0 B11R1.13 O=CNc1cccc(c1F)O 2479241cf2438797d1e30aab72324d07 [0,0,1,0,0,0|3,0,0]=4 1 B11R1.13 O=CNc1cccc(c1O)O cb62eca22797356beef33cf09a8c59de [0,0,1,0,0,0|3,0,0]=4 2 B11R1.16 C=CCN(C)c1ccccn1 d1965239475cc8283ac27acb48b569ca [0,0,1,0,0,0|2,0,1]=4 3 B11R1.17 C=CCNc1ccccc1Br 45171f98de3cf055ad8296095abf8a72 [0,0,1,0,0,0|1,0,2]=4 4 B11R1.17 C=CCNc1ccccc1C 227804e9ec39e8a3152168e4771a33a4 [0,0,1,0,0,0|1,0,2]=4 5 B11R1.17 C=CCNc1ccccc1Cl 22feb608c0b85e4420084046341860a2 [0,0,1,0,0,0|1,0,2]=4 6 B11R1.17 C=CCNc1ccccc1F 63452e5c6ec5ab9693bd6664ca8dd13b [0,0,1,0,0,0|1,0,2]=4 7 B11R1.17 C=CCNc1ccccc1I d363c07fc1f12e6cff19384ac05ea9d2 [0,0,1,0,0,0|1,0,2]=4 8 B11R1.17 C=CCNc1ccccc1S 9618c19886e595bcf2b31b8101182f0f [0,0,1,0,0,0|0,1,2]=4 9 B11R1.17 C=CCOc1ccccc1Br 4219c528216a56e11dfd4a15041b71e9 [0,0,1,0,0,0|2,0,1]=4 10 B11R1.17 C=CCOc1ccccc1C 420c56a798f432c55ab7076030ddf302 [0,0,1,0,0,0|2,0,1]=4 11 B11R1.17 C=CCOc1ccccc1Cl 60d7332fdfafa715c60cd99db260ce28 [0,0,1,0,0,0|2,0,1]=4 12 B11R1.17 C=CCOc1ccccc1F cfe0e61e867eaa1bb6bf5b2b171e2161 [0,0,1,0,0,0|2,0,1]=4 13 B11R1.17 C=CCOc1ccccc1I ffdd736d21d64cd3e87dc3be0d6164f1 [0,0,1,0,0,0|2,0,1]=4 14 B11R1.17 C=CCOc1ccccc1S c76936b9ce1c64eb66f6caeb41aad97f [0,0,1,0,0,0|1,1,1]=4 15 B11R1.17 O=CNCc1ccccc1O df0afa8c91afdac1d44912107063bd10 [0,0,1,0,0,0|3,0,0]=4 16 B11R1.24 O=CNCc1cccc(c1)O 5064b7b78a71b73f549eda5bd0de9ccc [0,0,1,0,0,0|2,0,1]=4 17 B11R1.28 C/C=C/CNc1cccnc1 016f8674f0de62bc0968120f36183bbf [0,0,1,0,0,0|2,0,1]=4 18 B11R1.28 C/C=C/COc1cccnc1 182aabd1e115f20a2221ff63f4609b70 [0,0,1,0,0,0|2,0,1]=4 19 B11R1.28 C/C=C\CNc1cccnc1 be373d2993e9bf82390bd09b9626574e [0,0,1,0,0,0|2,0,1]=4 20 B11R1.28 C/C=C\COc1cccnc1 d486f9f7e5b795e5a8aedabfa7f6ce63 [0,0,1,0,0,0|2,0,1]=4 21 B11R1.28 CC=CCNc1cccnc1 712a10215e7a39b6e923461fbfb9f854 [0,0,1,0,0,0|2,0,1]=4 22 B11R1.28 Cl/C=C/CNc1cccnc1 4c880db362d0bb5599ebb3569229cd20 [0,0,1,0,0,0|2,0,1]=4 23 B11R1.28 Cl/C=C/COc1cccnc1 958f62ca3222776039624c998ece50d6 [0,0,1,0,0,0|2,0,1]=4 24 B11R1.28 Cl/C=C\CNc1cccnc1 5928728b468f916ad207769df539dde6 [0,0,1,0,0,0|2,0,1]=4 25 B11R1.28 Cl/C=C\COc1cccnc1 9e789e51d37bdaa0eeeaf628165830d4 [0,0,1,0,0,0|2,0,1]=4 26 B11R1.28 O/C=C\CNc1ccccc1 8e43d75b756e053c042884ec195cf7a7 [0,0,1,0,0,0|2,0,1]=4 27 B11R1.28 O/C=C\CNc1cccnc1 de9757e1e7a0fdccd35f1dc1824af66e [0,0,1,0,0,0|1,0,1]=3 28 B11R1.28 O/C=C\CNc1cccnn1 e52ad279909108c36bfaee0ce998c614 [0,0,1,0,0,0|2,0,1]=4 29 B11R1.28 O/C=C\CNc1ccnnc1 045c548fd4be5bb2d635592edd2bdf04 [0,0,1,0,0,0|2,0,1]=4 30 B11R1.28 O/C=C\CNc1cnccn1 42856907adf1463c572cd4925a22f64f [0,0,1,0,0,0|2,0,1]=4 31 B11R1.28 O/C=C\CNc1cncnc1 ce604438bd7dfd42b91ad2a4591afafc [0,0,1,0,0,0|2,0,1]=4 32 B11R1.41 C=Cc1ncccc1NC=O f06ac0d926f03852ca9c2a478204d4b9 [0,0,1,0,0,0|3,0,0]=4 33 B11R1.41 O=CNc1cccnc1C=O d80d7c19f5e5a0bb77f647c89c4352af [0,0,1,0,0,0|2,0,1]=4 34 B11R1.41 O=CNc1cccnc1CO 9dbd7f6688e5cea477c7b7c616617b11 [0,0,1,0,0,0|2,0,1]=4 35 B10R1.4 O=CNc1ccccc1O a5803dbb8fd09b48d1dac5606f2634e9 [1,0,1,0,0,0|1,0,1]=4 36 B10R1.4 O=CNc1cccnc1O 2b8662d82921d406bd957c952a352054 [1,0,1,0,0,0|2,0,0]=4 37 B10R1.10 O=CNc1cccc(c1)O b7034720bcdfb6e36ba15c0a5abf2a37 [1,0,1,0,0,0|2,0,0]=4 38 B10R1.17 C=CCNc1ccccc1 47db636c74d7e6cdd4488df2cb146b26 [1,0,1,0,0,0|0,0,2]=4 39 B10R1.17 C=CCNc1ccccn1 a09a0780182f6d8fa8752ca3713a2f3e [1,0,1,0,0,0|1,0,1]=4 40 B10R1.17 C=CCNc1cccnc1 91b240dd75d71a218918690927e5881a [1,0,1,0,0,0|1,0,1]=4 41 B10R1.17 C=CCOc1ccccn1 eb9f74f9d52407e143455993efad096c [1,0,1,0,0,0|1,0,1]=4 42 B10R1.17 C=CCOc1cccnc1 7fb30f1efe498d0d31dd0f3d48945875 [1,0,1,0,0,0|1,0,1]=4 43 B12R1.34 C=CC(=O)N(C)c1ccccn1 c52028e19112aae4977a4f2a8477d094 [0,1,1,0,0,0|2,0,0]=4 44 B12R1.121 C=CCNc1ccccc1CO ba2527e194b6fd3b3cfe13ccf2cb9b66 [0,1,1,0,0,0|0,0,2]=4 45 B12R1.121 C=CCNc1ccccc1OC 600c4864e94814f923ef363b0890136b [0,1,1,0,0,0|0,0,2]=4 46 B12R1.121 C=CCOc1ccccc1OC 0923a765e34f8c98d85221c0e78732aa [0,1,1,0,0,0|1,0,1]=4 47 B12R1.371 C=CC(=O)Nc1ccccc1Br e5d1f40bbb3972cd234b3d1559f149fb [0,1,1,0,0,0|1,0,1]=4 48 B12R1.371 C=CC(=O)Nc1ccccc1C acb3e10026991d61c64ba4069b9746f5 [0,1,1,0,0,0|1,0,1]=4 49 B12R1.371 C=CC(=O)Nc1ccccc1Cl 4977f0e6a6edb54dfe74c87f87185b5c [0,1,1,0,0,0|1,0,1]=4 50 B12R1.371 C=CC(=O)Nc1ccccc1F dbb2194c0b6b7ae61906b5bef156a80b [0,1,1,0,0,0|1,0,1]=4 51 B12R1.371 C=CC(=O)Nc1ccccc1I 1d2658ab33296a9656a08882644409fe [0,1,1,0,0,0|1,0,1]=4 52 B12R1.371 C=CC(=O)Nc1ccccc1O 9447ec7b0f9e158ab19bcffe70be1362 [0,1,1,0,0,0|0,0,1]=3 53 B12R1.371 C=CC(=O)Nc1ccccc1S 2b5292e4efc934dbb57e5219724c1b78 [0,1,1,0,0,0|0,1,1]=4 54 B12R1.371 C=CC(=O)Nc1cccnc1O af6cc2f157595b88ff5abc3fbf2b9540 [0,1,1,0,0,0|1,0,1]=4 55 B12R1.371 C=CC(=O)Nc1cnccc1O 05b2037b2bd2f5c811b13aa1ef46e505 [0,1,1,0,0,0|1,0,1]=4 56 B12R1.371 C=CC(=O)Nc1ncccc1O 83a4f160d7f1bdc6315eafaa92140a51 [0,1,1,0,0,0|1,0,1]=4 57 B12R1.371 O=CC(=O)Nc1ccccc1O e415f0146d0743efb0d7d2314f6f490f [0,1,1,0,0,0|1,0,1]=4 58 B12R1.28 CC=CCNc1cccc(c1)O 0ec4450758cda2ae602b2e783d8c49bd [0,1,1,0,0,0|1,0,1]=4 59 B12R1.50 C=CC(=O)Nc1cccc(c1)O d9903fc4cc32bb7c205c89ad1773e260 [0,1,1,0,0,0|2,0,0]=4 60 B12R1.50 O=CC(=O)Nc1cccc(c1)O 9b1fdea8e7c547705fd265adf6658af8 [0,1,1,0,0,0|2,0,0]=4 61 B12R1.1 Cc1ccc(cn1)NC/C=C\O a414f932e420961e10f3ca7af887f57f [0,1,1,0,0,0|1,0,1]=4 62 B12R1.1 O/C=C\CNc1ccc(nc1)Br e2d1c41440a1f2f772266194dfd3b6c8 [0,1,1,0,0,0|1,0,1]=4 63 B12R1.1 O/C=C\CNc1ccc(nc1)Cl 55cd1a2a62d87236deb094aa90949876 [0,1,1,0,0,0|1,0,1]=4 64 B12R1.1 O/C=C\CNc1ccc(nc1)F 00caf03fa4a6df82c9edd9b110f56f01 [0,1,1,0,0,0|1,0,1]=4 65 B12R1.1 O/C=C\CNc1ccc(nc1)I 92fcd63da6cff50433c5491e5b38e7cd [0,1,1,0,0,0|1,0,1]=4 66 B12R1.8 O/C=C\CNCc1cccnc1 1b127bcedabb68854c46a8dc71a531d8 [0,1,1,0,0,0|0,0,2]=4 67 B12R1.32 C/C=C/C(=O)Nc1cccnc1 8cf296947079f8325abe699420205b81 [0,1,1,0,0,0|2,0,0]=4 68 B12R1.32 O=C(/C=C/Br)Nc1cccnc1 e0ce8cbc919421bb72f7ea940bf56271 [0,1,1,0,0,0|2,0,0]=4 69 B12R1.32 O=C(/C=C/Cl)Nc1cccnc1 96da7c048845407b8e9fb3cfc8e5cbac [0,1,1,0,0,0|2,0,0]=4 70 B12R1.32 O=C(/C=C/I)Nc1cccnc1 0445bf6d14eff8a6c498774cad109552 [0,1,1,0,0,0|2,0,0]=4 71 B12R1.32 O=C(/C=C\Br)Nc1cccnc1 4801603e5da7c495f54ac2f3938251f8 [0,1,1,0,0,0|2,0,0]=4 72 B12R1.32 O=C(/C=C\Cl)Nc1cccnc1 298fb29fde194fe0e6f85b13e040d25e [0,1,1,0,0,0|2,0,0]=4 73 B12R1.32 O=C(/C=C\I)Nc1cccnc1 67a27e04e59e183ccb6ad4c1364858c5 [0,1,1,0,0,0|2,0,0]=4 74 B12R1.32 O=C(C=CBr)Nc1cccnc1 d865e25dedb2cfca6fb2b9f6e7c2f030 [0,1,1,0,0,0|2,0,0]=4 75 B12R1.32 O=C(C=CI)Nc1cccnc1 15ab4fabccc35191d29238b8766692c4 [0,1,1,0,0,0|2,0,0]=4 76 B14R2.7150 CCNc1cccc2c1nccc2 16d8e66823aead4cb4dfb3523fefe361 [0,2,0,0,0,0|1,0,0]=3 77 B14R2.7150 CCNc1cccc2c1nccn2 b08671b57b0056e2ea6ad79cebca8f59 [0,2,0,0,0,0|2,0,0]=4 78 B14R2.7150 CCNc1cccc2c1ncnc2 01d7e271751d5727f0795eb43382b99f [0,2,0,0,0,0|2,0,0]=4 79 B14R2.7150 CCNc1ccnc2c1nccc2 491f193ae65f3c761d71f00c0aa7b36c [0,2,0,0,0,0|2,0,0]=4 80 B14R2.7150 CCNc1cncc2c1nccc2 264aab5818dabe01fad0e2baff7ebba7 [0,2,0,0,0,0|2,0,0]=4 81 B14R2.7150 CCNc1nccc2c1nccc2 2204f9826d402a0b8090e1d4f71d31e2 [0,2,0,0,0,0|2,0,0]=4 82 B14R2.7150 CCOc1cccc2c1CC=CC2 0f838d40d77dcf7c2d94d58025b14e7f [0,2,0,0,0,0|1,0,1]=4 83 B14R2.7150 CCOc1cccc2c1cccc2 99a6a3a46ff0c7e3e8a1d045886b7fc6 [0,2,0,0,0,0|1,0,0]=3 84 B14R2.7150 CCOc1cccc2c1cccn2 af785ad7c99ea92e4c3fda59829da971 [0,2,0,0,0,0|2,0,0]=4 85 B14R2.7150 CCOc1cccc2c1ccnc2 651d70445fd11fabf6310cdab3b86256 [0,2,0,0,0,0|2,0,0]=4 86 B14R2.7150 CCOc1cccc2c1cncc2 4c919f362c16ec6932fd289e4ce0791c [0,2,0,0,0,0|2,0,0]=4 87 B14R2.7150 CCOc1cccc2c1nccc2 970e32578de3b39f9261281a21a4cbd5 [0,2,0,0,0,0|0,0,0]=2 88 B14R2.7150 CCOc1cccc2c1nccn2 1c2cda7a2d3ed25a0c3c32df22b8968d [0,2,0,0,0,0|1,0,0]=3 89 B14R2.7150 CCOc1cccc2c1ncnc2 95a7f1266544940a67970d2c04207a61 [0,2,0,0,0,0|1,0,0]=3 90 B14R2.7150 CCOc1ccnc2c1cccc2 2f347e7ad60e9f3f0ec1d5ffd1b6d722 [0,2,0,0,0,0|2,0,0]=4 91 B14R2.7150 CCOc1ccnc2c1nccc2 e4285e87aa0eb0b9b770c25854798d2c [0,2,0,0,0,0|1,0,0]=3 92 B14R2.7150 CCOc1cncc2c1cccc2 27e49490b2a8c68b6f80427425c7ff35 [0,2,0,0,0,0|2,0,0]=4 93 B14R2.7150 CCOc1nccc2c1cccc2 627da3d4602875a3fe121b00a52343b5 [0,2,0,0,0,0|2,0,0]=4 94 B14R2.7150 CCOc1ncnc2c1nccc2 7c87817a4df866896fbde460c111b65b [0,2,0,0,0,0|2,0,0]=4 95 B14R2.7150 FCNc1cccc2c1nccc2 23d3e4b5153bf5a765774036a29adb6e [0,2,0,0,0,0|1,0,0]=3 96 B14R2.7150 FCNc1cccc2c1nccn2 11207b39b39015386b95c8a3f613a0e9 [0,2,0,0,0,0|2,0,0]=4 97 B14R2.7150 FCNc1cccc2c1ncnc2 b37106585b6f501cc93ee63905264014 [0,2,0,0,0,0|2,0,0]=4 98 B14R2.7150 FCNc1ccnc2c1nccc2 04b530e9012f358ca5b47ab5c69c6ee9 [0,2,0,0,0,0|2,0,0]=4 99 B14R2.7150 FCNc1cncc2c1nccc2 37bfd9fba72c18f4843548bf90bddf2e [0,2,0,0,0,0|2,0,0]=4 100 B14R2.7150 FCNc1nccc2c1nccc2 2cea782ffaa5045f55dbfccab897f989 [0,2,0,0,0,0|2,0,0]=4 101 B14R2.7150 FCOc1cccc2c1CC=CC2 b04bcdba018b2dd5d9cc3a0327a85b27 [0,2,0,0,0,0|1,0,1]=4 102 B14R2.7150 FCOc1cccc2c1cccc2 342779f054d02ae865cdda589c7fc5f6 [0,2,0,0,0,0|1,0,0]=3 103 B14R2.7150 FCOc1cccc2c1cccn2 bc60e257d8bf39c602516e60821d9ba3 [0,2,0,0,0,0|2,0,0]=4 104 B14R2.7150 FCOc1cccc2c1ccnc2 cec59df269f4caa2ef5ed9214bd03180 [0,2,0,0,0,0|2,0,0]=4 105 B14R2.7150 FCOc1cccc2c1cncc2 4f2be501b75d3c06c1bea68ed3dd7881 [0,2,0,0,0,0|2,0,0]=4 106 B14R2.7150 FCOc1cccc2c1nccc2 36246ce4b6c280392aa2fe86d0ec588b [0,2,0,0,0,0|0,0,0]=2 107 B14R2.7150 FCOc1cccc2c1nccn2 bc014e790f31d6566218762d8d49c441 [0,2,0,0,0,0|1,0,0]=3 108 B14R2.7150 FCOc1ccnc2c1cccc2 d13c5010a87ab0afd69d3dc5caaa8365 [0,2,0,0,0,0|2,0,0]=4 109 B14R2.7150 FCOc1ccnc2c1nccc2 844c1047d3a11ef9cd71a99685ac0609 [0,2,0,0,0,0|1,0,0]=3 110 B14R2.7150 FCOc1cncc2c1cccc2 f9c1754966063a1cd4fcf413bdbcf931 [0,2,0,0,0,0|2,0,0]=4 111 B14R2.7150 FCOc1nccc2c1cccc2 ce59e3058552bfc442a9d2eeacb6a1cd [0,2,0,0,0,0|2,0,0]=4 112 B14R2.7150 FCOc1ncnc2c1nccc2 3fcef9229b2e57c0d0abcf4f4fd61646 [0,2,0,0,0,0|2,0,0]=4 113 B14R2.7150 O=CNc1cccc2c1nccc2 d9815af5b96430d572960e0e6b1684dd [0,2,0,0,0,0|0,0,1]=3 114 B14R2.7150 O=CNc1cccc2c1nccn2 80a0e83a1c19ea6cd06a40598cf47c96 [0,2,0,0,0,0|1,0,1]=4 115 B14R2.7150 O=CNc1cccc2c1ncnc2 128288d092bd05cfcf844c29ee7e1d78 [0,2,0,0,0,0|1,0,1]=4 116 B14R2.7150 O=CNc1ccnc2c1nccc2 975beeb5c06b407025e6311bf5bdd608 [0,2,0,0,0,0|1,0,1]=4 117 B14R2.7150 O=CNc1cncc2c1nccc2 f83d3226afdd1460b6c9d5ae6edc344d [0,2,0,0,0,0|1,0,1]=4 118 B14R2.7150 O=CNc1nccc2c1nccc2 fd3d250f7659ad35606560c76189cac4 [0,2,0,0,0,0|1,0,1]=4 119 B14R2.7150 OCNc1cccc2c1cccn2 3d08b2fcf36de2f15a47d4c41dcbb26e [0,2,0,0,0,0|2,0,0]=4 120 B14R2.7150 OCNc1cccc2c1ccnc2 82c00b0be0525deeb86fe48f328cc83d [0,2,0,0,0,0|2,0,0]=4 121 B14R2.7150 OCNc1cccc2c1cncc2 5524c0a60d5af0fb4f0b8aa12c2cca7c [0,2,0,0,0,0|2,0,0]=4 122 B14R2.7150 OCNc1cccc2c1nccc2 a22dd1786308d575389c44df6e6ca85b [0,2,0,0,0,0|0,0,0]=2 123 B14R2.7150 OCNc1cccc2c1nccn2 ad3161dd6f5eb04d06ce34ad84821b41 [0,2,0,0,0,0|1,0,0]=3 124 B14R2.7150 OCNc1cccc2c1ncnc2 47917bdac8a97bfb1b04f1ad2f3c0e0d [0,2,0,0,0,0|1,0,0]=3 125 B14R2.7150 OCNc1ccnc2c1cccc2 a08779da4076d3fd5f60f3454e86bdd0 [0,2,0,0,0,0|2,0,0]=4 126 B14R2.7150 OCNc1ccnc2c1nccc2 8ff181118becc1ccc63de0ce54325ab2 [0,2,0,0,0,0|1,0,0]=3 127 B14R2.7150 OCNc1cncc2c1cccc2 80830474b883b5ef41d16501378dbb39 [0,2,0,0,0,0|2,0,0]=4 128 B14R2.7150 OCNc1cncc2c1nccc2 a8b0ce85b3a493b138af72c8b6f9d508 [0,2,0,0,0,0|1,0,0]=3 129 B14R2.7150 OCNc1nccc2c1cccc2 5a268954e10acc1b4a8b743c0a7d82d4 [0,2,0,0,0,0|2,0,0]=4 130 B14R2.7150 OCNc1nccc2c1nccc2 9e1cc1ac96c62a703108ad6e6ab44757 [0,2,0,0,0,0|1,0,0]=3 131 B14R2.7150 OCNc1ncnc2c1nccc2 0e68207440fe9659248250366e0e0695 [0,2,0,0,0,0|2,0,0]=4 132 B12R2.2 c1c[nH]c(c1)c2ccncn2 bb9dd54dd4cfc877d78c4a1adcad3de1 [0,0,1,1,0,0|2,0,0]=4 133 B12R2.2 c1c[nH]c(c1)c2cnccn2 f63a5c864aff07f824c78b1cbae8890a [0,0,1,1,0,0|2,0,0]=4 134 B12R2.2 c1cc(ncn1)c2ccno2 e0bd74df610a1cad6e4f718ea252c13c [0,0,1,1,0,0|2,0,0]=4 135 B12R2.2 c1cc(ncn1)c2cnco2 7058f42e303e4a6ab8ef64a4b38707e1 [0,0,1,1,0,0|2,0,0]=4 136 B12R2.2 c1cc(ncn1)c2ncco2 e6c39e6dc3acf49964ef1a6fc69d1000 [0,0,1,1,0,0|2,0,0]=4 137 B12R2.2 c1ccc(cc1)c2ccc[nH]2 31571cc0c476cc0ec85253928e85f3d5 [0,0,1,1,0,0|2,0,0]=4 138 B12R2.2 c1ccc(cc1)c2ccco2 67d5bff31c39591a62f72fefb1796923 [0,0,1,1,0,0|1,0,0]=3 139 B12R2.2 c1ccc(cc1)c2cccs2 7e0ec9509785b0110be83131d3635968 [0,0,1,1,0,0|1,1,0]=4 140 B12R2.2 c1ccc(cc1)c2ccno2 43e56304d00da0163b84bc8aac75bf60 [0,0,1,1,0,0|2,0,0]=4 141 B12R2.2 c1ccc(cc1)c2cnco2 2e69350309650d294610cdfd138ca5ee [0,0,1,1,0,0|2,0,0]=4 142 B12R2.2 c1ccc(cc1)c2ncco2 a0fc7771bcc722874649153b6d011e45 [0,0,1,1,0,0|2,0,0]=4 143 B12R2.2 c1ccc(nc1)c2c[nH]cn2 f01347f1bca224d46df88c904915002e [0,0,1,1,0,0|2,0,0]=4 144 B12R2.2 c1ccc(nc1)c2cc[nH]c2 f74cf98293d9a4c3bbe1bf6c263d689e [0,0,1,1,0,0|2,0,0]=4 145 B12R2.2 c1ccc(nc1)c2cc[nH]n2 e7bb3d8914cf20c2d5968a209cefc127 [0,0,1,1,0,0|2,0,0]=4 146 B12R2.2 c1ccc(nc1)c2ccc[nH]2 cb5e87c7aff4050998d5fc84c3f38ca1 [0,0,1,1,0,0|1,0,0]=3 147 B12R2.2 c1ccc(nc1)c2ccco2 3e8cd58e5409a07e09f07e93f6992690 [0,0,1,1,0,0|0,0,0]=2 148 B12R2.2 c1ccc(nc1)c2cccs2 8c84e4b032f42e8dcf4c3e6d708b90b7 [0,0,1,1,0,0|0,1,0]=3 149 B12R2.2 c1ccc(nc1)c2ccno2 336b02d275c6e8f22c9afb3fe4a2cfaf [0,0,1,1,0,0|1,0,0]=3 150 B12R2.2 c1ccc(nc1)c2ccns2 fc09cedecb6fa24d367fc6c44dede961 [0,0,1,1,0,0|1,1,0]=4 151 B12R2.2 c1ccc(nc1)c2ccoc2 78eb81bf60a9fc34410a89a0c45bf08b [0,0,1,1,0,0|2,0,0]=4 152 B12R2.2 c1ccc(nc1)c2ccon2 bb92ed797f2b4d6d4a7ed94ca95ee315 [0,0,1,1,0,0|2,0,0]=4 153 B12R2.2 c1ccc(nc1)c2ccsc2 1611da139dcb69724e7516cf2d0451ab [0,0,1,1,0,0|2,0,0]=4 154 B12R2.2 c1ccc(nc1)c2ccsn2 165e62b535fa07791d543312e782f65d [0,0,1,1,0,0|2,0,0]=4 155 B12R2.2 c1ccc(nc1)c2cnco2 3202bb0835a1a05a036919f9000f25da [0,0,1,1,0,0|1,0,0]=3 156 B12R2.2 c1ccc(nc1)c2cncs2 ab40ce0282255bc3cc27c0e624e381b6 [0,0,1,1,0,0|1,1,0]=4 157 B12R2.2 c1ccc(nc1)c2cocn2 86e22f0f6c8d3ddeaa9bd6ffa155e21e [0,0,1,1,0,0|2,0,0]=4 158 B12R2.2 c1ccc(nc1)c2cscn2 e129aba36d844f9ac19658e4dd4d3281 [0,0,1,1,0,0|2,0,0]=4 159 B12R2.2 c1ccc(nc1)c2ncc[nH]2 aab142407ea0b2c9f8b48ab859161f82 [0,0,1,1,0,0|2,0,0]=4 160 B12R2.2 c1ccc(nc1)c2ncco2 f21c13d9cf6fa164f87e9d9abc78c534 [0,0,1,1,0,0|1,0,0]=3 161 B12R2.2 c1ccc(nc1)c2nccs2 ad6dcfe66d522496208c4fc604a40100 [0,0,1,1,0,0|1,1,0]=4 162 B12R2.2 c1ccc(nc1)c2nnco2 89542b61803a95a76b3c18cccf300699 [0,0,1,1,0,0|2,0,0]=4 163 B12R2.2 c1cnc(cn1)c2ccno2 ce8f925c76e52811ee938ac6a1df7cde [0,0,1,1,0,0|2,0,0]=4 164 B12R2.2 c1cnc(cn1)c2cnco2 6f2d20277c4e6b6e6255d75761b79703 [0,0,1,1,0,0|2,0,0]=4 165 B12R2.2 c1cnc(cn1)c2ncco2 a63159b7f2b5ec5fd3e3592e01cbfbe6 [0,0,1,1,0,0|2,0,0]=4 166 B12R2.2 c1cnc(nc1)c2ccc[nH]2 0294bc0d7f2c84bea684348898a67e15 [0,0,1,1,0,0|2,0,0]=4 167 B12R2.2 c1cnc(nc1)c2ccco2 84f0205c6776c1fbc1051f2ec8b0e2b9 [0,0,1,1,0,0|1,0,0]=3 168 B12R2.2 c1cnc(nc1)c2cccs2 a9ccff2429c4095fb8993993a4e8c0fa [0,0,1,1,0,0|1,1,0]=4 169 B12R2.2 c1cnc(nc1)c2ccno2 f0919bc55d0592eb0e3c47927fb3a110 [0,0,1,1,0,0|2,0,0]=4 170 B12R2.2 c1cnc(nc1)c2cnco2 3be6c69352687c679696f5ba26543519 [0,0,1,1,0,0|2,0,0]=4 171 B12R2.2 c1cnc(nc1)c2ncco2 8cc801bfbb3362999fac8a09f884b6c7 [0,0,1,1,0,0|2,0,0]=4 172 B12R2.2 c1cncc(c1)c2ccco2 fa36aaa20f1537d247a60065bd2ee876 [0,0,1,1,0,0|2,0,0]=4 173 B12R2.2 c1cnnc(c1)c2ccc[nH]2 fd210710e2b25dc945d6e30e2a46d4ea [0,0,1,1,0,0|2,0,0]=4 174 B12R2.2 c1cnnc(c1)c2ccco2 1fe9ac9272cdbd2c4552671c407d5284 [0,0,1,1,0,0|1,0,0]=3 175 B12R2.2 c1cnnc(c1)c2cccs2 79a0d33f5c3f66871eb58b86064dc7ef [0,0,1,1,0,0|1,1,0]=4 176 B12R2.2 c1cnnc(c1)c2ccno2 2c414e4dd9e97d8e0a680e5f29b66e62 [0,0,1,1,0,0|2,0,0]=4 177 B12R2.2 c1cnnc(c1)c2cnco2 7ed638cc6d1790e472542491675845c5 [0,0,1,1,0,0|2,0,0]=4 178 B12R2.2 c1cnnc(c1)c2ncco2 c6e9df8cb0d0dd273279e0d124a65f84 [0,0,1,1,0,0|2,0,0]=4 179 B12R2.2 c1coc(c1)c2ccncc2 b9d30f2c4c38ab1839aa84182e7bb82c [0,0,1,1,0,0|2,0,0]=4 180 B12R2.2 c1coc(c1)c2ccncn2 45e42c205c426e759672538885402236 [0,0,1,1,0,0|1,0,0]=3 181 B12R2.2 c1coc(c1)c2cnccn2 f58ce8e736550bc4d2dbd703da0e9baf [0,0,1,1,0,0|1,0,0]=3 182 B12R2.2 c1coc(c1)c2cncnn2 4557cf22342578ea624e5684b951f3cb [0,0,1,1,0,0|2,0,0]=4 183 B12R2.2 c1csc(c1)c2ccncn2 4ddc1a913c16debdf47c9708a2c0e9ca [0,0,1,1,0,0|1,1,0]=4 184 B12R2.2 c1csc(c1)c2cnccn2 9f6ca4d6444da49d7969f43433db9d5a [0,0,1,1,0,0|1,1,0]=4