d06 [0,2,0,0,0,0|1,0,0]=3 1118 B12R2.1 O=CN1CCc2c1cccc2 952fb58dcbced8913394c41c3e29378e [0,1,0,1,0,0|1,0,0]=3 1119 B12R2.1 O=CN1CCc2c1cccn2 d2dcd13cafbd9713f3325443b770875f [0,1,0,1,0,0|2,0,0]=4 1120 B12R2.1 O=CN1CCc2c1ccnc2 2e0b92775838ffc53aae45498b831cce [0,1,0,1,0,0|2,0,0]=4 1121 B12R2.1 O=CN1CCc2c1cncc2 1b052413b23f1c3e48b9b6dcd0ea0849 [0,1,0,1,0,0|2,0,0]=4 1122 B12R2.1 O=CN1CCc2c1nccc2 6d4df3c1b7ebbfc1a8390e263c834cd5 [0,1,0,1,0,0|2,0,0]=4