0 B10R1.18 CC(=O)Nc1cccnc1 3ff4f8eaa45b955bdc1d480af270b630 [0,0,0,0,0,0|2,0,1]=3 1 B10R1.18 CC(=O)Nc1cccnn1 0f494122953745d5434019dc2597dec3 [0,0,0,0,0,0|3,0,1]=4 2 B10R1.18 CC(=O)Nc1ccnnc1 13b7327c392c1dda0e0267bb7d63e990 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.18 CC(=O)Nc1cnccn1 de63828007b663ee737a5f03044b51d4 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.18 CC(C)CN1CC=CCC1 d929b51370027b898acd2e6edf4ec0d4 [0,0,0,0,0,0|2,0,2]=4 5 B10R1.18 CC(C)Nc1ccccc1 678b2595d663b993cd638fb4df86366a [0,0,0,0,0,0|2,0,0]=2 6 B10R1.18 CC(C)Nc1ccccn1 8f41ba2831fdc97ef841b17526dcf604 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.18 CC(C)Nc1cccnc1 b32b013363863cea153240b96e97c19f [0,0,0,0,0,0|1,0,0]=1 8 B10R1.18 CC(C)Nc1cccnn1 7e8e9cb3fe00dc0cd26a09d7d65a05b1 [0,0,0,0,0,0|2,0,0]=2 9 B10R1.18 CC(C)Nc1ccncc1 ed919cf6533ea85c87fe5a974cf5c4b4 [0,0,0,0,0,0|3,0,0]=3 10 B10R1.18 CC(C)Nc1ccncn1 069107b8df99cf2ce1a28de8ff12b3bc [0,0,0,0,0,0|4,0,0]=4 11 B10R1.18 CC(C)Nc1ccnnc1 ca5f97416f9a66603da37ac043765b94 [0,0,0,0,0,0|2,0,0]=2 12 B10R1.18 CC(C)Nc1cnccn1 58156a1e8faa75eacf930a892d9c44a0 [0,0,0,0,0,0|2,0,0]=2 13 B10R1.18 CC(C)Nc1cncnc1 58c88f3a700af3acdb4e2b5e448ab47a [0,0,0,0,0,0|2,0,0]=2 14 B10R1.18 CC(C)Nc1cnncn1 00c822f77f4b25d3559c239bdf91bd98 [0,0,0,0,0,0|3,0,0]=3 15 B10R1.18 CC(C)Nc1ncccn1 b6e51d4ce55bed0a9644a5fb30715e8d [0,0,0,0,0,0|4,0,0]=4 16 B10R1.18 CC(C)Nc1nccnn1 9d7094c1641b452d6a07a9ee90930c9f [0,0,0,0,0,0|3,0,0]=3 17 B10R1.18 CC(C)Oc1ccccn1 0855bdc27823287e98107cda25a8e4de [0,0,0,0,0,0|3,0,0]=3 18 B10R1.18 CC(C)Oc1cccnc1 2d5fbf8b6573bcaaa6ad1437daf348fa [0,0,0,0,0,0|1,0,0]=1 19 B10R1.18 CC(C)Oc1ccncc1 fcbd1de824cfd0b7040632344868de57 [0,0,0,0,0,0|3,0,0]=3 20 B10R1.18 CC(C)Oc1ccnnc1 5f378768fb399f97727c7d2434a4ccad [0,0,0,0,0,0|2,0,0]=2 21 B10R1.18 CC(C)Oc1cnccn1 f445429d4d0106398179ba53f8ca2052 [0,0,0,0,0,0|2,0,0]=2 22 B10R1.18 CC(C)Oc1cncnc1 987ff7423f824d1dd79f18db733241ff [0,0,0,0,0,0|2,0,0]=2 23 B10R1.18 CC(C)Oc1ncccn1 9c1a5b776824ae13ad1499e2cad8b03a [0,0,0,0,0,0|4,0,0]=4 24 B9R1.8 CCNc1ccccc1 33257e4a9e1d882742dfd4cfddb78cda [1,0,0,0,0,0|2,0,0]=3 25 B9R1.8 CCNc1ccccn1 2525c23bd886b96c78c0be1e9ad1905b [1,0,0,0,0,0|3,0,0]=4 26 B9R1.8 CCNc1cccnc1 e16c06cad87ecb5a3a4a58b6d8537631 [1,0,0,0,0,0|1,0,0]=2 27 B9R1.8 CCNc1cccnn1 8ce46420a68f085572db040256d5d2b7 [1,0,0,0,0,0|2,0,0]=3 28 B9R1.8 CCNc1ccncc1 76118d388bf159fc52a5b3b43773c6d0 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.8 CCNc1ccnnc1 84df08ea46526da8091efc8e7dc98bc3 [1,0,0,0,0,0|2,0,0]=3 30 B9R1.8 CCNc1cnccn1 692286fa82997f2fb685e4d3ad5b2443 [1,0,0,0,0,0|2,0,0]=3 31 B9R1.8 CCNc1cncnc1 d22064ed1cc1956224a6568ef26d5099 [1,0,0,0,0,0|2,0,0]=3 32 B9R1.8 CCNc1cnncn1 f82c088077ae7696bce842278215e142 [1,0,0,0,0,0|3,0,0]=4 33 B9R1.8 CCNc1nccnn1 de6c00a96ec865d94fb0210d389d00df [1,0,0,0,0,0|3,0,0]=4 34 B9R1.8 CCOc1ccccn1 8b10ed115fcb5b65f209d3b07c05b728 [1,0,0,0,0,0|3,0,0]=4 35 B9R1.8 CCOc1cccnc1 efa582b018c37c3ab155936515b551ea [1,0,0,0,0,0|1,0,0]=2 36 B9R1.8 CCOc1ccncc1 365c1eef106f5326bc3144a980f01ba5 [1,0,0,0,0,0|3,0,0]=4 37 B9R1.8 CCOc1ccnnc1 495bf99ef1353fb62f88bfe5786129d6 [1,0,0,0,0,0|2,0,0]=3 38 B9R1.8 CCOc1cnccn1 aa9d1d61b4f8dce5da42fe3ddcc6df85 [1,0,0,0,0,0|2,0,0]=3 39 B9R1.8 CCOc1cncnc1 8629022d8ea6564de249e44f3cfd1da9 [1,0,0,0,0,0|2,0,0]=3 40 B9R1.8 CCOc1cncnn1 c9814c00ede749a4f13c3c62d7c87882 [1,0,0,0,0,0|3,0,0]=4 41 B9R1.8 FCNc1ccccc1 c8185de2a7206057ede93409452a493c [1,0,0,0,0,0|3,0,0]=4 42 B9R1.8 FCNc1cccnc1 cd4b988ac9022e9beb52f2fd6e6d3819 [1,0,0,0,0,0|2,0,0]=3 43 B9R1.8 FCNc1cccnn1 b8bf7f385d541b86a7f5923a27fa760f [1,0,0,0,0,0|3,0,0]=4 44 B9R1.8 FCNc1ccnnc1 bbb607e362c8df8df0e1a73eff88c7de [1,0,0,0,0,0|3,0,0]=4 45 B9R1.8 FCNc1cnccn1 3cbe94cf9594c68ec8b94825e8905ed8 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.8 FCNc1cncnc1 49689598886657fafe98ac3f8f7ecc0b [1,0,0,0,0,0|3,0,0]=4 47 B9R1.8 FCOc1cccnc1 613341899f57b52454964b4cd6fd2e82 [1,0,0,0,0,0|2,0,0]=3 48 B9R1.8 FCOc1ccnnc1 05f5ab7b1fae92c97a253676b278beab [1,0,0,0,0,0|3,0,0]=4 49 B9R1.8 FCOc1cnccn1 e656ed16372ac6d21dfc0a12172339fc [1,0,0,0,0,0|3,0,0]=4 50 B9R1.8 FCOc1cncnc1 dbacbc810d9b1ecd830119e3cd67df78 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.8 O=CNc1cccnc1 355201612949cfa8d6342c6af1c523a5 [1,0,0,0,0,0|2,0,1]=4 52 B9R1.8 OCNc1ccccc1 6a26daba1a11b7282126aadb7f7b8f97 [1,0,0,0,0,0|3,0,0]=4 53 B9R1.8 OCNc1cccnc1 68add967e09ec2eee2b71061a3bb94f5 [1,0,0,0,0,0|2,0,0]=3 54 B9R1.8 OCNc1cccnn1 d8959988e09873d44f8b640f1fe386e3 [1,0,0,0,0,0|3,0,0]=4 55 B9R1.8 OCNc1ccnnc1 3894cb787e7b8600c63a04771d062bff [1,0,0,0,0,0|3,0,0]=4 56 B9R1.8 OCNc1cnccn1 a22ea0b3c17d02d754f571b9860bc923 [1,0,0,0,0,0|3,0,0]=4 57 B9R1.8 OCNc1cncnc1 f94e24e43a9b982a2515c894be0cdeee [1,0,0,0,0,0|3,0,0]=4 58 B11R1.20 CC(=O)Nc1ccc(nc1)C 99de9776e76b302c70f1b2299cc60df4 [0,1,0,0,0,0|2,0,1]=4 59 B11R1.20 CC(=O)Nc1ccc(nc1)F d95b06008ed9858976947678a788c0d4 [0,1,0,0,0,0|2,0,1]=4 60 B11R1.20 CC(=O)Nc1ccc(nc1)I 4875ca9d40de97c8bc9a2f1b043085ee [0,1,0,0,0,0|2,0,1]=4 61 B11R1.20 CC(C)Nc1ccc(=O)[nH]c1 63657213ff6b579908dedea051a64186 [0,1,0,0,0,0|1,0,1]=3 62 B11R1.20 CC(C)Nc1ccc(cc1)Br e5f70783ec71726153c102e5801f7c8a [0,1,0,0,0,0|2,0,0]=3 63 B11R1.20 CC(C)Nc1ccc(cc1)Cl b33a847c825901d9dbcf3f8815c5869c [0,1,0,0,0,0|2,0,0]=3 64 B11R1.20 CC(C)Nc1ccc(cc1)F 689ddbde83a9a9429aa2388668fed19a [0,1,0,0,0,0|2,0,0]=3 65 B11R1.20 CC(C)Nc1ccc(cc1)I fa67ab606e8380aaae6be79fda5faf68 [0,1,0,0,0,0|2,0,0]=3 66 B11R1.20 CC(C)Nc1ccc(cc1)S e681327c1f8eccf785cd674735bc98be [0,1,0,0,0,0|2,0,0]=3 67 B11R1.20 CC(C)Nc1ccc(cn1)Br 9b1d22e0d0da20412cc097462da94620 [0,1,0,0,0,0|3,0,0]=4 68 B11R1.20 CC(C)Nc1ccc(cn1)Cl 5ae73597a5a1fa64ce292b318939abee [0,1,0,0,0,0|3,0,0]=4 69 B11R1.20 CC(C)Nc1ccc(cn1)F 6d484441b7055ef582d9e9fe1a736c28 [0,1,0,0,0,0|3,0,0]=4 70 B11R1.20 CC(C)Nc1ccc(cn1)I d7825663ab6a7ded0de82b19c2a89f36 [0,1,0,0,0,0|3,0,0]=4 71 B11R1.20 CC(C)Nc1ccc(nc1)Br a219ac4b34332eb3738a2d60093d25ca [0,1,0,0,0,0|1,0,0]=2 72 B11R1.20 CC(C)Nc1ccc(nc1)Cl cd874efcc56ef7f4e81f67a347da5256 [0,1,0,0,0,0|1,0,0]=2 73 B11R1.20 CC(C)Nc1ccc(nc1)F e5037e278c2deb1da56d4dd59d5edb3e [0,1,0,0,0,0|1,0,0]=2 74 B11R1.20 CC(C)Nc1ccc(nn1)Br 9300d74efb4bfa8eea46726e009a97ee [0,1,0,0,0,0|2,0,0]=3 75 B11R1.20 CC(C)Nc1ccc(nn1)Cl 5b527c05258f457b8939c2fb6f0c8530 [0,1,0,0,0,0|2,0,0]=3 76 B11R1.20 CC(C)Nc1ccc(nn1)F 03736295aa8a1cb85dc5ef0d9c473b8f [0,1,0,0,0,0|2,0,0]=3 77 B11R1.20 CC(C)Nc1ccc(nn1)I 543520b4c9b56ee98ab74b6573e76295 [0,1,0,0,0,0|2,0,0]=3 78 B11R1.20 CC(C)Nc1cnc(=O)[nH]c1 5b45c35c1194a8fd5e035367d4d905a3 [0,1,0,0,0,0|2,0,0]=3 79 B11R1.20 CC(C)Nc1cnc(cn1)Br 26fffbec766594256dcde64570cbc673 [0,1,0,0,0,0|2,0,0]=3 80 B11R1.20 CC(C)Nc1cnc(cn1)Cl 4ba16f1ce0f257859cc1f9ba0a86b78c [0,1,0,0,0,0|2,0,0]=3 81 B11R1.20 CC(C)Nc1cnc(cn1)I fd7d69d98edf876e2c615a37a4f4879b [0,1,0,0,0,0|2,0,0]=3 82 B11R1.20 CC(C)Nc1cnc(nc1)Br 12a16084fff13a49df9b1bb3b597bf90 [0,1,0,0,0,0|2,0,0]=3 83 B11R1.20 CC(C)Nc1cnc(nc1)Cl eff09b8f7596d1cc8bad83f546973024 [0,1,0,0,0,0|2,0,0]=3 84 B11R1.20 CC(C)Nc1cnc(nc1)I 4cd5cc0fc825615bb699b3d5a521ac1c [0,1,0,0,0,0|2,0,0]=3 85 B11R1.20 CC(C)Nc1ncc(nn1)Br 0ef4f4bb2a0f0ac3f95a924756dcfe93 [0,1,0,0,0,0|3,0,0]=4 86 B11R1.20 CC(C)Oc1ccc(cc1)Br c830042d81f1762ab02a381b9eac79a4 [0,1,0,0,0,0|2,0,0]=3 87 B11R1.20 CC(C)Oc1ccc(cc1)Cl 7f20d83f4f9b33a7fd797ee07caaf887 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.20 CC(C)Oc1ccc(cc1)F 4b3257094d99fffc8c1b5f1ead656595 [0,1,0,0,0,0|2,0,0]=3 89 B11R1.20 CC(C)Oc1ccc(cc1)I d09c2b32d485e0c585ea84ecec015274 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.20 CC(C)Oc1ccc(cc1)S bc2b7db7696d219aecddb9042131dcc3 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.20 CC(C)Oc1ccc(cn1)Cl 2d764f542cd850467dceb5ea7856809e [0,1,0,0,0,0|3,0,0]=4 92 B11R1.20 CC(C)Oc1ccc(cn1)F 8b718d6ec6cce88e81ab345ae3477032 [0,1,0,0,0,0|3,0,0]=4 93 B11R1.20 CC(C)Oc1ccc(cn1)I 00aba9b6fb1d651d79b062e296bef87f [0,1,0,0,0,0|3,0,0]=4 94 B11R1.20 CC(C)Oc1ccc(nc1)Br 03387980ed704f1b91f33115fdf148c9 [0,1,0,0,0,0|1,0,0]=2 95 B11R1.20 CC(C)Oc1ccc(nc1)Cl bf70b6eb15a088db8ddeb63733ed08d7 [0,1,0,0,0,0|1,0,0]=2 96 B11R1.20 CC(C)Oc1ccc(nc1)F c1100a1e2d454cfe8c3cbbc5d6e5727d [0,1,0,0,0,0|1,0,0]=2 97 B11R1.20 CC(C)Oc1ccc(nc1)I 86c15c6da9d65de15ebd86f541f4105e [0,1,0,0,0,0|1,0,0]=2 98 B11R1.20 CC(C)Oc1ccc(nn1)Br ca5abe55c45c851e797664bc3617f18c [0,1,0,0,0,0|2,0,0]=3 99 B11R1.20 CC(C)Oc1ccc(nn1)Cl 651b51b62b61604004703dab1d001021 [0,1,0,0,0,0|2,0,0]=3 100 B11R1.20 CC(C)Oc1cnc(cn1)Br 91d4eb535db1ce7bf9be0fa4b9feb81e [0,1,0,0,0,0|2,0,0]=3 101 B11R1.20 CC(C)Oc1cnc(cn1)Cl 8f1446e401eb34f52484f721e9cf817f [0,1,0,0,0,0|2,0,0]=3 102 B11R1.20 CC(C)Oc1cnc(cn1)I 87b70644a91cf51d9b39023634698b9d [0,1,0,0,0,0|2,0,0]=3 103 B11R1.20 CC(C)Oc1cnc(nc1)Br ad8f69db62ff396d38c6de8d1ecfafc5 [0,1,0,0,0,0|2,0,0]=3 104 B11R1.20 CC(C)Oc1cnc(nc1)Cl de04b4f963f6555a0ae2c0c98d78106c [0,1,0,0,0,0|2,0,0]=3 105 B11R1.20 Cc1ccc(cc1)NC(C)C bd77af8bd7263855741bad7d9283a59e [0,1,0,0,0,0|2,0,0]=3 106 B11R1.20 Cc1ccc(cc1)OC(C)C afaa4b057d8f12ac5846fcc0accc69e4 [0,1,0,0,0,0|2,0,0]=3 107 B11R1.20 Cc1ccc(cn1)NC(C)C 743454483328eed9afd36a5108a5fde3 [0,1,0,0,0,0|1,0,0]=2 108 B11R1.20 Cc1ccc(cn1)OC(C)C 587bf2eefeb78be461683015f0e1ab8b [0,1,0,0,0,0|1,0,0]=2 109 B11R1.20 Cc1ccc(nc1)NC(C)C 2fd0646075e4e7895badb9a91550ac5c [0,1,0,0,0,0|3,0,0]=4 110 B11R1.20 Cc1ccc(nc1)OC(C)C daaa0dc9632c23fcd00a8fbb104724aa [0,1,0,0,0,0|3,0,0]=4 111 B11R1.20 Cc1ccc(nn1)NC(C)C 6487fd6105f4adae0f068b61d1fd8eca [0,1,0,0,0,0|2,0,0]=3 112 B11R1.20 Cc1ccc(nn1)OC(C)C 3a816d13ac315665579e028ef90ab3f0 [0,1,0,0,0,0|2,0,0]=3 113 B11R1.20 Cc1cnc(cn1)NC(C)C 62da4fafaa97ef8ba9f5acc424d10f86 [0,1,0,0,0,0|2,0,0]=3 114 B11R1.20 Cc1cnc(cn1)OC(C)C 8ea0bf7b568631d6ecb8058cf1ff450a [0,1,0,0,0,0|2,0,0]=3 115 B11R1.20 Cc1ncc(cn1)NC(C)C 5670a0984e7163331880fbed117040f8 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.20 Cc1ncc(cn1)OC(C)C c8623025f78d21d543d230fe689706e7 [0,1,0,0,0,0|2,0,0]=3 117 B11R1.36 CC(=O)N(C)c1cccnc1 99d370e4887dccbc66fa5e316a815456 [0,1,0,0,0,0|2,0,1]=4 118 B11R1.36 CC(C)N(C)c1ccnnc1 916b841b082b9c56209004d8f80d6411 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.36 CC(C)N(C)c1nccnn1 86ce7014ad5046a842638b44b6a6e404 [0,1,0,0,0,0|3,0,0]=4 120 B11R1.40 C#CC(C)Nc1cccnc1 cfbe38280031a5b1bea7126930aebd77 [0,1,0,0,0,0|1,0,1]=3 121 B11R1.40 C#CC(C)Nc1cccnn1 af88c3f898952aa82abf99c938b53096 [0,1,0,0,0,0|2,0,1]=4 122 B11R1.40 C#CC(C)Nc1cnccn1 0890d9b24b473fe758e6199edc8a0881 [0,1,0,0,0,0|2,0,1]=4 123 B11R1.40 C=CC(C)Nc1ccccc1 11c4f91eafeb8b3d7c22c97a0ea92d57 [0,1,0,0,0,0|2,0,1]=4 124 B11R1.40 C=CC(C)Nc1cccnc1 103a7e1883d7a333825583600980cdee [0,1,0,0,0,0|1,0,1]=3 125 B11R1.40 C=CC(C)Nc1cccnn1 dc6a1aba96fa4e8b75fa66f85b1d807b [0,1,0,0,0,0|2,0,1]=4 126 B11R1.40 C=CC(C)Nc1ccnnc1 a6599ef6d455dd84723af3ffd1bcef4c [0,1,0,0,0,0|2,0,1]=4 127 B11R1.40 C=CC(C)Nc1cnccn1 2ce38d7c68482d190f46e4388093ba1c [0,1,0,0,0,0|2,0,1]=4 128 B11R1.40 C=CC(C)Nc1cncnc1 08bccc2dac4a68d194ead45a06e2fc2e [0,1,0,0,0,0|2,0,1]=4 129 B11R1.40 C=CC(C)Oc1cccnc1 d79b86e283fff567ebdcf80f360890ce [0,1,0,0,0,0|1,0,1]=3 130 B11R1.40 C=CC(C)Oc1ccnnc1 c92abe33aea7a19d28d3335ff37f9894 [0,1,0,0,0,0|2,0,1]=4 131 B11R1.40 C=CC(C)Oc1cnccn1 08abd798f6ac8d2321e8bf93d641b019 [0,1,0,0,0,0|2,0,1]=4 132 B11R1.40 C=CC(C)Oc1cncnc1 dee2ec2d5307467eaa35b74084e49447 [0,1,0,0,0,0|2,0,1]=4 133 B11R1.40 CC(C#N)Nc1cccnc1 da7dd839df2b3e32656f7151ae7c86a2 [0,1,0,0,0,0|1,0,1]=3 134 B11R1.40 CC(C#N)Oc1cnccn1 00507718a19126ce3eaca95e14c1a595 [0,1,0,0,0,0|2,0,1]=4 135 B11R1.40 CC(C=O)Nc1ccccc1 0d04ec44ee6fe8b8d4f3d71cd15333ba [0,1,0,0,0,0|2,0,1]=4 136 B11R1.40 CC(C=O)Nc1cccnc1 d9c7b2b4935781413d4a985313466b9b [0,1,0,0,0,0|1,0,1]=3 137 B11R1.40 CC(C=O)Nc1cccnn1 f41444e7551c51087a4ae36908695441 [0,1,0,0,0,0|2,0,1]=4 138 B11R1.40 CC(C=O)Nc1ccnnc1 7135314c77e1e7a01a51892873433fbf [0,1,0,0,0,0|2,0,1]=4 139 B11R1.40 CC(C=O)Nc1cnccn1 ca669a34fd29c06e16c362add7ff1bce [0,1,0,0,0,0|2,0,1]=4 140 B11R1.40 CC(C=O)Nc1cncnc1 dbf6707db9d2a7b2f1e17b219fabb075 [0,1,0,0,0,0|2,0,1]=4 141 B11R1.40 CC(C=O)Oc1cccnc1 e37888c7c991d828e39da1a6807dceaa [0,1,0,0,0,0|1,0,1]=3 142 B11R1.40 CC(C=O)Oc1ccnnc1 960d99b225fc0dbb7b516ae7293716c1 [0,1,0,0,0,0|2,0,1]=4 143 B11R1.40 CC(C=O)Oc1cnccn1 e77f8a263c09c3973bbf702d318415d9 [0,1,0,0,0,0|2,0,1]=4 144 B11R1.40 CC(C=O)Oc1cncnc1 92b7c4fa798d11354a923083f00d0aa7 [0,1,0,0,0,0|2,0,1]=4 145 B11R1.40 CC(CO)Nc1ccccc1 28944821b2a2502f940043c73e5bee97 [0,1,0,0,0,0|2,0,0]=3 146 B11R1.40 CC(CO)Nc1ccccn1 2e21620844440b7bb083395c24fa5d12 [0,1,0,0,0,0|3,0,0]=4 147 B11R1.40 CC(CO)Nc1cccnc1 1993973453fc1c9eb0295a2e45197541 [0,1,0,0,0,0|1,0,0]=2 148 B11R1.40 CC(CO)Nc1cccnn1 fb9d6dc59f436ead150c6d9d000776a9 [0,1,0,0,0,0|2,0,0]=3 149 B11R1.40 CC(CO)Nc1ccncc1 014df859a1aaecd67e68db71b7c7ef69 [0,1,0,0,0,0|3,0,0]=4 150 B11R1.40 CC(CO)Nc1ccnnc1 a72883531d0bea58a80b868b64a69708 [0,1,0,0,0,0|2,0,0]=3 151 B11R1.40 CC(CO)Nc1cnccn1 bca12c198f8b3dcf3474883c473e477a [0,1,0,0,0,0|2,0,0]=3 152 B11R1.40 CC(CO)Nc1cnncn1 fa7e8b8d71a3d3e1e1704982d8ed5739 [0,1,0,0,0,0|3,0,0]=4 153 B11R1.40 CC(CO)Nc1nccnn1 4056310548b07b1de0ae9d16861121cd [0,1,0,0,0,0|3,0,0]=4 154 B11R1.40 CCC(=O)Nc1cccnc1 3f3732eaee579e7903ad30638bf6459b [0,1,0,0,0,0|2,0,1]=4 155 B11R1.40 CCC(C)Nc1ccccc1 0d73dedeab1dd8f5149c3124f0b802dc [0,1,0,0,0,0|2,0,0]=3 156 B11R1.40 CCC(C)Nc1ccccn1 bb895d27f1d9ed94ab4cd5f93b01f0bd [0,1,0,0,0,0|3,0,0]=4 157 B11R1.40 CCC(C)Nc1cccnc1 a0e745f4d44915557790daf72381f523 [0,1,0,0,0,0|1,0,0]=2 158 B11R1.40 CCC(C)Nc1cccnn1 ff06696cf74f270fdba143978c62ac27 [0,1,0,0,0,0|2,0,0]=3 159 B11R1.40 CCC(C)Nc1ccncc1 8150e11adca204128a3ae62428597250 [0,1,0,0,0,0|3,0,0]=4 160 B11R1.40 CCC(C)Nc1ccnnc1 b2cd78b0e4e493fc8fc7fd660daa28ea [0,1,0,0,0,0|2,0,0]=3 161 B11R1.40 CCC(C)Nc1cnccn1 218f39b97d2fc8b56d7c106256492dff [0,1,0,0,0,0|2,0,0]=3 162 B11R1.40 CCC(C)Nc1cncnc1 c613a4573f5f5c49698cbf707a287ecf [0,1,0,0,0,0|2,0,0]=3 163 B11R1.40 CCC(C)Nc1cnncn1 b4ae1832d341449951660973d36dd2a7 [0,1,0,0,0,0|3,0,0]=4 164 B11R1.40 CCC(C)Nc1nccnn1 7aafbe768b9876c6c10b1c269bfe3a67 [0,1,0,0,0,0|3,0,0]=4 165 B11R1.40 CCC(C)Oc1ccccn1 b8b4a806c6af90298cf0d1454fda0647 [0,1,0,0,0,0|3,0,0]=4 166 B11R1.40 CCC(C)Oc1cccnc1 ea8ea3a935f9f1da0dc64162c872e010 [0,1,0,0,0,0|1,0,0]=2 167 B11R1.40 CCC(C)Oc1ccncc1 0e7c13edf9ed6b6addf466a3a8481e15 [0,1,0,0,0,0|3,0,0]=4 168 B11R1.40 CCC(C)Oc1ccnnc1 2c1374a060c2205ba338192573bcdf4f [0,1,0,0,0,0|2,0,0]=3 169 B11R1.40 CCC(C)Oc1cnccn1 259d43a94fcc1396cf4ed5279619bad5 [0,1,0,0,0,0|2,0,0]=3 170 B11R1.40 CCC(C)Oc1cncnc1 1927eda9da52994d7329db955284990c [0,1,0,0,0,0|2,0,0]=3 171 B11R1.40 CCC(C)Oc1cncnn1 c022991dbc7528d89b1ea0e28f6ee210 [0,1,0,0,0,0|3,0,0]=4 172 B11R1.40 CCN(C)Cc1ccccc1 c214a7b7c23665abe56278baaf98348b [0,1,0,0,0,0|2,0,0]=3 173 B11R1.40 CCN(C)Cc1ccccn1 e347cf6623c9ce49a1c94570b5d3844c [0,1,0,0,0,0|3,0,0]=4 174 B11R1.40 CCN(C)Cc1cccnc1 69e9bc72fe902e2c097b1bc797c43254 [0,1,0,0,0,0|1,0,0]=2 175 B11R1.40 CCN(C)Cc1cccnn1 ba8363aad2effd2a40895558d9f7d2cc [0,1,0,0,0,0|2,0,0]=3 176 B11R1.40 CCN(C)Cc1ccncc1 ebfb44d53a95f23536771c3c1b41adfd [0,1,0,0,0,0|3,0,0]=4 177 B11R1.40 CCN(C)Cc1ccnnc1 2d7fc4ef14b48a5f88ce788ec9f32499 [0,1,0,0,0,0|2,0,0]=3 178 B11R1.40 CCN(C)Cc1cnccn1 13139f85f2c80541c7a741660f0206e2 [0,1,0,0,0,0|2,0,0]=3 179 B11R1.40 CCN(C)Cc1cncnc1 708e19b320a4a94b647d87d87781bb66 [0,1,0,0,0,0|2,0,0]=3 180 B11R1.40 CC[C@@H](C)Nc1ccccc1 405a065880ecff40d5c3aba49f23a60f [0,1,0,0,0,0|2,0,0]=3 181 B11R1.40 CC[C@@H](C)Nc1cccnc1 d5c354fec9aa4824593a6aa370b31f97 [0,1,0,0,0,0|1,0,0]=2 182 B11R1.40 CC[C@H](C)Nc1ccccc1 bdf0fca4eb541010d4b75cf2b0618571 [0,1,0,0,0,0|2,0,0]=3 183 B11R1.40 CC[C@H](C)Nc1cccnc1 a188aeb369243191dc243d4fb98ce075 [0,1,0,0,0,0|1,0,0]=2 184 B11R1.40 CN(C=O)Cc1ccccc1 701ed8237afa851586621908f176512f [0,1,0,0,0,0|2,0,1]=4 185 B11R1.40 CN(C=O)Cc1cccnc1 ffa035f03a82f49c9d004e6e7105924f [0,1,0,0,0,0|1,0,1]=3 186 B11R1.40 CN(C=O)Cc1ccnnc1 6aa9c7337d8579b656d7d9ee8da74d21 [0,1,0,0,0,0|2,0,1]=4 187 B11R1.40 CN(C=O)Cc1cnccn1 b9f2001685a2ed99942d5f26418f6b7e [0,1,0,0,0,0|2,0,1]=4 188 B11R1.40 CN(C=O)Cc1cncnc1 cefad9e7e848a34b6a841a561710dec7 [0,1,0,0,0,0|2,0,1]=4 189 B11R1.40 CN(CF)Cc1ccccc1 5e57d186c6f316353ffa6c809cb61d75 [0,1,0,0,0,0|2,0,0]=3 190 B11R1.40 CN(CF)Cc1ccccn1 0fb6d4fca1ae3b36d4aab61bd5289947 [0,1,0,0,0,0|3,0,0]=4 191 B11R1.40 CN(CF)Cc1cccnc1 da4d9171379b3361244699d43a3a0472 [0,1,0,0,0,0|1,0,0]=2 192 B11R1.40 CN(CF)Cc1ccncc1 81b0e7813544135aff8022710b2af4c1 [0,1,0,0,0,0|3,0,0]=4 193 B11R1.40 CN(CF)Cc1ccnnc1 7b47ba4d179b178f704e260951cae4b1 [0,1,0,0,0,0|2,0,0]=3 194 B11R1.40 CN(CF)Cc1cnccn1 d828fc4f5274d45411baef854e240efe [0,1,0,0,0,0|2,0,0]=3 195 B11R1.40 CN(CF)Cc1cncnc1 57753bb3fb1553c4d8f9ef1371fe5e8d [0,1,0,0,0,0|2,0,0]=3 196 B11R1.40 CN(CO)Cc1ccccc1 c1d08d2d2c7de731954ebcb428d333e2 [0,1,0,0,0,0|2,0,0]=3 197 B11R1.40 CN(CO)Cc1ccccn1 a4ef6b4247ef0972f7871752389806bb [0,1,0,0,0,0|3,0,0]=4 198 B11R1.40 CN(CO)Cc1cccnc1 bdae5dd3c0107b4a15ddef98331c4b4c [0,1,0,0,0,0|1,0,0]=2 199 B11R1.40 CN(CO)Cc1ccncc1 82d474736717cd4ad3b664282e77f89c [0,1,0,0,0,0|3,0,0]=4 200 B11R1.40 CN(CO)Cc1ccnnc1 5b5084de478571a9b183e9e107f59626 [0,1,0,0,0,0|2,0,0]=3 201 B11R1.40 CN(CO)Cc1cnccn1 2612be83cbdd1e0199b6ab3c39c473bd [0,1,0,0,0,0|2,0,0]=3 202 B11R1.40 CN(CO)Cc1cncnc1 f9d411a7c93fec4cd466924cbeb5df6d [0,1,0,0,0,0|2,0,0]=3 203 B11R1.40 C[C@@H](CO)Nc1ccccc1 d1a979ebd31c8c47073ae387eaa9c5f8 [0,1,0,0,0,0|2,0,0]=3 204 B11R1.40 C[C@@H](CO)Nc1ccccn1 9ac7427612f5553e5180ee81712e35fd [0,1,0,0,0,0|3,0,0]=4 205 B11R1.40 C[C@@H](CO)Nc1cccnc1 b4b83540aa924934ce25b37024c4f475 [0,1,0,0,0,0|1,0,0]=2 206 B11R1.40 C[C@@H](CO)Nc1cccnn1 9f042c1373662f7bcf04444b6615ba81 [0,1,0,0,0,0|2,0,0]=3 207 B11R1.40 C[C@@H](CO)Nc1ccncc1 495de922b28b07b689b24b08a715b1b6 [0,1,0,0,0,0|3,0,0]=4 208 B11R1.40 C[C@@H](CO)Nc1ccnnc1 315cca37f2c47b9fb75c2b878b513097 [0,1,0,0,0,0|2,0,0]=3 209 B11R1.40 C[C@@H](CO)Nc1cnccn1 54f606e098d7069b6301fbd7ff24023c [0,1,0,0,0,0|2,0,0]=3 210 B11R1.40 C[C@@H](CO)Nc1cnncn1 006c50fa1defe05a5bc68519dbbd528b [0,1,0,0,0,0|3,0,0]=4 211 B11R1.40 C[C@@H](CO)Nc1nccnn1 77b9669b58c9059bfaacabc1ccf79acc [0,1,0,0,0,0|3,0,0]=4 212 B11R1.40 C[C@H](C=O)Nc1ccccc1 10a4433daba67da13987d6e7cd5b7f0f [0,1,0,0,0,0|2,0,1]=4 213 B11R1.40 C[C@H](C=O)Nc1cccnc1 fedeaeec69f602e704c38cd1adea1d8e [0,1,0,0,0,0|1,0,1]=3 214 B11R1.40 C[C@H](C=O)Nc1cccnn1 d5dc60d8cb88bbcccc9cff59b5cb66c4 [0,1,0,0,0,0|2,0,1]=4 215 B11R1.40 C[C@H](C=O)Nc1ccnnc1 63246a98e993a20f559f25157e6aa6df [0,1,0,0,0,0|2,0,1]=4 216 B11R1.40 C[C@H](C=O)Nc1cnccn1 4c60062904b679381801663797286554 [0,1,0,0,0,0|2,0,1]=4 217 B11R1.40 C[C@H](C=O)Nc1cncnc1 bc55ecbf47eebf35db495bd6302ccf88 [0,1,0,0,0,0|2,0,1]=4 218 B11R1.40 C[C@H](C=O)Oc1cccnc1 55db0365e7488258d11fe983dbcaf255 [0,1,0,0,0,0|1,0,1]=3 219 B11R1.40 C[C@H](C=O)Oc1ccnnc1 d7a4fb9bbc6f8e4add0462267acb3f34 [0,1,0,0,0,0|2,0,1]=4 220 B11R1.40 C[C@H](C=O)Oc1cnccn1 b9a474b6d34bbaaa48c5d556feded984 [0,1,0,0,0,0|2,0,1]=4 221 B11R1.40 C[C@H](C=O)Oc1cncnc1 62af53ecbbc06f256097a3ea5ee960ae [0,1,0,0,0,0|2,0,1]=4 222 B11R1.40 C[C@H](CO)Nc1ccccc1 b7592eed2c2b10dda06f47547223c567 [0,1,0,0,0,0|2,0,0]=3 223 B11R1.40 C[C@H](CO)Nc1ccccn1 01d2d5e2403842048f8ac810f41680f1 [0,1,0,0,0,0|3,0,0]=4 224 B11R1.40 C[C@H](CO)Nc1cccnc1 0388d126da012bf4a1e005fb7424e864 [0,1,0,0,0,0|1,0,0]=2 225 B11R1.40 C[C@H](CO)Nc1cccnn1 d9e3b155afcba651747dae7b699586f7 [0,1,0,0,0,0|2,0,0]=3 226 B11R1.40 C[C@H](CO)Nc1ccncc1 12aec410035ef0ee1b8933a8e56e1a8b [0,1,0,0,0,0|3,0,0]=4 227 B11R1.40 C[C@H](CO)Nc1ccnnc1 3563e889d7f294b8bea1b38e886331c4 [0,1,0,0,0,0|2,0,0]=3 228 B11R1.40 C[C@H](CO)Nc1cnccn1 ad67c5623bc833af0ed62e39411a7055 [0,1,0,0,0,0|2,0,0]=3 229 B11R1.40 C[C@H](CO)Nc1cnncn1 0124ac7430f9d51f58a12c3bb7901b37 [0,1,0,0,0,0|3,0,0]=4 230 B11R1.40 C[C@H](CO)Nc1nccnn1 d226497317c47bb130c42c6cfa0e4b4d [0,1,0,0,0,0|3,0,0]=4 231 B11R1.40 N#CC(F)Nc1cccnc1 7a9fba4f9fa724662405b88810e895fb [0,1,0,0,0,0|2,0,1]=4 232 B11R1.40 O=C(CF)Nc1cccnc1 5e2dc67f59a0ee35b818f3c738a2672a [0,1,0,0,0,0|2,0,1]=4 233 B11R1.40 O=C(CO)Nc1cccnc1 c1618f12da4bc6c07033d2147d5e05a1 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.86 CC(=O)Nc1cccnc1C cb746ed6a78728abfd09af911ecd9df1 [0,1,0,0,0,0|2,0,1]=4 235 B11R1.86 CC(=O)Nc1cccnc1Cl d6108d611ff0956d8f248587b24194a3 [0,1,0,0,0,0|2,0,1]=4 236 B11R1.86 CC(=O)Nc1cccnc1F 14d1358323375dfcd1ff37fd32da5eb9 [0,1,0,0,0,0|2,0,1]=4 237 B11R1.86 CC(=O)Nc1cccnc1I 467bfbcd2f98dc2da33396f6c3169a29 [0,1,0,0,0,0|2,0,1]=4 238 B11R1.86 CC(=O)Nc1cccnc1O 7fcf288ae770f8f4e3cf6493eee6512f [0,1,0,0,0,0|2,0,1]=4 239 B11R1.86 CC(=O)Nc1cnccc1C 008c73bad38e7c0ad3042f8c5e2eeef6 [0,1,0,0,0,0|2,0,1]=4 240 B11R1.86 CC(=O)Nc1cnccc1F fb86cc23bed5784da517c22693fa424f [0,1,0,0,0,0|2,0,1]=4 241 B11R1.86 CC(=O)Nc1cnccc1I f9bbe3b48c30df8d0dae6d2447ab7b64 [0,1,0,0,0,0|2,0,1]=4 242 B11R1.86 CC(=O)Nc1cnccc1O 026ebb27f2a3ead3d67bfa6a1c65cef8 [0,1,0,0,0,0|2,0,1]=4 243 B11R1.86 CC(C)Nc1c[nH]cnc1=O f2745b31b781c663f0b43c700e2fa5a9 [0,1,0,0,0,0|2,0,0]=3 244 B11R1.86 CC(C)Nc1cccc[n+]1[O-] 002b21bba3d24ee1645670e08aeceb41 [0,1,0,0,0,0|3,0,0]=4 245 B11R1.86 CC(C)Nc1ccccc1I 3eed1e6c2f407ecc428748af6151fed6 [0,1,0,0,0,0|2,0,0]=3 246 B11R1.86 CC(C)Nc1cccnc1Br a687380e5aa8756bf4d5d1c2e5895a79 [0,1,0,0,0,0|1,0,0]=2 247 B11R1.86 CC(C)Nc1cccnc1Cl 69ea8d619084b1b2778d6c21db2c80fb [0,1,0,0,0,0|1,0,0]=2 248 B11R1.86 CC(C)Nc1cccnc1F 893908ba00122d7cec7a3e9e3be67dd0 [0,1,0,0,0,0|1,0,0]=2 249 B11R1.86 CC(C)Nc1cccnc1I 51a846c9c1560b89c89fa64730a3deb3 [0,1,0,0,0,0|1,0,0]=2 250 B11R1.86 CC(C)Nc1ccn[nH]c1=O f24f9a4d91111db992940ec84b81a3fc [0,1,0,0,0,0|2,0,1]=4 251 B11R1.86 CC(C)Nc1ccn[nH]c1=S ed75b8fb27a7a1239d8db15d9d7d09ce [0,1,0,0,0,0|2,0,1]=4 252 B11R1.86 CC(C)Nc1ccncc1Br e596052c6754555b45104840e29c9959 [0,1,0,0,0,0|3,0,0]=4 253 B11R1.86 CC(C)Nc1ccncc1Cl 692462569093beed2014348ff5439bd9 [0,1,0,0,0,0|3,0,0]=4 254 B11R1.86 CC(C)Nc1ccncc1F 802dcf9c8e6305905595b97ec24ca83d [0,1,0,0,0,0|3,0,0]=4 255 B11R1.86 CC(C)Nc1ccncc1I f42128d1b412011706fba5240c2e234a [0,1,0,0,0,0|3,0,0]=4 256 B11R1.86 CC(C)Nc1ccnnc1Br fe3284e7e1105bbf48c2eac8554ed50b [0,1,0,0,0,0|2,0,0]=3 257 B11R1.86 CC(C)Nc1ccnnc1Cl 82b8c4ff6bcb82ab7fdefb7a94524909 [0,1,0,0,0,0|2,0,0]=3 258 B11R1.86 CC(C)Nc1cnccc1Cl 9286675edb1a06121c1b48201bbd38ab [0,1,0,0,0,0|1,0,0]=2 259 B11R1.86 CC(C)Nc1cnccc1F d36a1ce63436ee8a7fe7bd2f44ea5dbd [0,1,0,0,0,0|1,0,0]=2 260 B11R1.86 CC(C)Nc1cnccc1I ef08c6d9916171418c74e22e8ea78aab [0,1,0,0,0,0|1,0,0]=2 261 B11R1.86 CC(C)Nc1cnncc1Cl d87720d3ecd7b911000dd02f3aecfba6 [0,1,0,0,0,0|2,0,0]=3 262 B11R1.86 CC(C)Nc1ncccc1F 6f5840dc300786776e2e321fcdb5f56b [0,1,0,0,0,0|3,0,0]=4 263 B11R1.86 CC(C)Nc1ncccc1I 532c9ce1b71264e87c45674524d2fb56 [0,1,0,0,0,0|3,0,0]=4 264 B11R1.86 CC(C)Nc1nccnc1Br 64f273542fcdef7892171fa21df651e1 [0,1,0,0,0,0|2,0,0]=3 265 B11R1.86 CC(C)Nc1nccnc1Cl 0f9c256412e7d20f9195319d8444aeb5 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.86 CC(C)Nc1nccnc1I 13ad7ab334c3ad8089a1f994056eeee3 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.86 CC(C)Oc1c[nH]cnc1=O 528b49c16905dca0ff058248a1f370f6 [0,1,0,0,0,0|2,0,0]=3 268 B11R1.86 CC(C)Oc1ccc[nH]c1=S af7a587cdb1aeebef35b500fdd4289f5 [0,1,0,0,0,0|1,0,1]=3 269 B11R1.86 CC(C)Oc1cccc[n+]1[O-] 10611fdb1ef3435c39bd2cacbc1b5ed5 [0,1,0,0,0,0|3,0,0]=4 270 B11R1.86 CC(C)Oc1ccccc1Cl c23b66f89632f42c5d307b4af3111d42 [0,1,0,0,0,0|2,0,0]=3 271 B11R1.86 CC(C)Oc1ccccc1F 883d2c1cc9d854cb85fa804d83d6f507 [0,1,0,0,0,0|2,0,0]=3 272 B11R1.86 CC(C)Oc1ccccc1I 5b38c2c613687166fa94711069ce6a86 [0,1,0,0,0,0|2,0,0]=3 273 B11R1.86 CC(C)Oc1ccccc1S 75d24c98473e29b4fc09eb15793f8071 [0,1,0,0,0,0|2,0,0]=3 274 B11R1.86 CC(C)Oc1cccnc1Br 41da9105aa46a4cc5b28d1151f766f7c [0,1,0,0,0,0|1,0,0]=2 275 B11R1.86 CC(C)Oc1cccnc1Cl 5f47c201110ae76c3f20771d30f413ac [0,1,0,0,0,0|1,0,0]=2 276 B11R1.86 CC(C)Oc1cccnc1F 5024034c0e002e24ad11e1d6328a6435 [0,1,0,0,0,0|1,0,0]=2 277 B11R1.86 CC(C)Oc1cccnc1I 452ebdc4006c876f552145b479069297 [0,1,0,0,0,0|1,0,0]=2 278 B11R1.86 CC(C)Oc1cccoc1=O 40032c53cdaa862447e101ae5829df37 [0,1,0,0,0,0|2,0,0]=3 279 B11R1.86 CC(C)Oc1ccncc1Br 19a74c8f130c4f5a2ca0ac00315ac896 [0,1,0,0,0,0|3,0,0]=4 280 B11R1.86 CC(C)Oc1ccncc1Cl e9ec19e818e2bc1fafa3aee746091000 [0,1,0,0,0,0|3,0,0]=4 281 B11R1.86 CC(C)Oc1ccncc1F 2c1131f1cf9aea7ce8b673f2b786cc54 [0,1,0,0,0,0|3,0,0]=4 282 B11R1.86 CC(C)Oc1ccnnc1Cl e88d0703ed86fd175abc260f73006759 [0,1,0,0,0,0|2,0,0]=3 283 B11R1.86 CC(C)Oc1cnccc1Br d266279798ad748ca463f4d7f3f9adac [0,1,0,0,0,0|1,0,0]=2 284 B11R1.86 CC(C)Oc1cnccc1Cl 8d0804b21d39d2da2453c643a62be877 [0,1,0,0,0,0|1,0,0]=2 285 B11R1.86 CC(C)Oc1cnccc1F 2f3c830875644371b715186f6a3a53d7 [0,1,0,0,0,0|1,0,0]=2 286 B11R1.86 CC(C)Oc1cnccc1I 0e40e93e631b7a656560ba0272883482 [0,1,0,0,0,0|1,0,0]=2 287 B11R1.86 CC(C)Oc1cncnc1I bbb81930b224cc57b0448e07ad2a3c23 [0,1,0,0,0,0|2,0,0]=3 288 B11R1.86 CC(C)Oc1cnncc1Br 042e482b128800a34aed3b07f3950368 [0,1,0,0,0,0|2,0,0]=3 289 B11R1.86 CC(C)Oc1cnncc1Cl 1b059994d55579019c58a277334c55b3 [0,1,0,0,0,0|2,0,0]=3 290 B11R1.86 CC(C)Oc1coccc1=O 4d1b0da98e9bb63884871a804e330837 [0,1,0,0,0,0|2,0,0]=3 291 B11R1.86 CC(C)Oc1ncccc1Br 3d4ea0f45df93141b027452ac7d893d8 [0,1,0,0,0,0|3,0,0]=4 292 B11R1.86 CC(C)Oc1ncccc1Cl 9581b31c20e69ea270ecf789bba7b204 [0,1,0,0,0,0|3,0,0]=4 293 B11R1.86 CC(C)Oc1ncccc1F 366877e5493bef2aca6740e317ad0785 [0,1,0,0,0,0|3,0,0]=4 294 B11R1.86 CC(C)Oc1nccnc1Br 08bd2cad7f32b307a8d1015974c10f7a [0,1,0,0,0,0|2,0,0]=3 295 B11R1.86 CC(C)Oc1nnccc1Cl adb63b71d2412f1fb781ba602efc104d [0,1,0,0,0,0|2,0,0]=3 296 B11R1.86 CC(C)Oc1nnccc1I 87c834135a2fb55ba301ad1ba16dcc9e [0,1,0,0,0,0|2,0,0]=3 297 B11R1.86 CC(C)On1ccccc1=N 4ae1f304fba835ddd2d4147240ac35fb [0,1,0,0,0,0|3,0,0]=4 298 B11R1.86 CC(C)On1ccccc1=O 22cb614e9cef459cdf1d194311410b8b [0,1,0,0,0,0|3,0,0]=4 299 B11R1.86 CC(C)On1ccccc1=S c35b26e2d1b24665cc8b4412ddcdecc1 [0,1,0,0,0,0|3,0,0]=4 300 B11R1.86 Cc1ccccc1OC(C)C e336697c807367b5d2038eeb2d20cb38 [0,1,0,0,0,0|2,0,0]=3 301 B11R1.86 Cc1cccnc1NC(C)C ca53f8740b6496eebb84463f2bacb5a7 [0,1,0,0,0,0|3,0,0]=4 302 B11R1.86 Cc1cccnc1OC(C)C 2f4605dd9175a92f8b23a3625dc7655c [0,1,0,0,0,0|3,0,0]=4 303 B11R1.86 Cc1ccncc1OC(C)C 6e2f25c7be333db7d06187bc11a46726 [0,1,0,0,0,0|1,0,0]=2 304 B11R1.86 Cc1ccnnc1NC(C)C 4058e84abac9e4c55544fad10c869b2f [0,1,0,0,0,0|2,0,0]=3 305 B11R1.86 Cc1ccnnc1OC(C)C 2d8f76e95dd7a9d99351d31aa0c546e3 [0,1,0,0,0,0|2,0,0]=3 306 B11R1.86 Cc1cnccc1NC(C)C 0b91d986e8b999a69ce7977f721b4bab [0,1,0,0,0,0|3,0,0]=4 307 B11R1.86 Cc1cnccc1OC(C)C 0182e6e6188a5bd0fd92877deb3f0f63 [0,1,0,0,0,0|3,0,0]=4 308 B11R1.86 Cc1ncccc1NC(C)C ab0ea95484d50f8fd20357062d11cc88 [0,1,0,0,0,0|1,0,0]=2 309 B11R1.86 Cc1ncccc1OC(C)C 3bc8395d80b6d7a4cbb4afe4d1590f68 [0,1,0,0,0,0|1,0,0]=2 310 B11R1.86 Cc1nccnc1NC(C)C 487af012b2415642e3b4830cd3838913 [0,1,0,0,0,0|2,0,0]=3 311 B11R1.86 Cc1nccnc1OC(C)C 4c698fd515c5e4f6b0bc546fe95a926a [0,1,0,0,0,0|2,0,0]=3 312 B11R1.86 Cc1ncncc1OC(C)C 26859b4d7fefc04fb2bcd8b5ccae26d4 [0,1,0,0,0,0|2,0,0]=3 313 B11R1.86 Cc1nnccc1NC(C)C 81a1216e9e76b925b148babc306f6804 [0,1,0,0,0,0|2,0,0]=3 314 B11R1.157 CC(=O)Nc1cncc(c1)C 4291afcbdd0cbcaf1adc4172123ca697 [0,1,0,0,0,0|2,0,1]=4 315 B11R1.157 CC(=O)Nc1cncc(c1)F 9860c048d1d1e6420ea4a0a66f480b3c [0,1,0,0,0,0|2,0,1]=4 316 B11R1.157 CC(=O)Nc1cncc(c1)I 1accd6dc622c13ee068932fae9e60766 [0,1,0,0,0,0|2,0,1]=4 317 B11R1.157 CC(=O)Nc1cncc(c1)O df72e33984e978f8a94153b22b3fc5c6 [0,1,0,0,0,0|2,0,1]=4 318 B11R1.157 CC(C)Nc1cc(ccn1)Br ede334b0086465a9e421d24727c4af48 [0,1,0,0,0,0|3,0,0]=4 319 B11R1.157 CC(C)Nc1cc(ccn1)Cl 4657c8906495d89fadc59595bd54c150 [0,1,0,0,0,0|3,0,0]=4 320 B11R1.157 CC(C)Nc1cc(ccn1)F ef287f108744f6c18c5f49d744df2b4a [0,1,0,0,0,0|3,0,0]=4 321 B11R1.157 CC(C)Nc1cc(ccn1)I e2bc63e72569a419f8e6f6c1760decc0 [0,1,0,0,0,0|3,0,0]=4 322 B11R1.157 CC(C)Nc1cc(cnn1)Br d74b2489176d13b13a9d49adabca1305 [0,1,0,0,0,0|2,0,0]=3 323 B11R1.157 CC(C)Nc1cc(cnn1)Cl 159fb4bd07c0e858c6053a03bbd330ef [0,1,0,0,0,0|2,0,0]=3 324 B11R1.157 CC(C)Nc1cc[nH]c(=S)c1 943e2f3af2236045092551a8b698d760 [0,1,0,0,0,0|3,0,0]=4 325 B11R1.157 CC(C)Nc1cccc(c1)Br c1a310149209bebd05d401b8d9453768 [0,1,0,0,0,0|2,0,0]=3 326 B11R1.157 CC(C)Nc1cccc(c1)Cl 88b649511dda4c3138b09b24b4cdf85e [0,1,0,0,0,0|2,0,0]=3 327 B11R1.157 CC(C)Nc1cccc(c1)F 2469bb14dda7a11ffa1e171e9579afdb [0,1,0,0,0,0|2,0,0]=3 328 B11R1.157 CC(C)Nc1cccc(c1)I 28c8d38bd4c860795c7f6ab5b08202d3 [0,1,0,0,0,0|2,0,0]=3 329 B11R1.157 CC(C)Nc1cccc(c1)S 4d5403275c38f6ee6364ab78831bae52 [0,1,0,0,0,0|2,0,0]=3 330 B11R1.157 CC(C)Nc1cccc(n1)Br 891f541b9adc7b0ca8f76cb7e39c8b39 [0,1,0,0,0,0|3,0,0]=4 331 B11R1.157 CC(C)Nc1cccc(n1)I 8d2a49a9d3ceb895e3574586ee1c89bf [0,1,0,0,0,0|3,0,0]=4 332 B11R1.157 CC(C)Nc1ccnc(c1)Br 4af3800bff929822af3b4739eff8eddc [0,1,0,0,0,0|3,0,0]=4 333 B11R1.157 CC(C)Nc1ccnc(c1)Cl 766191311591fa4b6d81b2509e2aebbd [0,1,0,0,0,0|3,0,0]=4 334 B11R1.157 CC(C)Nc1ccnc(c1)F f733e1ce2ac4ea46e404373b197b867b [0,1,0,0,0,0|3,0,0]=4 335 B11R1.157 CC(C)Nc1ccnc(c1)I 2df22ebd7dbeb99f813a36b914800a99 [0,1,0,0,0,0|3,0,0]=4 336 B11R1.157 CC(C)Nc1cn[nH]c(=O)c1 d8bacbd0e021a7b47b8f7b0a9ba85927 [0,1,0,0,0,0|2,0,0]=3 337 B11R1.157 CC(C)Nc1cn[nH]c(=O)n1 d77a476a29c780166c21db631949faab [0,1,0,0,0,0|3,0,0]=4 338 B11R1.157 CC(C)Nc1cncc(c1)Cl c26350b11d8c01ec2f1f210f522bf42f [0,1,0,0,0,0|1,0,0]=2 339 B11R1.157 CC(C)Nc1cncc(c1)F c0d792196e8876c1a0df52cc6f431e54 [0,1,0,0,0,0|1,0,0]=2 340 B11R1.157 CC(C)Nc1cncc(c1)I 5165104992f08facddd648b36b59a9a8 [0,1,0,0,0,0|1,0,0]=2 341 B11R1.157 CC(C)Nc1cncc(n1)F e065eccf180edd767707b1eb1341d59b [0,1,0,0,0,0|2,0,0]=3 342 B11R1.157 CC(C)Nc1cnnc(c1)Cl 434fe2c48a3abd2f15846c771e15c654 [0,1,0,0,0,0|2,0,0]=3 343 B11R1.157 CC(C)Nc1cnnc(c1)F 172b1002ef8f9f4aae83b594aed2aef2 [0,1,0,0,0,0|2,0,0]=3 344 B11R1.157 CC(C)Nc1cnnc(n1)Cl 20d3ab6f00a12bb11dac8f7479f06ea2 [0,1,0,0,0,0|3,0,0]=4 345 B11R1.157 CC(C)Oc1cc(ccn1)Br 3480ee35d8ae0d5d11b7aa683499591e [0,1,0,0,0,0|3,0,0]=4 346 B11R1.157 CC(C)Oc1cc(ccn1)Cl d3d971cd1e336a781f870de87e0a3e03 [0,1,0,0,0,0|3,0,0]=4 347 B11R1.157 CC(C)Oc1cc(ccn1)F fb9a7af5c09ecabe8fe4cffddc870db1 [0,1,0,0,0,0|3,0,0]=4 348 B11R1.157 CC(C)Oc1ccc[n+](c1)[O-] b00660a7d3334e38c94bae1aa15bfa44 [0,1,0,0,0,0|1,0,1]=3 349 B11R1.157 CC(C)Oc1cccc(=O)[nH]1 13625ddc45965e087d906cecd50738c3 [0,1,0,0,0,0|3,0,0]=4 350 B11R1.157 CC(C)Oc1cccc(c1)Br 03d6e4f39dc83644234524de153060f8 [0,1,0,0,0,0|2,0,0]=3 351 B11R1.157 CC(C)Oc1cccc(c1)Cl b05958621a80ad10943fb41bda6c4ff4 [0,1,0,0,0,0|2,0,0]=3 352 B11R1.157 CC(C)Oc1cccc(c1)F cc5136a263bfb966a933f5c182f882fd [0,1,0,0,0,0|2,0,0]=3 353 B11R1.157 CC(C)Oc1cccc(c1)I eecf4227dddae0c4ffe51c7d1a2196a6 [0,1,0,0,0,0|2,0,0]=3 354 B11R1.157 CC(C)Oc1cccc(c1)S c0ecc340d31d590be5ee243f9c89bfa6 [0,1,0,0,0,0|2,0,0]=3 355 B11R1.157 CC(C)Oc1cccc(n1)Br a18346d99926fef9a7886c50d31b0717 [0,1,0,0,0,0|3,0,0]=4 356 B11R1.157 CC(C)Oc1cccc(n1)F 4bfa0974aa476b6675e47db0c31b5390 [0,1,0,0,0,0|3,0,0]=4 357 B11R1.157 CC(C)Oc1ccnc(c1)Br 8163155dc9554a826c1579a6cd8b8a53 [0,1,0,0,0,0|3,0,0]=4 358 B11R1.157 CC(C)Oc1ccnc(c1)Cl 65c976867642144996957df346a8a86e [0,1,0,0,0,0|3,0,0]=4 359 B11R1.157 CC(C)Oc1ccnc(c1)F ba6b23e91f130a75063ccfe77ebe581a [0,1,0,0,0,0|3,0,0]=4 360 B11R1.157 CC(C)Oc1cncc(c1)Cl 388d88d9e0df30a2ba0e40f8f1524c25 [0,1,0,0,0,0|1,0,0]=2 361 B11R1.157 CC(C)Oc1cncc(c1)F a1defac1377360a458739a468937d592 [0,1,0,0,0,0|1,0,0]=2 362 B11R1.157 CC(C)Oc1cncc(c1)I 277b82df97e12d2b7f27e78d9949ff74 [0,1,0,0,0,0|1,0,0]=2 363 B11R1.157 CC(C)Oc1cncc(n1)Br 728b8a9c26c866a2cb7f1592bf7d3777 [0,1,0,0,0,0|2,0,0]=3 364 B11R1.157 CC(C)Oc1cncc(n1)Cl 3830830eeebaad7249ab139f796ed7e2 [0,1,0,0,0,0|2,0,0]=3 365 B11R1.157 CC(C)Oc1cnnc(c1)Cl bf20ebf7d0d46b22df7d35cd9408de34 [0,1,0,0,0,0|2,0,0]=3 366 B11R1.157 Cc1cc(ccn1)NC(C)C 0a6ae8318e6544f792c3080ec507bf61 [0,1,0,0,0,0|3,0,0]=4 367 B11R1.157 Cc1cc(ccn1)OC(C)C 8187a967c8823cc680c7bbf8143ee8a4 [0,1,0,0,0,0|3,0,0]=4 368 B11R1.157 Cc1cccc(c1)NC(C)C 6995924353e7f43790a327361636dd3c [0,1,0,0,0,0|2,0,0]=3 369 B11R1.157 Cc1cccc(c1)OC(C)C 768a0b78053567f181c821d541878835 [0,1,0,0,0,0|2,0,0]=3 370 B11R1.157 Cc1cccc(n1)NC(C)C 0fa0e842298c41943400547750aed7ea [0,1,0,0,0,0|3,0,0]=4 371 B11R1.157 Cc1cccc(n1)OC(C)C 791927ccd2fefd725c286781ac8b13c0 [0,1,0,0,0,0|3,0,0]=4 372 B11R1.157 Cc1ccnc(c1)NC(C)C d5f3d252110a2ee12b556e117762673a [0,1,0,0,0,0|3,0,0]=4 373 B11R1.157 Cc1ccnc(c1)OC(C)C 8636d90e36f69158a147da7734120e09 [0,1,0,0,0,0|3,0,0]=4 374 B11R1.157 Cc1cncc(c1)NC(C)C 16b6df361413b730dd0edaa3dd52fb68 [0,1,0,0,0,0|1,0,0]=2 375 B11R1.157 Cc1cnnc(c1)NC(C)C 5ee18eee53d1232c5f06046abeb5289e [0,1,0,0,0,0|2,0,0]=3 376 B11R1.157 Cc1nncc(n1)NC(C)C 76e88ce695d87e407fc4740792c8c56d [0,1,0,0,0,0|3,0,0]=4 377 B11R1.509 CC(C)(C)Nc1ccccc1 820b34717c3d9476c22fcc3db6fccee9 [0,1,0,0,0,0|2,0,0]=3 378 B11R1.509 CC(C)(C)Nc1cccnc1 22afe0912ef2c695ba26155c9d7e4850 [0,1,0,0,0,0|1,0,0]=2 379 B9R0.14 C=CCN(C=O)CC(C)C 53920279c48c49e840e1e3e20aba9f1b [0,0,1,0,0,0|2,0,1]=4 380 B11R2.238 c1cc(ccn1)NC2CC2 5ad70d53c8f8554348b48da331d79b17 [0,0,0,1,0,0|3,0,0]=4 381 B11R2.238 c1cc(cnn1)NC2CC2 9f38e533ae4b1470c9d08146bd9ebf5f [0,0,0,1,0,0|2,0,0]=3 382 B11R2.238 c1cc(cnn1)OC2CC2 db075b7d2e08bf2f9d661827545665d9 [0,0,0,1,0,0|2,0,0]=3 383 B11R2.238 c1ccc(cc1)NC2CC2 0cca6617983212a2989086e88698db73 [0,0,0,1,0,0|2,0,0]=3 384 B11R2.238 c1ccc(nc1)OC2CC2 05f70841461656fba19d4e6cae35b4c4 [0,0,0,1,0,0|3,0,0]=4 385 B11R2.238 c1cnc(nn1)NC2CC2 6fa5c774385a17a538cf31ccbb47b005 [0,0,0,1,0,0|3,0,0]=4 386 B11R2.238 c1cncc(c1)NC2CC2 faca6d2d50c0b4a3e50cda13d58850cf [0,0,0,1,0,0|1,0,0]=2 387 B11R2.238 c1cncc(c1)OC2CC2 e02f03b072be3d2fd90f9a4a8c487a8f [0,0,0,1,0,0|1,0,0]=2 388 B9R1.13 CC(C)CN1CC=CC1 0159c45440890eddec53e955480c9179 [0,0,0,0,1,0|1,0,2]=4 389 B9R1.13 CC(C)Nc1cc[nH]n1 be6d410d3568f9605b2c6d8df650a613 [0,0,0,0,1,0|2,0,0]=3 390 B9R1.13 CC(C)Nc1ccno1 2159316ddf4b6c3bfafa9dd18aed231b [0,0,0,0,1,0|2,0,0]=3 391 B9R1.13 CC(C)Nc1ccns1 714dd1d20ea7ef80db82985f3609938e [0,0,0,0,1,0|2,0,0]=3 392 B9R1.13 CC(C)Nc1ccon1 4748af366c19db24727ab88e6ed6e4f0 [0,0,0,0,1,0|2,0,0]=3 393 B9R1.13 CC(C)Nc1ccsc1 15ad6ed6958067724a7a26e61257254b [0,0,0,0,1,0|2,0,0]=3 394 B9R1.13 CC(C)Nc1cn[nH]c1 8000fff5f883ac29b0e3632025d851d7 [0,0,0,0,1,0|2,0,0]=3 395 B9R1.13 CC(C)Nc1cncs1 52121261cabe3794162f74d6b81b293a [0,0,0,0,1,0|2,0,0]=3 396 B9R1.13 CC(C)Nc1cnoc1 c76f946df3b55dc487eb77cf96453f88 [0,0,0,0,1,0|2,0,0]=3 397 B9R1.13 CC(C)Nc1cnon1 c3bfdf318509670fdef611d4a4c0bd77 [0,0,0,0,1,0|3,0,0]=4 398 B9R1.13 CC(C)Nc1cocn1 5323ffea4d50273bd659bd73d5f477ee [0,0,0,0,1,0|2,0,0]=3 399 B9R1.13 CC(C)Nc1cscn1 80c72724b05cb5c849b1b06a3e5845c5 [0,0,0,0,1,0|2,0,0]=3 400 B9R1.13 CC(C)Nc1nc[nH]n1 bcea48efe5f06b8b4165eb24a47629b2 [0,0,0,0,1,0|3,0,0]=4 401 B9R1.13 CC(C)Nc1ncc[nH]1 8d05845695c8fb7502c2af4756268830 [0,0,0,0,1,0|2,0,0]=3 402 B9R1.13 CC(C)Nc1ncco1 fcd0fac8f92d9b0f4549470280738971 [0,0,0,0,1,0|2,0,0]=3 403 B9R1.13 CC(C)Nc1nccs1 a7ef9a363e91d5ff572edca29e81d493 [0,0,0,0,1,0|2,0,0]=3 404 B9R1.13 CC(C)Nc1ncns1 9da3ae4dd3dfc18a9fb390dcfc3ea496 [0,0,0,0,1,0|3,0,0]=4 405 B9R1.13 CC(C)Nc1ncon1 a0925a01294faa5143daa11b75a96f9b [0,0,0,0,1,0|3,0,0]=4 406 B9R1.13 CC(C)Nc1nncs1 f3607a1b97a69a72d891bb767eb26076 [0,0,0,0,1,0|3,0,0]=4 407 B9R1.13 CC(C)Oc1c[nH]cn1 1008314a7152167f871b01e8884baa4b [0,0,0,0,1,0|2,0,0]=3 408 B9R1.13 CC(C)Oc1ccco1 6706bc489021fd5e63c9cd08f454e9c6 [0,0,0,0,1,0|2,0,0]=3 409 B9R1.13 CC(C)Oc1cccs1 21794e900987f3d432b829048842efca [0,0,0,0,1,0|2,0,0]=3 410 B9R1.13 CC(C)Oc1ccn[nH]1 53c884ecb33b778652e01026b1e95972 [0,0,0,0,1,0|2,0,0]=3 411 B9R1.13 CC(C)Oc1ccsc1 6ccbd5cefe1aa53d8fe97e89f11c7215 [0,0,0,0,1,0|2,0,0]=3 412 B9R1.13 CC(C)Oc1cn[nH]c1 b05e8f4a5a4064c84eeb176794b31171 [0,0,0,0,1,0|2,0,0]=3 413 B9R1.13 CC(C)Oc1cnoc1 c46dc47e1623205835d17626dd014a3e [0,0,0,0,1,0|2,0,0]=3 414 B9R1.13 CC(C)Oc1cnsn1 55a7cb9a0990006b20f470f57b106ea7 [0,0,0,0,1,0|3,0,0]=4 415 B9R1.13 CC(C)Oc1nccs1 6b7fdf51a80ea2ae8353cabc54ee22f1 [0,0,0,0,1,0|2,0,0]=3 416 B9R1.13 CC(C)Oc1nncs1 5dd301398ca8ba4a5a46998ed07cdebf [0,0,0,0,1,0|3,0,0]=4 417 B9R1.13 CC(C)On1cccn1 485d56731527e6acaf37f4f9b0b2879e [0,0,0,0,1,0|2,0,0]=3 418 B9R1.13 CC(C)On1ccnc1 609be73781b0bdaf0862a61bf16d2c28 [0,0,0,0,1,0|2,0,0]=3 419 B11R1.91 C=C(Br)CNc1cccnc1 a11cf5f6d9b1fac244d28cac011d2a32 [0,0,0,0,0,1|1,0,2]=4 420 B11R1.91 C=C(Br)COc1cccnc1 03ee6b86f68c4d9665848abdc6665e99 [0,0,0,0,0,1|1,0,2]=4 421 B11R1.91 C=C(C)CNc1ccccc1 9ff030153dc2dcaf07d1da3f9e6a073f [0,0,0,0,0,1|1,0,2]=4 422 B11R1.91 C=C(C)CNc1cccnc1 8810dec0d1b93ae6f2f50fc532118fa0 [0,0,0,0,0,1|0,0,2]=3 423 B11R1.91 C=C(C)CNc1cccnn1 cf29f02fc2b1b06fbdfb1d6447888724 [0,0,0,0,0,1|1,0,2]=4 424 B11R1.91 C=C(C)CNc1ccnnc1 8c1b00caa26bca7ad2a324ec396b7258 [0,0,0,0,0,1|1,0,2]=4 425 B11R1.91 C=C(C)CNc1cnccn1 d0a9ee6c6179d7f99dc86f8b5699859d [0,0,0,0,0,1|1,0,2]=4 426 B11R1.91 C=C(C)CNc1cncnc1 74ba569c19858fbe49a5ebea4677c124 [0,0,0,0,0,1|1,0,2]=4 427 B11R1.91 C=C(C)COc1cccnc1 3cac933caa917577843fc86e5c520fd6 [0,0,0,0,0,1|0,0,2]=3 428 B11R1.91 C=C(C)COc1ccnnc1 e2baf51b2cbaf9dd6ef0ec2b572f01ce [0,0,0,0,0,1|1,0,2]=4 429 B11R1.91 C=C(C)COc1cnccn1 75b8877c41b529e2d05c6c78734c83aa [0,0,0,0,0,1|1,0,2]=4 430 B11R1.91 C=C(C)COc1cncnc1 7dbc1811ffc7a3ce322aba6cb01c69eb [0,0,0,0,0,1|1,0,2]=4 431 B11R1.91 C=C(Cl)CNc1cccnc1 54e242eb426763e91578db67448c885f [0,0,0,0,0,1|1,0,2]=4 432 B11R1.91 C=C(Cl)COc1cccnc1 8b34485e013408a6d6c7e3498d13562e [0,0,0,0,0,1|1,0,2]=4 433 B11R1.91 C=C(F)CNc1cccnc1 ba2b2cb51023d183dfda83785e392235 [0,0,0,0,0,1|1,0,2]=4 434 B11R1.91 C=C(F)COc1cccnc1 4668ab24b3e1fd98adbd999ded211c59 [0,0,0,0,0,1|1,0,2]=4 435 B11R1.91 CC(=O)CNc1ccccc1 71a2fb3da6b0e889c13cfd81e73bd182 [0,0,0,0,0,1|2,0,1]=4 436 B11R1.91 CC(=O)CNc1cccnc1 35a6037a85b015cc869f557087769b5d [0,0,0,0,0,1|1,0,1]=3 437 B11R1.91 CC(=O)CNc1cccnn1 bd224fe4d75fd6299636314b2659cf40 [0,0,0,0,0,1|2,0,1]=4 438 B11R1.91 CC(=O)CNc1ccnnc1 988e3b33cea73d48c45816137b4a5d30 [0,0,0,0,0,1|2,0,1]=4 439 B11R1.91 CC(=O)CNc1cnccn1 f505fd1e568103e89908ef11d0b9c40c [0,0,0,0,0,1|2,0,1]=4 440 B11R1.91 CC(=O)NCc1ccccc1 29a87354e4243d3817f046f8152f971d [0,0,0,0,0,1|2,0,1]=4 441 B11R1.91 CC(=O)NCc1cccnc1 7b71a51c058bd0c2c3114d8b61c7e1f0 [0,0,0,0,0,1|1,0,1]=3 442 B11R1.91 CC(=O)NCc1cccnn1 8df4f95b0595f5061ab86d0c6899ec2c [0,0,0,0,0,1|2,0,1]=4 443 B11R1.91 CC(=O)NCc1ccnnc1 b7fb9ef1b30e19b3391ac6373f09e991 [0,0,0,0,0,1|2,0,1]=4 444 B11R1.91 CC(=O)NCc1cnccn1 3bc7c046654e0b52f0e8fd5e1c64219d [0,0,0,0,0,1|2,0,1]=4 445 B11R1.91 CC(=O)NCc1cncnc1 1788fa75b9a7d3ec40c95f826ad49ab5 [0,0,0,0,0,1|2,0,1]=4 446 B11R1.91 CC(C)CNc1ccccc1 408d8a64ab70f9eca096d81d546b6049 [0,0,0,0,0,1|1,0,0]=2 447 B11R1.91 CC(C)CNc1ccccn1 7b009ca04377ecc13f70ec3cf4ebfeda [0,0,0,0,0,1|2,0,0]=3 448 B11R1.91 CC(C)CNc1cccnc1 872c17275baf8dfc3e3fcfc1c6e8b0aa [0,0,0,0,0,1|0,0,0]=1 449 B11R1.91 CC(C)CNc1cccnn1 6e0a186ee92f69845b1d1e2faa4b9d99 [0,0,0,0,0,1|1,0,0]=2 450 B11R1.91 CC(C)CNc1ccncc1 25b00c7dc1cdd402497940b3c77292de [0,0,0,0,0,1|2,0,0]=3 451 B11R1.91 CC(C)CNc1ccncn1 f3aaf01b8fb4390cec4d8d0c307de117 [0,0,0,0,0,1|3,0,0]=4 452 B11R1.91 CC(C)CNc1ccnnc1 a8df0e4f94a9188832304de39fa0752f [0,0,0,0,0,1|1,0,0]=2 453 B11R1.91 CC(C)CNc1cnccn1 95ddfe6d68910c614f0cbdfaa85d0133 [0,0,0,0,0,1|1,0,0]=2 454 B11R1.91 CC(C)CNc1cncnc1 cb16d6f63363d23c43e0f4ee19155631 [0,0,0,0,0,1|1,0,0]=2 455 B11R1.91 CC(C)CNc1cnncn1 077dd4520b9c00d9ebe6adb526b19946 [0,0,0,0,0,1|2,0,0]=3 456 B11R1.91 CC(C)CNc1ncccn1 fb6ae2e310931ddbda6cf67796620c38 [0,0,0,0,0,1|3,0,0]=4 457 B11R1.91 CC(C)CNc1nccnn1 4d09253906936b3597d33f009e5aae20 [0,0,0,0,0,1|2,0,0]=3 458 B11R1.91 CC(C)COc1ccccn1 7b0823f232ca75667ab72b773cf2055c [0,0,0,0,0,1|2,0,0]=3 459 B11R1.91 CC(C)COc1cccnc1 639764ab0bac28311f80a0c1092bb51e [0,0,0,0,0,1|0,0,0]=1 460 B11R1.91 CC(C)COc1ccncc1 f219312091f37b23472c98e305cf03a6 [0,0,0,0,0,1|2,0,0]=3 461 B11R1.91 CC(C)COc1ccnnc1 505d9a49f2cac632fe0c68cb941cb98c [0,0,0,0,0,1|1,0,0]=2 462 B11R1.91 CC(C)COc1cnccn1 fca5516fc8fc749e126db826ec1364f8 [0,0,0,0,0,1|1,0,0]=2 463 B11R1.91 CC(C)COc1cncnc1 b99958e2d254a4ae75237cf3e69e1130 [0,0,0,0,0,1|1,0,0]=2 464 B11R1.91 CC(C)COc1cncnn1 a6933c9df608223011362944059fe81f [0,0,0,0,0,1|2,0,0]=3 465 B11R1.91 CC(C)COc1ncccn1 1f457fce7df81ae19e8aadca0db78537 [0,0,0,0,0,1|3,0,0]=4 466 B11R1.91 CC(C)NCc1ccccc1 60272e3c9303882f29d21331dcab1491 [0,0,0,0,0,1|1,0,0]=2 467 B11R1.91 CC(C)NCc1ccccn1 856545f5d02de0038284fed0716bf52b [0,0,0,0,0,1|2,0,0]=3 468 B11R1.91 CC(C)NCc1cccnc1 f83c1668bc1a0795e6062eecd9dab4fd [0,0,0,0,0,1|0,0,0]=1 469 B11R1.91 CC(C)NCc1cccnn1 cccaf60f16873524c6ada28e623ee50e [0,0,0,0,0,1|1,0,0]=2 470 B11R1.91 CC(C)NCc1ccncc1 6f1dfa66543bb67ac78a3a333bf46a66 [0,0,0,0,0,1|2,0,0]=3 471 B11R1.91 CC(C)NCc1ccncn1 36ee71268b7fc037f6d2456244279a98 [0,0,0,0,0,1|3,0,0]=4 472 B11R1.91 CC(C)NCc1ccnnc1 98a9968a20acdc964ac10c028e00eec7 [0,0,0,0,0,1|1,0,0]=2 473 B11R1.91 CC(C)NCc1cnccn1 320d7f2d7b3c9da90f951a37d43af864 [0,0,0,0,0,1|1,0,0]=2 474 B11R1.91 CC(C)NCc1ncccn1 248c6dc0e3f7cb9e6cb68053e65f796a [0,0,0,0,0,1|3,0,0]=4 475 B11R1.91 CC(C)OCc1ccccc1 7aa508df1117d05227b589ad5630d192 [0,0,0,0,0,1|1,0,0]=2 476 B11R1.91 CC(C)OCc1ccccn1 0763eb944dcd10bf40a6049a3281f0fa [0,0,0,0,0,1|2,0,0]=3 477 B11R1.91 CC(C)OCc1cccnc1 15bee2bbdfea4851383d51503cc56958 [0,0,0,0,0,1|0,0,0]=1 478 B11R1.91 CC(C)OCc1cccnn1 9e75df7bf42bec5daa46f121cb3b2fee [0,0,0,0,0,1|1,0,0]=2 479 B11R1.91 CC(C)OCc1ccncc1 6b799cfffcfa8445d7523666b8d1a250 [0,0,0,0,0,1|2,0,0]=3 480 B11R1.91 CC(C)OCc1ccncn1 8ca6a7835eff3f310e3286485f2bc8a3 [0,0,0,0,0,1|3,0,0]=4 481 B11R1.91 CC(C)OCc1ccnnc1 9f4405a184896ebf514498f5e77701bf [0,0,0,0,0,1|1,0,0]=2 482 B11R1.91 CC(C)OCc1cnccn1 e68303144f36400499d51e9b07ed6d5f [0,0,0,0,0,1|1,0,0]=2 483 B11R1.91 CC(C)OCc1cncnc1 0b9844eb4d847bf9172813d1bb5440e6 [0,0,0,0,0,1|1,0,0]=2 484 B11R1.91 CC(C)OCc1ncccn1 38d74e076887ffaed244a2918ea05836 [0,0,0,0,0,1|3,0,0]=4 485 B11R1.91 CC(O)CNc1ccccc1 bad1b8ce4c3d0d43f36328d30e7f1e89 [0,0,0,0,0,1|2,0,0]=3 486 B11R1.91 CC(O)CNc1ccccn1 0b02a9fc805d3fdc80aa58b252d76fac [0,0,0,0,0,1|3,0,0]=4 487 B11R1.91 CC(O)CNc1cccnc1 be948b4ea22210c06fa11f5ff0c44d9b [0,0,0,0,0,1|1,0,0]=2 488 B11R1.91 CC(O)CNc1cccnn1 e8550c43b60b9bd9029917d25ea6398c [0,0,0,0,0,1|2,0,0]=3 489 B11R1.91 CC(O)CNc1ccncc1 58a36af31ee3d9178a47f4e2f681d20e [0,0,0,0,0,1|3,0,0]=4 490 B11R1.91 CC(O)CNc1ccnnc1 ab88da5307d11b10e2373643d8ebb95d [0,0,0,0,0,1|2,0,0]=3 491 B11R1.91 CC(O)CNc1cnccn1 f991222b12e39f41fc4f22d1360207a1 [0,0,0,0,0,1|2,0,0]=3 492 B11R1.91 CC(O)CNc1cncnc1 9fc5976bef6d9ef64c8d846f37ba79d4 [0,0,0,0,0,1|2,0,0]=3 493 B11R1.91 CC(O)CNc1cnncn1 e9d744d012cb875341a25fa1c5edb17d [0,0,0,0,0,1|3,0,0]=4 494 B11R1.91 CC(O)CNc1nccnn1 079966ed897e1488fdb5a48945dead87 [0,0,0,0,0,1|3,0,0]=4 495 B11R1.91 CN(C)CNc1ccccc1 6ea2b21a530eb73fceed274bf1825a42 [0,0,0,0,0,1|2,0,0]=3 496 B11R1.91 CN(C)CNc1ccccn1 7dd3487cd8d87b9dce82d3b1e66d4dfe [0,0,0,0,0,1|3,0,0]=4 497 B11R1.91 CN(C)CNc1cccnc1 06dc729fa11ea9023ada541fc670b33d [0,0,0,0,0,1|1,0,0]=2 498 B11R1.91 CN(C)CNc1cccnn1 10ca1fff045b7a15c678bcb00a4606ad [0,0,0,0,0,1|2,0,0]=3 499 B11R1.91 CN(C)CNc1ccncc1 06f2faf99e2f9062dfe4af47bfbbee1d [0,0,0,0,0,1|3,0,0]=4 500 B11R1.91 CN(C)CNc1ccnnc1 0a3192582ec88e50b6a95618946e28ac [0,0,0,0,0,1|2,0,0]=3 501 B11R1.91 CN(C)CNc1cnccn1 b2e8bec18797b7bb28e6e20f5edf5e23 [0,0,0,0,0,1|2,0,0]=3 502 B11R1.91 CN(C)CNc1cncnc1 c1543e78b131af1af6e1b285c4153a01 [0,0,0,0,0,1|2,0,0]=3 503 B11R1.91 CN(C)CNc1cnncn1 f2d6968a4d7140b64770c86473eb86ef [0,0,0,0,0,1|3,0,0]=4 504 B11R1.91 CN(C)CNc1nccnn1 41f4df293c547a6d207ab0888103373d [0,0,0,0,0,1|3,0,0]=4 505 B11R1.91 CN(C)COc1ccccn1 0d00edbce2a52e0b3d43150d9124361f [0,0,0,0,0,1|3,0,0]=4 506 B11R1.91 CN(C)COc1cccnc1 ba3cfa03500b005052d6345515b92103 [0,0,0,0,0,1|1,0,0]=2 507 B11R1.91 CN(C)COc1ccncc1 24dcd02da3008257944139a724552f1d [0,0,0,0,0,1|3,0,0]=4 508 B11R1.91 CN(C)COc1ccnnc1 99db65c05688bc0aab8be34d262d37e9 [0,0,0,0,0,1|2,0,0]=3 509 B11R1.91 CN(C)COc1cnccn1 0bc79da095c240b1e1f95a99c0285d93 [0,0,0,0,0,1|2,0,0]=3 510 B11R1.91 CN(C)COc1cncnc1 c5dcd7c6847221d2731872c74ab0f73f [0,0,0,0,0,1|2,0,0]=3 511 B11R1.91 CN(C)COc1cncnn1 513262afbbf286f41be61d9104779955 [0,0,0,0,0,1|3,0,0]=4 512 B11R1.91 C[C@@H](O)CNc1ccccc1 3364bd989574177eabc4c47575206f02 [0,0,0,0,0,1|2,0,0]=3 513 B11R1.91 C[C@@H](O)CNc1ccccn1 2f50c5c35f8b03d00f3a417683f2e1c8 [0,0,0,0,0,1|3,0,0]=4 514 B11R1.91 C[C@@H](O)CNc1cccnc1 0269da8e8da5f2bc75323d1a7b31953c [0,0,0,0,0,1|1,0,0]=2 515 B11R1.91 C[C@@H](O)CNc1cccnn1 6d7b3599ec55158b05cb5aa4687b61f0 [0,0,0,0,0,1|2,0,0]=3 516 B11R1.91 C[C@@H](O)CNc1ccncc1 a759ad58b644a21887782ccec01db51a [0,0,0,0,0,1|3,0,0]=4 517 B11R1.91 C[C@@H](O)CNc1ccnnc1 fc7aeafa26d135bbab6fad8fb9254eca [0,0,0,0,0,1|2,0,0]=3 518 B11R1.91 C[C@@H](O)CNc1cnccn1 eefedac70fb9e61b84978ca5f31e1024 [0,0,0,0,0,1|2,0,0]=3 519 B11R1.91 C[C@@H](O)CNc1cnncn1 ec8f16affeeb15fca88b483b81b727bd [0,0,0,0,0,1|3,0,0]=4 520 B11R1.91 C[C@@H](O)CNc1nccnn1 97fdbd1b5c4939a91b3631c209d843d4 [0,0,0,0,0,1|3,0,0]=4 521 B11R1.91 C[C@H](O)CNc1ccccc1 72a253baaf381f6699a10e01b0f0ab34 [0,0,0,0,0,1|2,0,0]=3 522 B11R1.91 C[C@H](O)CNc1ccccn1 b5e1e178b39afd2578578a870577034a [0,0,0,0,0,1|3,0,0]=4 523 B11R1.91 C[C@H](O)CNc1cccnc1 13f963f21a32ff7cb405ad7d76f40567 [0,0,0,0,0,1|1,0,0]=2 524 B11R1.91 C[C@H](O)CNc1cccnn1 d1cbd42116d6dcb71e4b9c0be7e6b4b4 [0,0,0,0,0,1|2,0,0]=3 525 B11R1.91 C[C@H](O)CNc1ccncc1 40e1cfcf68d3fb31f8ea23f4fe31cf2f [0,0,0,0,0,1|3,0,0]=4 526 B11R1.91 C[C@H](O)CNc1ccnnc1 121e8797e50363cde88e3aa495b3c0e6 [0,0,0,0,0,1|2,0,0]=3 527 B11R1.91 C[C@H](O)CNc1cnccn1 8436b233d47376aa6994f036c7608979 [0,0,0,0,0,1|2,0,0]=3 528 B11R1.91 C[C@H](O)CNc1cncnc1 892e1398c21057eaaa2e672d8bd1d026 [0,0,0,0,0,1|2,0,0]=3 529 B11R1.91 C[C@H](O)CNc1cnncn1 70a6f470a69e2478a941d74a578a283f [0,0,0,0,0,1|3,0,0]=4 530 B11R1.91 C[C@H](O)CNc1nccnn1 4aeacf9a97ea5933405c1b517f46e8ff [0,0,0,0,0,1|3,0,0]=4 531 B11R1.91 FC(F)CNc1ccccc1 84c83ea792636e350c2a00840c340dda [0,0,0,0,0,1|3,0,0]=4 532 B11R1.91 FC(F)CNc1cccnc1 a910c213573add99ea980c8d5d2e609d [0,0,0,0,0,1|2,0,0]=3 533 B11R1.91 FC(F)CNc1cccnn1 6a0fb75be4f7a3d785cb3a714e06079d [0,0,0,0,0,1|3,0,0]=4 534 B11R1.91 FC(F)CNc1ccnnc1 11a9918326497d5e027b3488910ee000 [0,0,0,0,0,1|3,0,0]=4 535 B11R1.91 FC(F)CNc1cnccn1 044391ced47c9eaa868f2d3136bc246e [0,0,0,0,0,1|3,0,0]=4 536 B11R1.91 FC(F)CNc1cncnc1 cbbe3b8a7f95cde2c92fa2cad8e28f9f [0,0,0,0,0,1|3,0,0]=4 537 B11R1.91 FC(F)COc1cccnc1 16e8b5d84e4d3ff38c6e69c3e22cb9c1 [0,0,0,0,0,1|2,0,0]=3 538 B11R1.91 FC(F)COc1ccnnc1 bfef43af34af1dceb8d4aa8e528c2be4 [0,0,0,0,0,1|3,0,0]=4 539 B11R1.91 FC(F)COc1cnccn1 a08431a794976ce612934d8b1139152d [0,0,0,0,0,1|3,0,0]=4 540 B11R1.91 FC(F)COc1cncnc1 5673cd56ef50fd7eb2acf835e0911edf [0,0,0,0,0,1|3,0,0]=4 541 B11R1.91 NC(=O)CNc1cccnc1 dbb72e205ac173bc25639603ebb9275b [0,0,0,0,0,1|2,0,1]=4 542 B11R1.91 NC(=O)COc1cccnc1 561263082ed3dec2740bd877b6a3be01 [0,0,0,0,0,1|2,0,1]=4 543 B11R1.91 O=C(O)CNc1cccnc1 4378235c0fca8603764c85f64c571ed0 [0,0,0,0,0,1|2,0,1]=4 544 B11R1.91 O=C(O)COc1cccnc1 109e5f2cec28855b082ac5e8dd76ca14 [0,0,0,0,0,1|2,0,1]=4 545 B11R1.91 O=[N+]([O-])CNc1cccnc1 22f8aed454b7c282f646cfba0598b7ad [0,0,0,0,0,1|3,0,0]=4 546 B11R1.91 O=[N+]([O-])COc1cccnc1 57806cc501e01a10b949bb71b7b553b9 [0,0,0,0,0,1|3,0,0]=4 547 B8R0.16 C=CC(C=C)OC(C)C d52270769618bbb9ffdd6080fb107203 [1,0,1,0,0,0|1,0,1]=4 548 B10R0.78 C=C/C=C/C(=O)NCC(C)C a3844a0ec5abaf6eda8ca48c5fdbfdb4 [0,1,1,0,0,0|2,0,0]=4 549 B10R0.78 C=C/C=C\C(=O)NCC(C)C 1dd9352c50ac5e6f8f3809df03aeda40 [0,1,1,0,0,0|2,0,0]=4 550 B10R0.78 C=CC=CC(=O)NCC(C)C 9ee529ef15651cf2b8b82a031e37bc05 [0,1,1,0,0,0|2,0,0]=4 551 B10R1.1 CCNc1ccc(=O)[nH]c1 cda5f6466914b9089a8f399c4d41b9f1 [1,1,0,0,0,0|1,0,1]=4 552 B10R1.1 CCNc1ccc(cc1)Br e7368b650d842df07f1a9668bf0b4031 [1,1,0,0,0,0|2,0,0]=4 553 B10R1.1 CCNc1ccc(cc1)C 5bd280a2c0e051bd626f67ade06cc665 [1,1,0,0,0,0|2,0,0]=4 554 B10R1.1 CCNc1ccc(cc1)Cl 78a77ff2de1029463881d0096e3c40b4 [1,1,0,0,0,0|2,0,0]=4 555 B10R1.1 CCNc1ccc(cc1)F 7245e23faec7214139cc638d5d7041df [1,1,0,0,0,0|2,0,0]=4 556 B10R1.1 CCNc1ccc(cc1)I 08dbf719260fe2b9101a362dcb5b3f5c [1,1,0,0,0,0|2,0,0]=4 557 B10R1.1 CCNc1ccc(cc1)S d391e984cf82ddd3585ab73e3af8af78 [1,1,0,0,0,0|2,0,0]=4 558 B10R1.1 CCNc1ccc(nc1)Br 59c1c575d4cf738922707e4ac33945e2 [1,1,0,0,0,0|1,0,0]=3 559 B10R1.1 CCNc1ccc(nc1)C c6a305032b477973c3c3fbf0a9e4e681 [1,1,0,0,0,0|1,0,0]=3 560 B10R1.1 CCNc1ccc(nc1)Cl a3742bd50e5ddc0bb8d9bcc0351dba6f [1,1,0,0,0,0|1,0,0]=3 561 B10R1.1 CCNc1ccc(nc1)F 1c8d0a2e7c3ebc9b796eced21d4d67da [1,1,0,0,0,0|1,0,0]=3 562 B10R1.1 CCNc1ccc(nc1)I b055045d2de39aafb4b6d6710f7ae0e8 [1,1,0,0,0,0|1,0,0]=3 563 B10R1.1 CCNc1ccc(nn1)Br e192cd044ddddfa30a2da65dc4d391b6 [1,1,0,0,0,0|2,0,0]=4 564 B10R1.1 CCNc1ccc(nn1)C 2df667a473be0707f8096766eec8d6da [1,1,0,0,0,0|2,0,0]=4 565 B10R1.1 CCNc1ccc(nn1)Cl 81d466b3654e06d0322942354b3ac055 [1,1,0,0,0,0|2,0,0]=4 566 B10R1.1 CCNc1ccc(nn1)F 243b43310d3eb40fd9cb6fb51a1e8a34 [1,1,0,0,0,0|2,0,0]=4 567 B10R1.1 CCNc1ccc(nn1)I e6168a360292a5203c1c39b76c0832e4 [1,1,0,0,0,0|2,0,0]=4 568 B10R1.1 CCNc1cnc(=O)[nH]c1 8ff4830f2b9c404e1f8152e288d7f2ab [1,1,0,0,0,0|2,0,0]=4 569 B10R1.1 CCNc1cnc(cn1)Br 6193fdd09c4d7196a3aa4cf36704c96a [1,1,0,0,0,0|2,0,0]=4 570 B10R1.1 CCNc1cnc(cn1)C 941166f6068049435314cb9c37d7492a [1,1,0,0,0,0|2,0,0]=4 571 B10R1.1 CCNc1cnc(cn1)Cl f988f1cb66650f066f78da27c7a3b727 [1,1,0,0,0,0|2,0,0]=4 572 B10R1.1 CCNc1cnc(cn1)I 35cfe6dab3f2769a734da88f1f6d579b [1,1,0,0,0,0|2,0,0]=4 573 B10R1.1 CCNc1cnc(nc1)Br 7b1bbd5d331434da1dc189fc2ddf49b7 [1,1,0,0,0,0|2,0,0]=4 574 B10R1.1 CCNc1cnc(nc1)C dbe594b14a04dd73ff8c9bcf511ef8e0 [1,1,0,0,0,0|2,0,0]=4 575 B10R1.1 CCNc1cnc(nc1)Cl b1ff6250e52182ef03fda4d6a9ffccaa [1,1,0,0,0,0|2,0,0]=4 576 B10R1.1 CCNc1cnc(nc1)I 5db750ec576a1c51623f1a79e3d99e73 [1,1,0,0,0,0|2,0,0]=4 577 B10R1.1 CCOc1ccc(cc1)Br 0e76a95a836dd2981a43d0b194227fd8 [1,1,0,0,0,0|2,0,0]=4 578 B10R1.1 CCOc1ccc(cc1)C 26efd14f9e8649940b64cdf1b3738f1b [1,1,0,0,0,0|2,0,0]=4 579 B10R1.1 CCOc1ccc(cc1)Cl 945eb2c259d4cb8905c1789c25d510a9 [1,1,0,0,0,0|2,0,0]=4 580 B10R1.1 CCOc1ccc(cc1)F 5faab7d15ff0cf2f779560e4d5e7448c [1,1,0,0,0,0|2,0,0]=4 581 B10R1.1 CCOc1ccc(cc1)I 53aa34317b2540d22d9ec7de628cac3d [1,1,0,0,0,0|2,0,0]=4 582 B10R1.1 CCOc1ccc(cc1)S 99269a211e814d9abbdc09864e525389 [1,1,0,0,0,0|2,0,0]=4 583 B10R1.1 CCOc1ccc(nc1)Br bac9395e09cd94d673b47afe64f445de [1,1,0,0,0,0|1,0,0]=3 584 B10R1.1 CCOc1ccc(nc1)C a681f7f0cc1b45047bb455631f3beced [1,1,0,0,0,0|1,0,0]=3 585 B10R1.1 CCOc1ccc(nc1)Cl 1b78e4b95bbcd168fec166181ff52b61 [1,1,0,0,0,0|1,0,0]=3 586 B10R1.1 CCOc1ccc(nc1)F a0e05acc1f44f1bf919de4da94e9dd90 [1,1,0,0,0,0|1,0,0]=3 587 B10R1.1 CCOc1ccc(nc1)I 131dd3afd2712c4ddfbf28645dd95597 [1,1,0,0,0,0|1,0,0]=3 588 B10R1.1 CCOc1ccc(nn1)Br aa3efeb23c5d2c39f110d43a02a7d163 [1,1,0,0,0,0|2,0,0]=4 589 B10R1.1 CCOc1ccc(nn1)C ee9fd1014ff64a75b92c11dd9cb2cc10 [1,1,0,0,0,0|2,0,0]=4 590 B10R1.1 CCOc1ccc(nn1)Cl e6c7617f85409e01211416488dbdaaeb [1,1,0,0,0,0|2,0,0]=4 591 B10R1.1 CCOc1cnc(cn1)Br 83cb7a09f1f3b33c9793e617c55d72e4 [1,1,0,0,0,0|2,0,0]=4 592 B10R1.1 CCOc1cnc(cn1)C a6786d3b21f17a52c07e0a7cd8d71436 [1,1,0,0,0,0|2,0,0]=4 593 B10R1.1 CCOc1cnc(cn1)Cl 76caff5da4dacc7bb582efd551ad366e [1,1,0,0,0,0|2,0,0]=4 594 B10R1.1 CCOc1cnc(cn1)I 974b9f18a3a0669671ad64bfebfa9c92 [1,1,0,0,0,0|2,0,0]=4 595 B10R1.1 CCOc1cnc(nc1)Br fa2c0fdb7e883c6004d644fad185f6d3 [1,1,0,0,0,0|2,0,0]=4 596 B10R1.1 CCOc1cnc(nc1)C d7956e7814c65fdaee661cddc1d6f6d3 [1,1,0,0,0,0|2,0,0]=4 597 B10R1.1 CCOc1cnc(nc1)Cl 72d1b4ea92a00fe1e697303076b2bf21 [1,1,0,0,0,0|2,0,0]=4 598 B10R1.1 Cc1ccc(cn1)NCF f847d1a4bbb87566340c9e5a24558a24 [1,1,0,0,0,0|2,0,0]=4 599 B10R1.1 Cc1ccc(cn1)NCO fd814a39a039a510f879e6acc6bae8ec [1,1,0,0,0,0|2,0,0]=4 600 B10R1.1 Cc1ccc(cn1)OCF 74689607a43c2a9e18ce0cd22a8d942d [1,1,0,0,0,0|2,0,0]=4 601 B10R1.1 FCNc1ccc(nc1)Br 6261b0bc6b3ff3510bf1c71a3860f462 [1,1,0,0,0,0|2,0,0]=4 602 B10R1.1 FCNc1ccc(nc1)Cl 91c36365220c1b2120abfc67c7a4beb0 [1,1,0,0,0,0|2,0,0]=4 603 B10R1.1 FCNc1ccc(nc1)F b6ffb991ac7e44e5f6b16b3a713f9190 [1,1,0,0,0,0|2,0,0]=4 604 B10R1.1 FCNc1ccc(nc1)I 5b740bad1f8c1deefa5b346bd729bada [1,1,0,0,0,0|2,0,0]=4 605 B10R1.1 FCOc1ccc(nc1)Br e3796b17ff3d2d2dd46e80f84fb6187d [1,1,0,0,0,0|2,0,0]=4 606 B10R1.1 FCOc1ccc(nc1)Cl 70a5644c7430704168998528ea5ce13b [1,1,0,0,0,0|2,0,0]=4 607 B10R1.1 FCOc1ccc(nc1)F 77ab35a2a6dcafe96de60a2128f5fe49 [1,1,0,0,0,0|2,0,0]=4 608 B10R1.1 FCOc1ccc(nc1)I 03bd4c63f213b54e5f564a7a1a2fd6ff [1,1,0,0,0,0|2,0,0]=4 609 B10R1.1 OCNc1ccc(nc1)Br 399f860b3f8af2a89c07a3b0752fb11e [1,1,0,0,0,0|2,0,0]=4 610 B10R1.1 OCNc1ccc(nc1)Cl d6034f7aa3e9576c3befbcbc74c36153 [1,1,0,0,0,0|2,0,0]=4 611 B10R1.1 OCNc1ccc(nc1)F 9c48cfa9cdfaaee705bc9f41b078a0e2 [1,1,0,0,0,0|2,0,0]=4 612 B10R1.1 OCNc1ccc(nc1)I 115f65afea3289921087b1ab2d1633ed [1,1,0,0,0,0|2,0,0]=4 613 B10R1.4 CCNc1c[nH]cnc1=O 92fe3a14d8150c5096d77f1d75bfd4e2 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.4 CCNc1ccc[nH]c1=S 67a5b3b55c36deab6cc15e67fc040e75 [1,1,0,0,0,0|1,0,1]=4 615 B10R1.4 CCNc1ccccc1Cl 2dfb513d252d373232906f5030075d40 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.4 CCNc1ccccc1F 7ab2c72548cf5934972f59a05bcf3b98 [1,1,0,0,0,0|2,0,0]=4 617 B10R1.4 CCNc1ccccc1I a15e1e777d9cb3c3c67c713eae1f152f [1,1,0,0,0,0|2,0,0]=4 618 B10R1.4 CCNc1cccnc1Br a2373bd4dbeea9e96613175b1fa389be [1,1,0,0,0,0|1,0,0]=3 619 B10R1.4 CCNc1cccnc1C aa29ce1aae1cb0173cce32ed6de53439 [1,1,0,0,0,0|1,0,0]=3 620 B10R1.4 CCNc1cccnc1Cl cabaa73226660203e29d27ac34157732 [1,1,0,0,0,0|1,0,0]=3 621 B10R1.4 CCNc1cccnc1F 1c26bd9832ea7353d5986c5b2a82ebeb [1,1,0,0,0,0|1,0,0]=3 622 B10R1.4 CCNc1cccnc1I aa60c46f7fe874be857c1ace71f86b31 [1,1,0,0,0,0|1,0,0]=3 623 B10R1.4 CCNc1ccnnc1Br bd12c41ba88602ebc9c64a3180ace8b2 [1,1,0,0,0,0|2,0,0]=4 624 B10R1.4 CCNc1ccnnc1C b89b8af7958b7cd2d083023eee6d381c [1,1,0,0,0,0|2,0,0]=4 625 B10R1.4 CCNc1ccnnc1Cl 274b4ecd2ca4e79cbfe10d7f6ee90103 [1,1,0,0,0,0|2,0,0]=4 626 B10R1.4 CCNc1cnccc1Br 16ccd75ae6484f9482a40238b5f84138 [1,1,0,0,0,0|1,0,0]=3 627 B10R1.4 CCNc1cnccc1C 4e74c1f11dcd52a7c20dfdd6b5662790 [1,1,0,0,0,0|1,0,0]=3 628 B10R1.4 CCNc1cnccc1Cl fce9e815cea92983ee0d8ac5fb395bc8 [1,1,0,0,0,0|1,0,0]=3 629 B10R1.4 CCNc1cnccc1F efcbd8573a43bcdf8091057e7ebdf59e [1,1,0,0,0,0|1,0,0]=3 630 B10R1.4 CCNc1cnccc1I 11de2c92a556b377d01b5ed33d779892 [1,1,0,0,0,0|1,0,0]=3 631 B10R1.4 CCNc1cnccc1S b06232fe6249f36d78efb086b14dd641 [1,1,0,0,0,0|1,0,0]=3 632 B10R1.4 CCNc1cncnc1Br 0995cba514c5c52cf1ff4087b5bf444f [1,1,0,0,0,0|2,0,0]=4 633 B10R1.4 CCNc1cncnc1C c780de3350d8a4ea3afb5887d12adc9b [1,1,0,0,0,0|2,0,0]=4 634 B10R1.4 CCNc1cncnc1Cl b13fe482777c2ee0f7c3bc51abe459e4 [1,1,0,0,0,0|2,0,0]=4 635 B10R1.4 CCNc1cnncc1Br 6fceee5bc94cee4e42616f84d1663fb1 [1,1,0,0,0,0|2,0,0]=4 636 B10R1.4 CCNc1cnncc1Cl 2fc501610661e5c8c63a465f86256d2d [1,1,0,0,0,0|2,0,0]=4 637 B10R1.4 CCNc1nccnc1Br 2d907f4bd6f02c9cef277fbcf41c453b [1,1,0,0,0,0|2,0,0]=4 638 B10R1.4 CCNc1nccnc1C 3a642966a1abe913b5ad08a3a9152c71 [1,1,0,0,0,0|2,0,0]=4 639 B10R1.4 CCNc1nccnc1Cl e6a9b6e484a84024d5e12240604a943c [1,1,0,0,0,0|2,0,0]=4 640 B10R1.4 CCNc1nccnc1I 4c45ef2dd2308c7078fb2cb28ca195b4 [1,1,0,0,0,0|2,0,0]=4 641 B10R1.4 CCNc1nnccc1C 691f3c86375c4bbd77548a51226e95ba [1,1,0,0,0,0|2,0,0]=4 642 B10R1.4 CCOc1c[nH]cnc1=O 0d97be97c3076d07178cdd68cb6e2a14 [1,1,0,0,0,0|2,0,0]=4 643 B10R1.4 CCOc1ccc[nH]c1=S 8c21bc69d2dc6be5a606751c990f45b9 [1,1,0,0,0,0|1,0,1]=4 644 B10R1.4 CCOc1ccccc1C dc9ee1b6b8a241cf6f51757c9fedb385 [1,1,0,0,0,0|2,0,0]=4 645 B10R1.4 CCOc1ccccc1Cl 9b9ed61fe6629f2df6b1eaddc9ec2e8a [1,1,0,0,0,0|2,0,0]=4 646 B10R1.4 CCOc1ccccc1F 41f85306b1c4b7c4daecba5a00d66cce [1,1,0,0,0,0|2,0,0]=4 647 B10R1.4 CCOc1ccccc1I 3bfd90529c85539df6076f624de1f80d [1,1,0,0,0,0|2,0,0]=4 648 B10R1.4 CCOc1cccnc1Br 08b45b24e31de1110a9d86520664a434 [1,1,0,0,0,0|1,0,0]=3 649 B10R1.4 CCOc1cccnc1C 0260c4935677d055d800178e37d974b6 [1,1,0,0,0,0|1,0,0]=3 650 B10R1.4 CCOc1cccnc1Cl 684709ad9eeb4a1f4f9e4a19760d89be [1,1,0,0,0,0|1,0,0]=3 651 B10R1.4 CCOc1cccnc1F eb46cca158e1b62d818714a01a5af0f3 [1,1,0,0,0,0|1,0,0]=3 652 B10R1.4 CCOc1cccnc1I 792b0a09e935918385422ce79b947b91 [1,1,0,0,0,0|1,0,0]=3 653 B10R1.4 CCOc1cccoc1=O 7ff4b51ee01af505d2964258091f5c59 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.4 CCOc1ccnnc1Cl 7c3ad384cedf6497d6238270485d57d8 [1,1,0,0,0,0|2,0,0]=4 655 B10R1.4 CCOc1cnccc1Br cc65e9d894dca176f1e04b368966ac9b [1,1,0,0,0,0|1,0,0]=3 656 B10R1.4 CCOc1cnccc1C 50b788e4b20e4d60835564cb398dcb8c [1,1,0,0,0,0|1,0,0]=3 657 B10R1.4 CCOc1cnccc1Cl 9252fbdc2aaa496a5df46d8e859e8bec [1,1,0,0,0,0|1,0,0]=3 658 B10R1.4 CCOc1cnccc1F 48497666769166ce90aacce840caeccc [1,1,0,0,0,0|1,0,0]=3 659 B10R1.4 CCOc1cnccc1I b3ec03f0e98ec8d0e34044a0a69fa976 [1,1,0,0,0,0|1,0,0]=3 660 B10R1.4 CCOc1cncnc1C ae58a7be391f847fd7fcfb6c7cbd61b8 [1,1,0,0,0,0|2,0,0]=4 661 B10R1.4 CCOc1cncnc1I 95f0fce970116575f4736c252c27bb83 [1,1,0,0,0,0|2,0,0]=4 662 B10R1.4 CCOc1cnncc1Br 7d252e61da679c5c9cc95733cca05e1f [1,1,0,0,0,0|2,0,0]=4 663 B10R1.4 CCOc1cnncc1Cl 3a12f86025251c97f4d54b618762acb6 [1,1,0,0,0,0|2,0,0]=4 664 B10R1.4 CCOc1coccc1=O f03228b8de8c0c009e2b1ec644801385 [1,1,0,0,0,0|2,0,0]=4 665 B10R1.4 CCOc1nccnc1Br e4d444716c2ebf53c1141d98c73fd09e [1,1,0,0,0,0|2,0,0]=4 666 B10R1.4 CCOc1nccnc1C 51150a087141b1b997c624a726b47861 [1,1,0,0,0,0|2,0,0]=4 667 B10R1.4 CCOc1nnccc1C c18a8624109f039b80ba9ad6e855516b [1,1,0,0,0,0|2,0,0]=4 668 B10R1.4 CCOc1nnccc1Cl d603eca91d68438f9f871d8ac5a608c2 [1,1,0,0,0,0|2,0,0]=4 669 B10R1.4 CCOc1nnccc1I 2a8322b50ab03b887bc90327d5ab3a23 [1,1,0,0,0,0|2,0,0]=4 670 B10R1.4 Cc1ccncc1NCF c6aff9390de69367fa24d83c449f9a21 [1,1,0,0,0,0|2,0,0]=4 671 B10R1.4 Cc1ccncc1NCO e4933813d96bfefaf0bee2f99290507f [1,1,0,0,0,0|2,0,0]=4 672 B10R1.4 Cc1ccncc1OCF 1f7b2e5a2ad6b56329c1c2b95551e972 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.4 Cc1ncccc1NCF 811f0102399d1828b22fe489d7a22ddb [1,1,0,0,0,0|2,0,0]=4 674 B10R1.4 Cc1ncccc1NCO 2163da6c3951ac44c1be417e09664d52 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.4 Cc1ncccc1OCF 5bc55fc04a01d4a91e7fbd84fd947089 [1,1,0,0,0,0|2,0,0]=4 676 B10R1.4 FCNc1cccnc1Br 257ea0f7c5fea2905789e1f360396f08 [1,1,0,0,0,0|2,0,0]=4 677 B10R1.4 FCNc1cccnc1Cl a5a484ca3cbc7be99993c52cc07f21db [1,1,0,0,0,0|2,0,0]=4 678 B10R1.4 FCNc1cccnc1F e0f0f84116dfdaf85dd004b1ee9e779b [1,1,0,0,0,0|2,0,0]=4 679 B10R1.4 FCNc1cccnc1I faec914d99bc802b42e56135a7ca633e [1,1,0,0,0,0|2,0,0]=4 680 B10R1.4 FCNc1cnccc1Br 0c84c5a1462f11e4a85475222029115b [1,1,0,0,0,0|2,0,0]=4 681 B10R1.4 FCNc1cnccc1Cl d9d637d586d1e1ecebb63b63e728d12c [1,1,0,0,0,0|2,0,0]=4 682 B10R1.4 FCNc1cnccc1F e52011c23a846bdb9312eee89fa4fbb5 [1,1,0,0,0,0|2,0,0]=4 683 B10R1.4 FCNc1cnccc1I 4d44c68b85277006edc3a786e056fa56 [1,1,0,0,0,0|2,0,0]=4 684 B10R1.4 FCNc1cnccc1S 812d31337934d782d0723eec299436bb [1,1,0,0,0,0|2,0,0]=4 685 B10R1.4 FCOc1cccnc1Br 61d12b0f266165b87123c22de77ab591 [1,1,0,0,0,0|2,0,0]=4 686 B10R1.4 FCOc1cccnc1Cl a634614515cfce5111bbed326e3d2843 [1,1,0,0,0,0|2,0,0]=4 687 B10R1.4 FCOc1cccnc1F b70e8d0c73b322628c78b1d6ffaf8db3 [1,1,0,0,0,0|2,0,0]=4 688 B10R1.4 FCOc1cccnc1I 600c68a945224bbca21cf419446c3ed1 [1,1,0,0,0,0|2,0,0]=4 689 B10R1.4 FCOc1cnccc1Br b6ddd33a623297ef528ef66f70dcf680 [1,1,0,0,0,0|2,0,0]=4 690 B10R1.4 FCOc1cnccc1Cl 46db4bc68b6ee4515bf7620379190fa7 [1,1,0,0,0,0|2,0,0]=4 691 B10R1.4 FCOc1cnccc1F 358182ca0e513d2c82bd54056ff120aa [1,1,0,0,0,0|2,0,0]=4 692 B10R1.4 FCOc1cnccc1I e5038112465ba0d6b7a6f8ae789a77ab [1,1,0,0,0,0|2,0,0]=4 693 B10R1.4 OCNc1cccnc1Br 7e757b1b55f902889855879ddc522fb0 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.4 OCNc1cccnc1Cl 698ab8db9bc7be3255bc7380ce9aaa39 [1,1,0,0,0,0|2,0,0]=4 695 B10R1.4 OCNc1cccnc1F fa95074763d1b79d4379cbccbf606177 [1,1,0,0,0,0|2,0,0]=4 696 B10R1.4 OCNc1cccnc1I 24ae1d254ba17b837d586845f299b407 [1,1,0,0,0,0|2,0,0]=4 697 B10R1.4 OCNc1cnccc1Br 5d032f06debe2317bdc278b84367b2a4 [1,1,0,0,0,0|2,0,0]=4 698 B10R1.4 OCNc1cnccc1Cl 303a576d9462a0faf85137d3188ebf11 [1,1,0,0,0,0|2,0,0]=4 699 B10R1.4 OCNc1cnccc1F 3f2dcb75eda77bcd64256bb0d5fa488d [1,1,0,0,0,0|2,0,0]=4 700 B10R1.4 OCNc1cnccc1I b87052664ee5286776a0964c0ae129c4 [1,1,0,0,0,0|2,0,0]=4 701 B10R1.4 OCNc1cnccc1S 72adbafda58b2f8f71778b7cbd9fa239 [1,1,0,0,0,0|2,0,0]=4 702 B10R1.10 CCNc1cc(cnn1)Br 130f90fa291f924963953a2617e18d74 [1,1,0,0,0,0|2,0,0]=4 703 B10R1.10 CCNc1cc(cnn1)C df853daeb5beb8e11e5de6535edde9e0 [1,1,0,0,0,0|2,0,0]=4 704 B10R1.10 CCNc1cc(cnn1)Cl 7f86a4c17d3afab280cee5584f6c9186 [1,1,0,0,0,0|2,0,0]=4 705 B10R1.10 CCNc1cccc(c1)Br 3559ffa0b462d1bd714cf3ca993ed95e [1,1,0,0,0,0|2,0,0]=4 706 B10R1.10 CCNc1cccc(c1)C 7e90094bdff0d2ffec0927834a6a088a [1,1,0,0,0,0|2,0,0]=4 707 B10R1.10 CCNc1cccc(c1)Cl e86c6a0dbdc5ec7691435dfb2bf0caac [1,1,0,0,0,0|2,0,0]=4 708 B10R1.10 CCNc1cccc(c1)F fb10d26ad355d9adf069631a680226b5 [1,1,0,0,0,0|2,0,0]=4 709 B10R1.10 CCNc1cccc(c1)I 9531fa5d8f78367f3126484c4e782fa9 [1,1,0,0,0,0|2,0,0]=4 710 B10R1.10 CCNc1cccc(c1)S a44d310b6eb926e6cc396b05b3cff23a [1,1,0,0,0,0|2,0,0]=4 711 B10R1.10 CCNc1cn[nH]c(=O)c1 0f95cb81e0703d57c6cf0bc73d66c64b [1,1,0,0,0,0|2,0,0]=4 712 B10R1.10 CCNc1cncc(c1)Br 32c3d20c2a967ffd8b369baff96df78b [1,1,0,0,0,0|1,0,0]=3 713 B10R1.10 CCNc1cncc(c1)C 3532d78dae514f8ef5b485b2e6860ebe [1,1,0,0,0,0|1,0,0]=3 714 B10R1.10 CCNc1cncc(c1)Cl 291ad30b57031986784f4e159245ef5b [1,1,0,0,0,0|1,0,0]=3 715 B10R1.10 CCNc1cncc(c1)F eb3b221df4c2b29925e5d3320a410797 [1,1,0,0,0,0|1,0,0]=3 716 B10R1.10 CCNc1cncc(c1)I e218a1afe6a6aca6d71c039b21806c27 [1,1,0,0,0,0|1,0,0]=3 717 B10R1.10 CCNc1cncc(n1)Br 770b397851bc6547edd2c903a2ac898f [1,1,0,0,0,0|2,0,0]=4 718 B10R1.10 CCNc1cncc(n1)C c6553f13dc26f5036471e9acc89e9094 [1,1,0,0,0,0|2,0,0]=4 719 B10R1.10 CCNc1cncc(n1)Cl 19802d29a0366658b0d20a1b222f5acc [1,1,0,0,0,0|2,0,0]=4 720 B10R1.10 CCNc1cncc(n1)F dc25744462a94011d6172cb1be08948d [1,1,0,0,0,0|2,0,0]=4 721 B10R1.10 CCNc1cnnc(c1)Cl ecf2838989b785b3afa52f75c7d1dfc9 [1,1,0,0,0,0|2,0,0]=4 722 B10R1.10 CCNc1cnnc(c1)F a29c374b84ab7163056f299be097d9e0 [1,1,0,0,0,0|2,0,0]=4 723 B10R1.10 CCOc1ccc[n+](c1)[O-] fe135ea11184d89f3d575034577b6c53 [1,1,0,0,0,0|1,0,1]=4 724 B10R1.10 CCOc1cccc(c1)Br 59b0f5cf1b6eeed19f09ca4b10ff10f6 [1,1,0,0,0,0|2,0,0]=4 725 B10R1.10 CCOc1cccc(c1)C c484b8098bb494764323b4d807c3d871 [1,1,0,0,0,0|2,0,0]=4 726 B10R1.10 CCOc1cccc(c1)Cl 0302a2b3778df08595f07cb1f730b10b [1,1,0,0,0,0|2,0,0]=4 727 B10R1.10 CCOc1cccc(c1)F e3c752114bd9c3d3cb33513b156f9036 [1,1,0,0,0,0|2,0,0]=4 728 B10R1.10 CCOc1cccc(c1)I 0d8a8a4223f2d3d3697a5720204df0bd [1,1,0,0,0,0|2,0,0]=4 729 B10R1.10 CCOc1cccc(c1)S 0a6998f5983825c4343bcc0ed4a9090c [1,1,0,0,0,0|2,0,0]=4 730 B10R1.10 CCOc1cncc(c1)C 9fa5233d4ea9ce3b8225bbc243f1f651 [1,1,0,0,0,0|1,0,0]=3 731 B10R1.10 CCOc1cncc(c1)Cl a02433d9cea7b28adfbfbce32981ccfd [1,1,0,0,0,0|1,0,0]=3 732 B10R1.10 CCOc1cncc(c1)F 31714c319aae0ab59ee10e9b01cc1a2a [1,1,0,0,0,0|1,0,0]=3 733 B10R1.10 CCOc1cncc(c1)I 50cf1cd1a59fe9ac9a9438b380797254 [1,1,0,0,0,0|1,0,0]=3 734 B10R1.10 CCOc1cncc(n1)Br ac72de76110949789a848aac900ff2b7 [1,1,0,0,0,0|2,0,0]=4 735 B10R1.10 CCOc1cncc(n1)Cl 3eb84960d06478c872d1ba605fcc4563 [1,1,0,0,0,0|2,0,0]=4 736 B10R1.10 CCOc1cnnc(c1)Cl 37851bb53d3b270716ffa7105bb5e275 [1,1,0,0,0,0|2,0,0]=4 737 B10R1.10 Cc1cncc(c1)NCF 5343e85263b0b99dab3d7254e4aad5ed [1,1,0,0,0,0|2,0,0]=4 738 B10R1.10 Cc1cncc(c1)NCO ee496a79f8157af8a8b0a0a3c499d815 [1,1,0,0,0,0|2,0,0]=4 739 B10R1.10 Cc1cncc(c1)OCF f920f15dbcb79c65d9bc0eff7cb956f0 [1,1,0,0,0,0|2,0,0]=4 740 B10R1.10 FCNc1cncc(c1)Br b188c10b8e918fe01ed42b63f2346fe8 [1,1,0,0,0,0|2,0,0]=4 741 B10R1.10 FCNc1cncc(c1)Cl 2ff7f7fffa82dc37f7f86c52319b3a7d [1,1,0,0,0,0|2,0,0]=4 742 B10R1.10 FCNc1cncc(c1)F d960286dc19ed9a9020e0e2410a96042 [1,1,0,0,0,0|2,0,0]=4 743 B10R1.10 FCNc1cncc(c1)I 410f949ccfe79cd885640d8087e67cdb [1,1,0,0,0,0|2,0,0]=4 744 B10R1.10 FCOc1cncc(c1)Cl ee93bb00de138ca911f29a8550fe75b1 [1,1,0,0,0,0|2,0,0]=4 745 B10R1.10 FCOc1cncc(c1)F b983d1e8a90686325283b24aa91ccfee [1,1,0,0,0,0|2,0,0]=4 746 B10R1.10 FCOc1cncc(c1)I cfc9253c0d173cfbcc4ab64234f20c42 [1,1,0,0,0,0|2,0,0]=4 747 B10R1.10 OCNc1cncc(c1)Br 22786331e0dc6b8b09cf20d0897d5f3b [1,1,0,0,0,0|2,0,0]=4 748 B10R1.10 OCNc1cncc(c1)Cl 258ed832222e8466a5881e98d79e789b [1,1,0,0,0,0|2,0,0]=4 749 B10R1.10 OCNc1cncc(c1)F 2545bb631007d7963e0a0dd86ab2e1bf [1,1,0,0,0,0|2,0,0]=4 750 B10R1.10 OCNc1cncc(c1)I 73140cc0c98763c1139ab7b397b91de3 [1,1,0,0,0,0|2,0,0]=4 751 B10R1.15 CCN(C)c1ccccc1 9cc6568b1f30abe04427bdea858da30e [1,1,0,0,0,0|2,0,0]=4 752 B10R1.15 CCN(C)c1cccnc1 04b21f569d4c75e23135eca19e8dfd7f [1,1,0,0,0,0|1,0,0]=3 753 B10R1.15 CCN(C)c1ccnnc1 1ac91ab60a635fb5329291a771fa3c6f [1,1,0,0,0,0|2,0,0]=4 754 B10R1.15 CCN(C)c1cnccn1 a8ffa0df115721fdc6dd2269b8097d32 [1,1,0,0,0,0|2,0,0]=4 755 B10R1.15 CN(CF)c1cccnc1 242d56eee61bf5da227aba2cc8ffb8a2 [1,1,0,0,0,0|2,0,0]=4 756 B10R1.15 CN(CO)c1cccnc1 021ae75de63d9271d48b9d5b4bd35a1c [1,1,0,0,0,0|2,0,0]=4 757 B10R1.17 BrCCNc1ccccc1 08c39138e90dcc3ad4c25fdba0569b67 [1,1,0,0,0,0|2,0,0]=4 758 B10R1.17 BrCCNc1cccnc1 2d13be8c88ebb7269676c6abc03a383d [1,1,0,0,0,0|1,0,0]=3 759 B10R1.17 BrCCNc1cccnn1 8bb1d2166673e66012e04a5297d759dc [1,1,0,0,0,0|2,0,0]=4 760 B10R1.17 C#CCNc1cccnc1 eab2f89c8ef7db5012639b0af7544f62 [1,1,0,0,0,0|0,0,2]=4 761 B10R1.17 C#CCOc1cccnc1 a0b168844b4ce712744918a8214c551f [1,1,0,0,0,0|0,0,2]=4 762 B10R1.17 C=CCNc1cccnc1 91b240dd75d71a218918690927e5881a [1,1,0,0,0,0|0,0,2]=4 763 B10R1.17 C=CCOc1cccnc1 7fb30f1efe498d0d31dd0f3d48945875 [1,1,0,0,0,0|0,0,2]=4 764 B10R1.17 CCCNc1ccccc1 b539dcf8361adb43cc5ffbb8617222f9 [1,1,0,0,0,0|1,0,0]=3 765 B10R1.17 CCCNc1ccccn1 d0e3424364e1c8a55b80e6e83d3696ba [1,1,0,0,0,0|2,0,0]=4 766 B10R1.17 CCCNc1cccnc1 54f0ece250e78709faf1eb2fd4dc869b [1,1,0,0,0,0|0,0,0]=2 767 B10R1.17 CCCNc1cccnn1 563334c6dadea743653cde03719d759b [1,1,0,0,0,0|1,0,0]=3 768 B10R1.17 CCCNc1ccncc1 d6095b2a5c05617a6cec49b81fb053c5 [1,1,0,0,0,0|2,0,0]=4 769 B10R1.17 CCCNc1ccnnc1 2caee9d9c90b98666cbfecfa06fa8cff [1,1,0,0,0,0|1,0,0]=3 770 B10R1.17 CCCNc1cnccn1 21846cbecedbe2640cf1187c9cb12883 [1,1,0,0,0,0|1,0,0]=3 771 B10R1.17 CCCNc1cncnc1 2bb7fb2ced184242938c7fda4c6e1a37 [1,1,0,0,0,0|1,0,0]=3 772 B10R1.17 CCCNc1cnncn1 ae485abbfb53ff29b4abc600381cf9a2 [1,1,0,0,0,0|2,0,0]=4 773 B10R1.17 CCCNc1nccnn1 ba977de7796519a7c9234ce6324979fd [1,1,0,0,0,0|2,0,0]=4 774 B10R1.17 CCCOc1ccccn1 6e04423b9fd777130a88eaa9fd38fe0c [1,1,0,0,0,0|2,0,0]=4 775 B10R1.17 CCCOc1cccnc1 a97f517fc793a805aaab3ac7468bbd26 [1,1,0,0,0,0|0,0,0]=2 776 B10R1.17 CCCOc1ccncc1 f349ca52270425380eacc7a2a158cca4 [1,1,0,0,0,0|2,0,0]=4 777 B10R1.17 CCCOc1ccnnc1 3c9c3d60b434f5a1bdb1673f40955496 [1,1,0,0,0,0|1,0,0]=3 778 B10R1.17 CCCOc1cnccn1 63621ef82dd8a608febe84451551c55a [1,1,0,0,0,0|1,0,0]=3 779 B10R1.17 CCCOc1cncnc1 3e9abc9b1ba148ce4f151dd0bc3facae [1,1,0,0,0,0|1,0,0]=3 780 B10R1.17 CCCOc1cncnn1 bc5670d65c0c36d3b12443fc4957fbb6 [1,1,0,0,0,0|2,0,0]=4 781 B10R1.17 CCNCc1ccccc1 b1285c6596ffdf0473a3780bf23df272 [1,1,0,0,0,0|1,0,0]=3 782 B10R1.17 CCNCc1ccccn1 18cfef8413e038075fdfe85720c8bb60 [1,1,0,0,0,0|2,0,0]=4 783 B10R1.17 CCNCc1cccnc1 ef83bfb13d2744bc293d6f1d68f67b86 [1,1,0,0,0,0|0,0,0]=2 784 B10R1.17 CCNCc1cccnn1 d81bd9bf1bc516576c473bbc4cf064a6 [1,1,0,0,0,0|1,0,0]=3 785 B10R1.17 CCNCc1ccncc1 2e26d8de78e71e06bcd28df387653244 [1,1,0,0,0,0|2,0,0]=4 786 B10R1.17 CCNCc1ccnnc1 dc0861acfe2535501016a881a15b8655 [1,1,0,0,0,0|1,0,0]=3 787 B10R1.17 CCNCc1cnccn1 e42a4917d2a6a9dffed5bdafd4c5a5d6 [1,1,0,0,0,0|1,0,0]=3 788 B10R1.17 CCNCc1cncnc1 f9703e58bb488c49affd31e2d844b19f [1,1,0,0,0,0|1,0,0]=3 789 B10R1.17 CCOCc1ccccc1 551a24ad73c54bc42b4e27015fdb411f [1,1,0,0,0,0|1,0,0]=3 790 B10R1.17 CCOCc1ccccn1 0c63694580ac3136b3801886d248907b [1,1,0,0,0,0|2,0,0]=4 791 B10R1.17 CCOCc1cccnc1 5f09f824e7a9d5177841898d80553992 [1,1,0,0,0,0|0,0,0]=2 792 B10R1.17 CCOCc1cccnn1 a18ecdaafc84bd92138525fb2f4ad399 [1,1,0,0,0,0|1,0,0]=3 793 B10R1.17 CCOCc1ccncc1 1d1afe04b02325a5cf955e686c22ba10 [1,1,0,0,0,0|2,0,0]=4 794 B10R1.17 CCOCc1ccnnc1 eb3f0189714571d275860574016314ed [1,1,0,0,0,0|1,0,0]=3 795 B10R1.17 CCOCc1cnccn1 7fb271123056acc990d03d3767398eec [1,1,0,0,0,0|1,0,0]=3 796 B10R1.17 CCOCc1cncnc1 c69748ab8bdd1b31da65e1fc4248cd6d [1,1,0,0,0,0|1,0,0]=3 797 B10R1.17 COCNc1ccccc1 6c62c6b48b6ce69fe29d4b52e03d5674 [1,1,0,0,0,0|2,0,0]=4 798 B10R1.17 COCNc1cccnc1 06eb298a8599044156c09f99ea626504 [1,1,0,0,0,0|1,0,0]=3 799 B10R1.17 COCNc1cccnn1 81506436050659ef73117567fa6791d8 [1,1,0,0,0,0|2,0,0]=4 800 B10R1.17 COCNc1ccnnc1 45f0a2cd8410106cda79b7a687ce8831 [1,1,0,0,0,0|2,0,0]=4 801 B10R1.17 COCNc1cnccn1 e1b86a322d65d71968ad3b0b53c14350 [1,1,0,0,0,0|2,0,0]=4 802 B10R1.17 COCNc1cncnc1 bc5d34e0d8f01ead88e91841539995d3 [1,1,0,0,0,0|2,0,0]=4 803 B10R1.17 COCOc1cccnc1 d9b37fb8d6b9f459b8606485db596791 [1,1,0,0,0,0|1,0,0]=3 804 B10R1.17 COCOc1ccnnc1 5746e5661eb8bdd9f7470ef224e7a8c7 [1,1,0,0,0,0|2,0,0]=4 805 B10R1.17 COCOc1cnccn1 91692ef16c539c2f51ce9f654d4e167a [1,1,0,0,0,0|2,0,0]=4 806 B10R1.17 COCOc1cncnc1 c8928e72aff7270067cebc8e3780eb48 [1,1,0,0,0,0|2,0,0]=4 807 B10R1.17 CSCNc1ccccc1 7a27a5c68b132b0ae36908396631930e [1,1,0,0,0,0|2,0,0]=4 808 B10R1.17 CSCNc1cccnc1 e9d3d08db46089fcfbd01833b3252a03 [1,1,0,0,0,0|1,0,0]=3 809 B10R1.17 CSCNc1cccnn1 25ab19c91bfa446099e97e2e9884abac [1,1,0,0,0,0|2,0,0]=4 810 B10R1.17 CSCNc1ccnnc1 a85c8ee67fb4c3c2ce9026ea5cfc88c5 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.17 CSCNc1cnccn1 930f16f0ffaab42f985807a52dc0c6d1 [1,1,0,0,0,0|2,0,0]=4 812 B10R1.17 CSCNc1cncnc1 828be2e55be0b994fef15bd27d5d65c3 [1,1,0,0,0,0|2,0,0]=4 813 B10R1.17 CSCOc1cccnc1 ba5df6f707d429b8683f03b4c7f7b4a6 [1,1,0,0,0,0|1,0,0]=3 814 B10R1.17 CSCOc1ccnnc1 0070046e2fad809de4ff6148194da845 [1,1,0,0,0,0|2,0,0]=4 815 B10R1.17 CSCOc1cnccn1 52ffcd2be78a9b2f46dfb44270cb610f [1,1,0,0,0,0|2,0,0]=4 816 B10R1.17 CSCOc1cncnc1 5aaddc6f81bda81f76fb85fc9a4c08c2 [1,1,0,0,0,0|2,0,0]=4 817 B10R1.17 FCCNc1ccccc1 f275d2eb426a2818882d3c7dcacca572 [1,1,0,0,0,0|2,0,0]=4 818 B10R1.17 FCCNc1cccnc1 948881de1f8cebdb00d3305a89cccf21 [1,1,0,0,0,0|1,0,0]=3 819 B10R1.17 FCCNc1cccnn1 50662e1b5530675bc8d8d1093a0bcb88 [1,1,0,0,0,0|2,0,0]=4 820 B10R1.17 FCCNc1ccnnc1 f72a0e5efc8e040396ed3eb557f12e84 [1,1,0,0,0,0|2,0,0]=4 821 B10R1.17 FCCNc1cnccn1 dd60db3af5d33017b5272adbacfa821e [1,1,0,0,0,0|2,0,0]=4 822 B10R1.17 FCCNc1cncnc1 5544af6c105b140c42d0d584a7ec4dee [1,1,0,0,0,0|2,0,0]=4 823 B10R1.17 FCCOc1cccnc1 7a88b89adbe5c70a007fa3204bf675ab [1,1,0,0,0,0|1,0,0]=3 824 B10R1.17 FCCOc1ccnnc1 243e0c54c052e6ff2349f314f0ec297b [1,1,0,0,0,0|2,0,0]=4 825 B10R1.17 FCCOc1cnccn1 a0c148fc7e01278295d3fef98ce5f3d8 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.17 FCCOc1cncnc1 68e30014a141764f0ec796d610eefe90 [1,1,0,0,0,0|2,0,0]=4 827 B10R1.17 FCNCc1ccccc1 0dcd541b35f2d813e3bd4529f13aa61b [1,1,0,0,0,0|2,0,0]=4 828 B10R1.17 FCNCc1cccnc1 303a68c3e72902076a5285aac654492a [1,1,0,0,0,0|1,0,0]=3 829 B10R1.17 FCNCc1cccnn1 bce279edad5329c009e9b508fb1aee5b [1,1,0,0,0,0|2,0,0]=4 830 B10R1.17 FCNCc1ccnnc1 d185692542f754d77cea426ab5a1d258 [1,1,0,0,0,0|2,0,0]=4 831 B10R1.17 FCNCc1cnccn1 b6859870939f07ca1816c457c1ced744 [1,1,0,0,0,0|2,0,0]=4 832 B10R1.17 FCOCc1ccccc1 602c85a0828834d1798ab6d91c5aa92b [1,1,0,0,0,0|2,0,0]=4 833 B10R1.17 FCOCc1cccnc1 d58467b55ec7fcb175961d4ef6210edb [1,1,0,0,0,0|1,0,0]=3 834 B10R1.17 FCOCc1cccnn1 be211298f0d8017761d0379df43db85c [1,1,0,0,0,0|2,0,0]=4 835 B10R1.17 FCOCc1ccnnc1 4a1d0d881ff603951714ac4c6a9ce218 [1,1,0,0,0,0|2,0,0]=4 836 B10R1.17 FCOCc1cnccn1 a11466f76fde0f26dadf75b6a45d47be [1,1,0,0,0,0|2,0,0]=4 837 B10R1.17 FCOCc1cncnc1 d848736714f42309e73dcca953822687 [1,1,0,0,0,0|2,0,0]=4 838 B10R1.17 ICCNc1ccccc1 2e8d29f41a7952c3a309dd8ce57744b3 [1,1,0,0,0,0|2,0,0]=4 839 B10R1.17 ICCNc1cccnc1 bd2873fb4e8705ac6b2391510b61aca0 [1,1,0,0,0,0|1,0,0]=3 840 B10R1.17 ICCNc1cccnn1 25a4665350da72721cd932013095093a [1,1,0,0,0,0|2,0,0]=4 841 B10R1.17 N#CCNc1cccnc1 aef19f28ef5503c740dae1a61fe37e81 [1,1,0,0,0,0|1,0,1]=4 842 B10R1.17 N#CCOc1cccnc1 1683bec3c106a0c94f6430f126b41bb0 [1,1,0,0,0,0|1,0,1]=4 843 B10R1.17 N#CNCc1cccnc1 b7cd89e5cd4646b42c64988159c94b48 [1,1,0,0,0,0|1,0,1]=4 844 B10R1.17 O=CCNc1cccnc1 e9d89fc8f59db8f4ca1573408ae38233 [1,1,0,0,0,0|1,0,1]=4 845 B10R1.17 O=CCOc1cccnc1 1d2e939a386c96cb8d89a6882c0c8d7c [1,1,0,0,0,0|1,0,1]=4 846 B10R1.17 O=CNCc1cccnc1 86ebf2990a9293a0c4bc35942f9e4571 [1,1,0,0,0,0|1,0,1]=4 847 B10R1.17 OCCNc1ccccc1 39a30f826fab6ed2b66a9ec4a9dddbdb [1,1,0,0,0,0|2,0,0]=4 848 B10R1.17 OCCNc1cccnc1 528072d5adbbf320415662e70c05db36 [1,1,0,0,0,0|1,0,0]=3 849 B10R1.17 OCCNc1cccnn1 904669d1e67b66fbedf39e30d8f01302 [1,1,0,0,0,0|2,0,0]=4 850 B10R1.17 OCCNc1ccnnc1 6c844b991ad1b9c7f6f76a597c7a9487 [1,1,0,0,0,0|2,0,0]=4 851 B10R1.17 OCCNc1cnccn1 b8c8b329bec75a99372dd1b5fe38a887 [1,1,0,0,0,0|2,0,0]=4 852 B10R1.17 OCCNc1cncnc1 41f2b3166167c4b3726a258fdaf09eb3 [1,1,0,0,0,0|2,0,0]=4 853 B10R1.17 OCNCc1ccccc1 c4aaeb48f32c090af3c65531a6e27cd4 [1,1,0,0,0,0|2,0,0]=4 854 B10R1.17 OCNCc1cccnc1 86bd6343ace558a3752eaa3d1a554844 [1,1,0,0,0,0|1,0,0]=3 855 B10R1.17 OCNCc1cccnn1 ab22a6b6bf709ff19959feb80ebef395 [1,1,0,0,0,0|2,0,0]=4 856 B10R1.17 OCNCc1ccnnc1 b085a3150d717e399252729324dde4be [1,1,0,0,0,0|2,0,0]=4 857 B10R1.17 OCNCc1cnccn1 2e97e3c7cc39869beec41193ed233122 [1,1,0,0,0,0|2,0,0]=4 858 B10R1.17 OCNCc1cncnc1 c9fd3f017cac60092425968f0623c6bf [1,1,0,0,0,0|2,0,0]=4 859 B10R1.17 SCCNc1ccccc1 9bbad99372906cf90d9dd5df1e41681f [1,1,0,0,0,0|2,0,0]=4 860 B10R1.17 SCCNc1cccnc1 d7661b93dffeb3e5de5eb3930ee71345 [1,1,0,0,0,0|1,0,0]=3 861 B10R1.17 SCCNc1cccnn1 ea4f3403b14ed9358eb50c9965b8278f [1,1,0,0,0,0|2,0,0]=4 862 B10R1.17 SCCNc1ccnnc1 4b98d416f498dfa7b33f72b7412f9107 [1,1,0,0,0,0|2,0,0]=4 863 B10R1.17 SCCNc1cnccn1 7a532bee0aa009efe26ced5e1fd07b4c [1,1,0,0,0,0|2,0,0]=4 864 B10R1.17 SCCNc1cncnc1 ed8d75b060e30c05ab7a82cf5f2c11f0 [1,1,0,0,0,0|2,0,0]=4 865 B10R1.17 SCCOc1cccnc1 84b759d60311f3e5695c1f1ffc5005e0 [1,1,0,0,0,0|1,0,0]=3 866 B10R1.17 SCCOc1ccnnc1 5673b631a1663bfb350079153c8c7cce [1,1,0,0,0,0|2,0,0]=4 867 B10R1.17 SCCOc1cnccn1 9ed631421fd79ea9b405fc40aac58272 [1,1,0,0,0,0|2,0,0]=4 868 B10R1.17 SCCOc1cncnc1 cd4bab19f2b8cb77cdfafa7e307db447 [1,1,0,0,0,0|2,0,0]=4 869 B10R1.23 CC(C)N(C)c1cc[nH]n1 b361212e8717080c4b031123f4db3743 [0,1,0,0,1,0|2,0,0]=4 870 B10R1.23 CC(C)N(C)c1ccon1 354658eeef5c34df18131c4a519c898d [0,1,0,0,1,0|2,0,0]=4 871 B10R1.23 CC(C)N(C)c1ccsc1 cbe8ee114cc19a994a50bf9953012f36 [0,1,0,0,1,0|2,0,0]=4 872 B10R1.23 CC(C)N(C)c1cnoc1 01cc1c2f5e9d0c8274acf87fb8dde9a9 [0,1,0,0,1,0|2,0,0]=4 873 B10R1.23 CC(C)N(C)c1ncc[nH]1 e996d76195205f3f8762c434c29d54b3 [0,1,0,0,1,0|2,0,0]=4 874 B10R1.23 CC(C)N(C)c1ncco1 032eaac749afe91f9dd6a126785485bb [0,1,0,0,1,0|2,0,0]=4 875 B10R1.23 CC(C)N(C)c1nccs1 0da716d314b46282d1113d22534674ca [0,1,0,0,1,0|2,0,0]=4 876 B10R1.27 CC(CO)Nc1c[nH]cn1 6eb72fdd51dd6b72bb521d8dfb245acb [0,1,0,0,1,0|2,0,0]=4 877 B10R1.27 CC(CO)Nc1cc[nH]n1 0ffd55994cce1a1b0cbcd9395752b322 [0,1,0,0,1,0|2,0,0]=4 878 B10R1.27 CC(CO)Nc1ccno1 ab3fd6743711ebbcdb3890c6830a7441 [0,1,0,0,1,0|2,0,0]=4 879 B10R1.27 CC(CO)Nc1ccns1 d981ccbdd671efd65ca79878dbd4cacc [0,1,0,0,1,0|2,0,0]=4 880 B10R1.27 CC(CO)Nc1ccon1 f90964f8106751aa4c76d39a330214fd [0,1,0,0,1,0|2,0,0]=4 881 B10R1.27 CC(CO)Nc1ccsc1 d4ef7cd17bf5b12d95fcbd94ec641690 [0,1,0,0,1,0|2,0,0]=4 882 B10R1.27 CC(CO)Nc1cn[nH]c1 93c6fe82bcf36afca99e27089d4e240d [0,1,0,0,1,0|2,0,0]=4 883 B10R1.27 CC(CO)Nc1cncs1 ec530026e2a565a6d5fe442a1b9376ec [0,1,0,0,1,0|2,0,0]=4 884 B10R1.27 CC(CO)Nc1cnoc1 2e7628bf557919f11496d1e070291486 [0,1,0,0,1,0|2,0,0]=4 885 B10R1.27 CC(CO)Nc1cnsc1 b035b71dfdfcffb4206ecac528db3815 [0,1,0,0,1,0|2,0,0]=4 886 B10R1.27 CC(CO)Nc1cscn1 d0420bafbc963c287a91fad21e61ad63 [0,1,0,0,1,0|2,0,0]=4 887 B10R1.27 CC(CO)Nc1ncc[nH]1 dc65cc129b4d6607a3f16b77105f4174 [0,1,0,0,1,0|2,0,0]=4 888 B10R1.27 CC(CO)Nc1ncco1 476e20dc977ed373fbd6582477a12781 [0,1,0,0,1,0|2,0,0]=4 889 B10R1.27 CC(CO)Nc1nccs1 3af8aa6c51a5e4ace65bcef7b413dad9 [0,1,0,0,1,0|2,0,0]=4 890 B10R1.27 CCC(C)Nc1cc[nH]n1 09de7dfeb6644aa25d1b7ef6ff214ab5 [0,1,0,0,1,0|2,0,0]=4 891 B10R1.27 CCC(C)Nc1ccno1 62da887b146173e61776cb28fb7d4be3 [0,1,0,0,1,0|2,0,0]=4 892 B10R1.27 CCC(C)Nc1ccns1 06b03268348cafc8cda8651b0dc84600 [0,1,0,0,1,0|2,0,0]=4 893 B10R1.27 CCC(C)Nc1ccon1 414589f6fc16ca502b791f63f083c906 [0,1,0,0,1,0|2,0,0]=4 894 B10R1.27 CCC(C)Nc1ccsc1 7eaab02a416c25d5815b6ff6d36cc092 [0,1,0,0,1,0|2,0,0]=4 895 B10R1.27 CCC(C)Nc1cn[nH]c1 cd5d14917d5d2f87b7a38c487ee3193c [0,1,0,0,1,0|2,0,0]=4 896 B10R1.27 CCC(C)Nc1cnoc1 62c9f66300b9eff6ff22b6f31d2599eb [0,1,0,0,1,0|2,0,0]=4 897 B10R1.27 CCC(C)Nc1cnsc1 c4cdb9e0ab7a3fd461c26c554512f199 [0,1,0,0,1,0|2,0,0]=4 898 B10R1.27 CCC(C)Nc1cocn1 8b972e2f9ba535494feb0aec3203f3ae [0,1,0,0,1,0|2,0,0]=4 899 B10R1.27 CCC(C)Nc1cscn1 90fc9e14235e73feb81b47279a0cf0ea [0,1,0,0,1,0|2,0,0]=4 900 B10R1.27 CCC(C)Nc1ncc[nH]1 955376107bc7153bb56fe54fc04de2cf [0,1,0,0,1,0|2,0,0]=4 901 B10R1.27 CCC(C)Nc1ncco1 dd1a41bdc7d3616e95ccaa3968dfc430 [0,1,0,0,1,0|2,0,0]=4 902 B10R1.27 CCC(C)Nc1nccs1 14d585ec4dbfab69000ae73fa3ea4f85 [0,1,0,0,1,0|2,0,0]=4 903 B10R1.27 CCC(C)Oc1c[nH]cn1 14c44c5bc000242eb7c714fd3f30d115 [0,1,0,0,1,0|2,0,0]=4 904 B10R1.27 CCC(C)Oc1ccco1 d0beb7fde6d54ae64363161825c47c35 [0,1,0,0,1,0|2,0,0]=4 905 B10R1.27 CCC(C)Oc1cccs1 3541fcdf455861cca5d3a82e83b56fc2 [0,1,0,0,1,0|2,0,0]=4 906 B10R1.27 CCC(C)Oc1ccn[nH]1 8121f17a42999d5cb950a437f710e113 [0,1,0,0,1,0|2,0,0]=4 907 B10R1.27 CCC(C)Oc1ccsc1 f6e91691f71a98584aafe2fd8c513359 [0,1,0,0,1,0|2,0,0]=4 908 B10R1.27 CCC(C)Oc1cn[nH]c1 47f518e5418576782a067e373b5dd869 [0,1,0,0,1,0|2,0,0]=4 909 B10R1.27 CCC(C)Oc1cnoc1 0dbfd92e8585faf0470b7e14793a5759 [0,1,0,0,1,0|2,0,0]=4 910 B10R1.27 CCC(C)Oc1nccs1 552d81292af32750494a1fa49e5bd981 [0,1,0,0,1,0|2,0,0]=4 911 B10R1.27 CCC(C)On1cccn1 2390f189d726e5ed12116795d0aa5b0c [0,1,0,0,1,0|2,0,0]=4 912 B10R1.27 CCC(C)On1ccnc1 4db09a4a007e61b2bb1300652c5bc79f [0,1,0,0,1,0|2,0,0]=4 913 B10R1.27 CCN(C)Cc1ccc[nH]1 e347aa0aab5f8b91131036b76761899f [0,1,0,0,1,0|1,0,1]=4 914 B10R1.27 CCN(C)Cc1ccco1 76ba84af7af62748e537e57011bb5102 [0,1,0,0,1,0|2,0,0]=4 915 B10R1.27 CCN(C)Cc1cccs1 5856368746510a7217772fc0f20fa2c2 [0,1,0,0,1,0|2,0,0]=4 916 B10R1.27 CCN(C)Cc1ccn[nH]1 a780e7b05df5b77e3ef29f900a8ef87b [0,1,0,0,1,0|2,0,0]=4 917 B10R1.27 CCN(C)Cc1ccno1 2eaf5abe3f52570a6d35305ff6ab8c8c [0,1,0,0,1,0|2,0,0]=4 918 B10R1.27 CCN(C)Cc1ccon1 c90d9e708af50f84c1e50522b4b05519 [0,1,0,0,1,0|2,0,0]=4 919 B10R1.27 CCN(C)Cc1ccsc1 ca9741e2c34ae2b58839e0376b12d3da [0,1,0,0,1,0|2,0,0]=4 920 B10R1.27 CCN(C)Cc1cnoc1 6918de278a684940befb2db843a86dd7 [0,1,0,0,1,0|2,0,0]=4 921 B10R1.27 CCN(C)Cc1cocn1 cc520ad18a02391d9294dc6a870d4277 [0,1,0,0,1,0|2,0,0]=4 922 B10R1.27 CCN(C)Cc1cscn1 06b0ef73797210f2d8dd9715ba27cbeb [0,1,0,0,1,0|2,0,0]=4 923 B10R1.27 CCN(C)Cc1ncc[nH]1 51576a26cf23285268fc6a43ae44df8c [0,1,0,0,1,0|2,0,0]=4 924 B10R1.27 CCN(C)Cc1ncco1 fbd451ad928ae1f8a9b5356432adeaee [0,1,0,0,1,0|2,0,0]=4 925 B10R1.27 CCN(C)Cc1nccs1 83da24133995872d4de5fd709f9e84fb [0,1,0,0,1,0|2,0,0]=4 926 B10R1.27 CC[C@@H](C)Nc1ccns1 54df8c9edf490c0ca98b4518811bd68a [0,1,0,0,1,0|2,0,0]=4 927 B10R1.27 CC[C@@H](C)Nc1nccs1 bd90c5ea462b27161ef27a60e27ab6aa [0,1,0,0,1,0|2,0,0]=4 928 B10R1.27 CC[C@H](C)Nc1ccns1 914985381b44fe0dd82aa68a592147bd [0,1,0,0,1,0|2,0,0]=4 929 B10R1.27 CC[C@H](C)Nc1nccs1 438f0d8e3c7d2f6718abcfb5a0246117 [0,1,0,0,1,0|2,0,0]=4 930 B10R1.27 CN(CF)Cc1ccc[nH]1 5acb32a101efb0b989c02eb95cb384e2 [0,1,0,0,1,0|1,0,1]=4 931 B10R1.27 CN(CF)Cc1ccco1 a8a8f0beb1fa78278a0baf9423982cd2 [0,1,0,0,1,0|2,0,0]=4 932 B10R1.27 CN(CF)Cc1ccn[nH]1 0879c6e3f91afd0d874b9915ce6fc287 [0,1,0,0,1,0|2,0,0]=4 933 B10R1.27 CN(CF)Cc1ccno1 6b36826c098ffbb54752251c2e46362d [0,1,0,0,1,0|2,0,0]=4 934 B10R1.27 CN(CF)Cc1ccoc1 decbe8b035ce5785d111d38c9def188e [0,1,0,0,1,0|2,0,0]=4 935 B10R1.27 CN(CF)Cc1ccsc1 9141582d3e3fae00d7a9bc1b13896e49 [0,1,0,0,1,0|2,0,0]=4 936 B10R1.27 CN(CF)Cc1cncs1 d8f43a966ddf5daa5f9105ff72f22a53 [0,1,0,0,1,0|2,0,0]=4 937 B10R1.27 CN(CF)Cc1ncc[nH]1 4e9c458f5ea3d2214ca9f7706459c7e4 [0,1,0,0,1,0|2,0,0]=4 938 B10R1.27 CN(CF)Cc1ncco1 1f4cfd94c4573d62c0a91fe2a7a54ada [0,1,0,0,1,0|2,0,0]=4 939 B10R1.27 CN(CF)Cc1nccs1 76b81ecc461bfd98c8cd773e6baa9fa4 [0,1,0,0,1,0|2,0,0]=4 940 B10R1.27 CN(CO)Cc1ccc[nH]1 c72aaf1507d6728f270abf1c4e66a3a9 [0,1,0,0,1,0|1,0,1]=4 941 B10R1.27 CN(CO)Cc1ccco1 e35a02611f613e4c724702badf0f544d [0,1,0,0,1,0|2,0,0]=4 942 B10R1.27 CN(CO)Cc1cccs1 a40c7fb2047d4e6a583417f484ade9f5 [0,1,0,0,1,0|2,0,0]=4 943 B10R1.27 CN(CO)Cc1ccn[nH]1 d8485c0bdef5f648b89934fc27710807 [0,1,0,0,1,0|2,0,0]=4 944 B10R1.27 CN(CO)Cc1ccno1 ac30ffa7eb72f9187d08072dca6a1460 [0,1,0,0,1,0|2,0,0]=4 945 B10R1.27 CN(CO)Cc1ccoc1 618417c7a8474ba729bd3a7f7154463b [0,1,0,0,1,0|2,0,0]=4 946 B10R1.27 CN(CO)Cc1ccsc1 39352de0e71af3ee4958607fae092fa0 [0,1,0,0,1,0|2,0,0]=4 947 B10R1.27 CN(CO)Cc1cncs1 fb548b164b6c5980d3f030c693e404a1 [0,1,0,0,1,0|2,0,0]=4 948 B10R1.27 CN(CO)Cc1ncc[nH]1 870d2e3d7bd3e228151c9a4447081ff6 [0,1,0,0,1,0|2,0,0]=4 949 B10R1.27 CN(CO)Cc1ncco1 18a5a35534ae83cc3936672ca18cdcd7 [0,1,0,0,1,0|2,0,0]=4 950 B10R1.27 CN(CO)Cc1nccs1 d06950d5c93aa4efb61588c7e01d60dc [0,1,0,0,1,0|2,0,0]=4 951 B10R1.27 C[C@@H](CO)Nc1c[nH]cn1 4d37ea81516d8b3a5ad800d13f38c6fc [0,1,0,0,1,0|2,0,0]=4 952 B10R1.27 C[C@@H](CO)Nc1cc[nH]n1 bd5e87838b6fa04965268423835b08a2 [0,1,0,0,1,0|2,0,0]=4 953 B10R1.27 C[C@@H](CO)Nc1ccno1 cb2350f31e7e07c2e0ef7fd94c8b6b49 [0,1,0,0,1,0|2,0,0]=4 954 B10R1.27 C[C@@H](CO)Nc1ccns1 fc0639dc64a6eb6ac1f913f3a10230ea [0,1,0,0,1,0|2,0,0]=4 955 B10R1.27 C[C@@H](CO)Nc1ccsc1 0886900d68aecc92d8e1a439fbe53380 [0,1,0,0,1,0|2,0,0]=4 956 B10R1.27 C[C@@H](CO)Nc1cn[nH]c1 bfa882f9b8221432ff483ed5d5392035 [0,1,0,0,1,0|2,0,0]=4 957 B10R1.27 C[C@@H](CO)Nc1cnoc1 96f13ca28629e71f572b4a3333f6a2ad [0,1,0,0,1,0|2,0,0]=4 958 B10R1.27 C[C@@H](CO)Nc1cnsc1 6601ee130224438e1d3b68e7dad49ac4 [0,1,0,0,1,0|2,0,0]=4 959 B10R1.27 C[C@@H](CO)Nc1cscn1 22be2db7c9adea2c3985a07cff732a41 [0,1,0,0,1,0|2,0,0]=4 960 B10R1.27 C[C@@H](CO)Nc1ncc[nH]1 cb8c1a0c0a3a444b7a97e5d80643c1f9 [0,1,0,0,1,0|2,0,0]=4 961 B10R1.27 C[C@@H](CO)Nc1ncco1 d4704a7540aa2361b2782f41f8ef8798 [0,1,0,0,1,0|2,0,0]=4 962 B10R1.27 C[C@@H](CO)Nc1nccs1 0bcb7a0b35e1463326ec7c2359e6f1cc [0,1,0,0,1,0|2,0,0]=4 963 B10R1.27 C[C@H](CO)Nc1c[nH]cn1 a9db3affd03815e8461b33aca9cef864 [0,1,0,0,1,0|2,0,0]=4 964 B10R1.27 C[C@H](CO)Nc1cc[nH]n1 06133ea0c7b0418e8486885775236cea [0,1,0,0,1,0|2,0,0]=4 965 B10R1.27 C[C@H](CO)Nc1ccno1 66c43430ea94610d388a29b1e4970c9f [0,1,0,0,1,0|2,0,0]=4 966 B10R1.27 C[C@H](CO)Nc1ccns1 671a2b7a32a2faa86cb2cc86b97885b2 [0,1,0,0,1,0|2,0,0]=4 967 B10R1.27 C[C@H](CO)Nc1ccsc1 a6f626205a030254be17ae1998a6bbac [0,1,0,0,1,0|2,0,0]=4 968 B10R1.27 C[C@H](CO)Nc1cn[nH]c1 bcfed78acf83af99cb8083e723eb7268 [0,1,0,0,1,0|2,0,0]=4 969 B10R1.27 C[C@H](CO)Nc1cnoc1 03342d1f3f03b90ee497adee517bfaa5 [0,1,0,0,1,0|2,0,0]=4 970 B10R1.27 C[C@H](CO)Nc1cnsc1 dbe40918d5f49991530f216b6e1fea86 [0,1,0,0,1,0|2,0,0]=4 971 B10R1.27 C[C@H](CO)Nc1cscn1 769919f81796fd5fc01a621e09132665 [0,1,0,0,1,0|2,0,0]=4 972 B10R1.27 C[C@H](CO)Nc1ncc[nH]1 e959c8adf326dfc6c3beedbc3728b254 [0,1,0,0,1,0|2,0,0]=4 973 B10R1.27 C[C@H](CO)Nc1ncco1 b40b86c99c3d96039154be111d41b3a2 [0,1,0,0,1,0|2,0,0]=4 974 B10R1.27 C[C@H](CO)Nc1nccs1 50b88dc633b43e9b1ba1c862b8a07226 [0,1,0,0,1,0|2,0,0]=4 975 B10R1.54 CC(C)Nc1cc([nH]n1)Br 0ffc1a68c141762e97527be37bdbf679 [0,1,0,0,1,0|2,0,0]=4 976 B10R1.54 CC(C)Nc1cc([nH]n1)F fc4d0a89d2f55b6af53694a1243ccec6 [0,1,0,0,1,0|2,0,0]=4 977 B10R1.54 CC(C)Nc1cc(n[nH]1)Cl 9efff3c913d7c82a6c370a639de79d38 [0,1,0,0,1,0|2,0,0]=4 978 B10R1.54 CC(C)Nc1ccn(n1)C a5b30ff65ff9ff1b84c75c4c9ad9d4ef [0,1,0,0,1,0|2,0,0]=4 979 B10R1.54 CC(C)Nc1cn(cn1)C f37a89307b25afe6cd397311b169c90e [0,1,0,0,1,0|2,0,0]=4 980 B10R1.54 CC(C)Nc1cnc(s1)Br dd44e6c6a48322bbdaf63b52db7a08df [0,1,0,0,1,0|2,0,0]=4 981 B10R1.54 CC(C)Nc1cnn(c1)C ca25743c9da8eb1c26c930a3f62885e7 [0,1,0,0,1,0|2,0,0]=4 982 B10R1.54 CC(C)Nc1csc(n1)Br 2b73bd439788163c78c72759a5360207 [0,1,0,0,1,0|2,0,0]=4 983 B10R1.54 CC(C)Nc1nc(c[nH]1)Br b4c6b3201b8b30dc9018e3a39ff8b124 [0,1,0,0,1,0|2,0,0]=4 984 B10R1.54 CC(C)Nc1nc(cs1)Br 9f69873932eef12da6cb8297656acf07 [0,1,0,0,1,0|2,0,0]=4 985 B10R1.54 CC(C)Nc1nc(cs1)Cl 49fc32cb4238fbf101cabb009b43efbb [0,1,0,0,1,0|2,0,0]=4 986 B10R1.54 CC(C)Nc1ncc(s1)Cl 77ea293bc313ff699c37d37dca7802f2 [0,1,0,0,1,0|2,0,0]=4 987 B10R1.54 CC(C)Oc1cc(sn1)Cl c4601e2235d8564be85bd39d62d2a804 [0,1,0,0,1,0|2,0,0]=4 988 B10R1.54 CC(C)Oc1ccc(s1)Br f84299d81806a400101a9bd6e19aec9d [0,1,0,0,1,0|2,0,0]=4 989 B10R1.54 CC(C)Oc1ccn(n1)C e9d16db7474fc77811ecb6b1f259ab87 [0,1,0,0,1,0|2,0,0]=4 990 B10R1.54 CC(C)Oc1cnn(c1)C 6e7a6bcd064fa43b0a4c0826286ff616 [0,1,0,0,1,0|2,0,0]=4 991 B10R1.54 CC(C)Oc1nc(cs1)Br 538b9e89099c28c159cbe48ccf0c6ebd [0,1,0,0,1,0|2,0,0]=4 992 B10R1.54 CC(C)On1cc(cn1)I 6e53c3adb6215d99b0b20ed15bb234b7 [0,1,0,0,1,0|2,0,0]=4 993 B10R1.54 Cc1cc(n[nH]1)NC(C)C ead29f4ffad31f8adb23ee15dbb81676 [0,1,0,0,1,0|2,0,0]=4 994 B10R1.54 Cc1cc(no1)NC(C)C 97d8cb8293e204bba8710064fc6e3cbf [0,1,0,0,1,0|2,0,0]=4 995 B10R1.54 Cc1cc(on1)NC(C)C d778120389c96c9a6e1e576487adcbf1 [0,1,0,0,1,0|2,0,0]=4 996 B10R1.54 Cc1cc(sn1)NC(C)C 74305d597b026959a6e744a5eba9543b [0,1,0,0,1,0|2,0,0]=4 997 B10R1.54 Cc1ccc(s1)NC(C)C 93bce7f187df330d71af93b5236b129c [0,1,0,0,1,0|2,0,0]=4 998 B10R1.54 Cc1cnc([nH]1)NC(C)C c2f48ff478affffc86d99c32eac814e1 [0,1,0,0,1,0|2,0,0]=4 999 B10R1.54 Cc1cnc(o1)NC(C)C 7e60d7afe3ab30d3ca96d7e5e37416d0 [0,1,0,0,1,0|2,0,0]=4 1000 B10R1.54 Cc1csc(c1)OC(C)C 373df1ff305189a72f1df4dff69c5fc9 [0,1,0,0,1,0|2,0,0]=4 1001 B10R1.54 Cc1csc(n1)NC(C)C 0b6dc34e13a21d1f67a396b31b538351 [0,1,0,0,1,0|2,0,0]=4 1002 B10R1.54 Cc1ncc(o1)NC(C)C 75e1ac28fd5ad7fc795683447e104e58 [0,1,0,0,1,0|2,0,0]=4 1003 B10R1.54 Cc1ncc(s1)NC(C)C 5c91fa230c11f7876a7f5a1e44086f4f [0,1,0,0,1,0|2,0,0]=4 1004 B10R1.64 CC(C)Nc1[nH]ncc1F b4716ae482bf11a5a24d4e3fb8f2b2b8 [0,1,0,0,1,0|2,0,0]=4 1005 B10R1.64 CC(C)Nc1c[nH]nc1Br 4a3294b83ba224e53d2eab3d7457b3c6 [0,1,0,0,1,0|2,0,0]=4 1006 B10R1.64 CC(C)Nc1c[nH]nc1Cl c5b2f796f31509cdb99caaddd84cb254 [0,1,0,0,1,0|2,0,0]=4 1007 B10R1.64 CC(C)Nc1ccnn1C 172a625a436b8493424cfc5db2d361cc [0,1,0,0,1,0|2,0,0]=4 1008 B10R1.64 CC(C)Nc1cncn1C 04a1ca52c25998c87465eb210836c969 [0,1,0,0,1,0|2,0,0]=4 1009 B10R1.64 CC(C)Nc1cscc1Br bb7e39fe3f60e7ab766827fa6589c157 [0,1,0,0,1,0|2,0,0]=4 1010 B10R1.64 CC(C)Nc1n[nH]cc1Cl a03f0e0787def0e26a31532383142bdd [0,1,0,0,1,0|2,0,0]=4 1011 B10R1.64 CC(C)Nc1n[nH]cc1I 65a2e3f94d317c5b81ab72e0f55af839 [0,1,0,0,1,0|2,0,0]=4 1012 B10R1.64 CC(C)Nc1nccn1C 1738301d2f70a1aed672ec671b05b31b [0,1,0,0,1,0|2,0,0]=4 1013 B10R1.64 CC(C)Nc1nocc1Cl 8013e9adb4b20741774b212ed10f4faa [0,1,0,0,1,0|2,0,0]=4 1014 B10R1.64 CC(C)Oc1cccn1C 9d16d688182fe387ea0342d61d906965 [0,1,0,0,1,0|1,0,1]=4 1015 B10R1.64 CC(C)Oc1ccnn1C efbf1ba99d6d6beb128365a5ee19358e [0,1,0,0,1,0|2,0,0]=4 1016 B10R1.64 Cc1[nH]ncc1OC(C)C 29edb059109686103d12522d45602260 [0,1,0,0,1,0|2,0,0]=4 1017 B10R1.64 Cc1c[nH]nc1NC(C)C 7c45d8168e95d90ca97c431c020d1fa5 [0,1,0,0,1,0|2,0,0]=4 1018 B10R1.64 Cc1c[nH]nc1OC(C)C 0e5c0597228ff1edf17f8ab72bdbde30 [0,1,0,0,1,0|2,0,0]=4 1019 B10R1.64 Cc1conc1NC(C)C a36a85dc743c4f7dbcc01d1b1f5f5f94 [0,1,0,0,1,0|2,0,0]=4 1020 B10R1.64 Cc1cscc1NC(C)C 11e8c8bc4103f1e121c35b28e2433683 [0,1,0,0,1,0|2,0,0]=4 1021 B10R1.64 Cc1n[nH]cc1NC(C)C f3553c4c8d0e93c25261b997338fe27e [0,1,0,0,1,0|2,0,0]=4 1022 B10R1.64 Cc1ncsc1NC(C)C d83ee4be5b5cd699a0352cb1a444d69f [0,1,0,0,1,0|2,0,0]=4 1023 B10R1.64 Cc1oncc1NC(C)C b55a70b0ad9db57737e9bad926ecbf0e [0,1,0,0,1,0|2,0,0]=4 1024 B10R1.64 Cc1sccc1NC(C)C 1c62e31d7906034669197c2462aece94 [0,1,0,0,1,0|2,0,0]=4 1025 B10R1.281 CC(C)(C)Nc1ccns1 353727fa54a55e5041aec8885c1fcfa8 [0,1,0,0,1,0|2,0,0]=4 1026 B10R1.281 CC(C)(C)Nc1ccoc1 4e80022f7e43d707dd110162ffc0041c [0,1,0,0,1,0|2,0,0]=4 1027 B10R1.281 CC(C)(C)Nc1cnoc1 54da198a4a50596d101ce90e0d19287f [0,1,0,0,1,0|2,0,0]=4 1028 B10R1.281 CC(C)(C)Nc1nccs1 935d300f1b1edb11b3bb58e7d6495434 [0,1,0,0,1,0|2,0,0]=4 1029 B12R1.21 C=C(C)CNc1ccc(nc1)Br 9c73a0a8c7d54f2a7e33df5834a83e0a [0,1,0,0,0,1|0,0,2]=4 1030 B12R1.21 C=C(C)CNc1ccc(nc1)C 3b729647ac4755635012616ded84642f [0,1,0,0,0,1|0,0,2]=4 1031 B12R1.21 C=C(C)CNc1ccc(nc1)Cl 7b3093f6e0eab55d02548008f243203b [0,1,0,0,0,1|0,0,2]=4 1032 B12R1.21 C=C(C)CNc1ccc(nc1)F 73591c76091737e7fcc36559aad14e72 [0,1,0,0,0,1|0,0,2]=4 1033 B12R1.21 C=C(C)CNc1ccc(nc1)I d6ae1258a9b7b1c07eaf0eb4e834758a [0,1,0,0,0,1|0,0,2]=4 1034 B12R1.21 C=C(C)COc1ccc(nc1)Br 42834c165c6127bddd47d9cd8898ca79 [0,1,0,0,0,1|0,0,2]=4 1035 B12R1.21 C=C(C)COc1ccc(nc1)C 8571450d438ea1d167291f7231d2ca53 [0,1,0,0,0,1|0,0,2]=4 1036 B12R1.21 C=C(C)COc1ccc(nc1)Cl a6fdaf95bceb59a4037de79c2994d445 [0,1,0,0,0,1|0,0,2]=4 1037 B12R1.21 C=C(C)COc1ccc(nc1)F ed271b36ec7ad17097644d9fba39506e [0,1,0,0,0,1|0,0,2]=4 1038 B12R1.21 C=C(C)COc1ccc(nc1)I 95b55267458b5e85a8de60380b802299 [0,1,0,0,0,1|0,0,2]=4 1039 B12R1.21 CC(=O)CNc1ccc(nc1)C af5cc7de8bed053b888963a847e4955b [0,1,0,0,0,1|1,0,1]=4 1040 B12R1.21 CC(=O)CNc1ccc(nc1)F 059d81fedea6ddc0c03a0c00cf186cb6 [0,1,0,0,0,1|1,0,1]=4 1041 B12R1.21 CC(=O)NCc1ccc(nc1)Br e9dbeda635f5ea81b0bda7268917134d [0,1,0,0,0,1|1,0,1]=4 1042 B12R1.21 CC(=O)NCc1ccc(nc1)C c7de52d9e18c5b5eeea94a97977c5605 [0,1,0,0,0,1|1,0,1]=4 1043 B12R1.21 CC(=O)NCc1ccc(nc1)Cl 9eb33223753c16aea396f97336de070d [0,1,0,0,0,1|1,0,1]=4 1044 B12R1.21 CC(=O)NCc1ccc(nc1)F 6b7a55dd10ce9ac95968778b4ef6141e [0,1,0,0,0,1|1,0,1]=4 1045 B12R1.21 CC(C)CNc1ccc(=O)[nH]c1 3970684279a6ee0105700d3d18cb6e83 [0,1,0,0,0,1|0,0,1]=3 1046 B12R1.21 CC(C)CNc1ccc(cc1)Br aafc6d7f6bffefff521c174b2e36cf47 [0,1,0,0,0,1|1,0,0]=3 1047 B12R1.21 CC(C)CNc1ccc(cc1)Cl b590bea18aa2be2fe9530b5825b6b83d [0,1,0,0,0,1|1,0,0]=3 1048 B12R1.21 CC(C)CNc1ccc(cc1)F f869f8ebca9e23d7a314cca58e04355a [0,1,0,0,0,1|1,0,0]=3 1049 B12R1.21 CC(C)CNc1ccc(cc1)I f5ed240cfb530eb638c88433537d6bc6 [0,1,0,0,0,1|1,0,0]=3 1050 B12R1.21 CC(C)CNc1ccc(cc1)S 5aebae70a565a4395c9f06d404e49e19 [0,1,0,0,0,1|1,0,0]=3 1051 B12R1.21 CC(C)CNc1ccc(cn1)Br bde6ddc1f63f60284fa6607640a728d9 [0,1,0,0,0,1|2,0,0]=4 1052 B12R1.21 CC(C)CNc1ccc(cn1)Cl 0ae5375a5e4c82cbd22b2ab085684d82 [0,1,0,0,0,1|2,0,0]=4 1053 B12R1.21 CC(C)CNc1ccc(cn1)F 8b43a1cc0e501ca0d0605ad14f0df209 [0,1,0,0,0,1|2,0,0]=4 1054 B12R1.21 CC(C)CNc1ccc(cn1)I 23fefd3376fbc7b4befdabe310bb0dda [0,1,0,0,0,1|2,0,0]=4 1055 B12R1.21 CC(C)CNc1ccc(nc1)Br f97d236c26c6d2f7293dba68c7c4b075 [0,1,0,0,0,1|0,0,0]=2 1056 B12R1.21 CC(C)CNc1ccc(nc1)Cl 35dd1dae0c5db16264d559782cfce889 [0,1,0,0,0,1|0,0,0]=2 1057 B12R1.21 CC(C)CNc1ccc(nc1)F 47051ae2555eee9d12ed92095481c029 [0,1,0,0,0,1|0,0,0]=2 1058 B12R1.21 CC(C)CNc1ccc(nc1)I 7597ad1c53bebc44f0a198afe4e3c158 [0,1,0,0,0,1|0,0,0]=2 1059 B12R1.21 CC(C)CNc1ccc(nn1)Br 71d4b9d60307ddee8d072332bb2aa953 [0,1,0,0,0,1|1,0,0]=3 1060 B12R1.21 CC(C)CNc1ccc(nn1)Cl 759852d1e6ccb4e13f8bc7c4ce058a3d [0,1,0,0,0,1|1,0,0]=3 1061 B12R1.21 CC(C)CNc1ccc(nn1)F 903d6c8bbcad05a64ea9083188cfbde6 [0,1,0,0,0,1|1,0,0]=3 1062 B12R1.21 CC(C)CNc1ccc(nn1)I 9f20ca964503267e732a79392bb16af5 [0,1,0,0,0,1|1,0,0]=3 1063 B12R1.21 CC(C)CNc1cnc(=O)[nH]c1 20b6c307443c5e0a9ec8415e9caa8120 [0,1,0,0,0,1|1,0,0]=3 1064 B12R1.21 CC(C)CNc1cnc(cn1)Br 786fa56ac56c18c17ef7ff60ce5620dd [0,1,0,0,0,1|1,0,0]=3 1065 B12R1.21 CC(C)CNc1cnc(cn1)Cl 8f8b918edbaca811d4c134389bca115b [0,1,0,0,0,1|1,0,0]=3 1066 B12R1.21 CC(C)CNc1cnc(cn1)I 5dfb3a45e9a521d1c7e6b60d37ac18a6 [0,1,0,0,0,1|1,0,0]=3 1067 B12R1.21 CC(C)CNc1cnc(nc1)Br 0933d2559979e9561e76119754bc2f31 [0,1,0,0,0,1|1,0,0]=3 1068 B12R1.21 CC(C)CNc1cnc(nc1)Cl 53accb9e7dee0113feeec8ee14cda620 [0,1,0,0,0,1|1,0,0]=3 1069 B12R1.21 CC(C)CNc1cnc(nc1)I 4d493befb89bfe841696de6f26a69873 [0,1,0,0,0,1|1,0,0]=3 1070 B12R1.21 CC(C)CNc1ncc(nn1)Br c0fde167026aaea3dd2200e141453c41 [0,1,0,0,0,1|2,0,0]=4 1071 B12R1.21 CC(C)COc1ccc(cc1)Br 688e322571e772c33ef9f7f1b70011c4 [0,1,0,0,0,1|1,0,0]=3 1072 B12R1.21 CC(C)COc1ccc(cc1)Cl f021a9169c3057630072da40a25929d0 [0,1,0,0,0,1|1,0,0]=3 1073 B12R1.21 CC(C)COc1ccc(cc1)F 041d5d9f7bc26d03338ae74cc974acbe [0,1,0,0,0,1|1,0,0]=3 1074 B12R1.21 CC(C)COc1ccc(cc1)I c8700cb8e6ceb84be023f81a6b63abe0 [0,1,0,0,0,1|1,0,0]=3 1075 B12R1.21 CC(C)COc1ccc(cc1)S 93dc663c86ffdc9dd467a4fa1c50d8c7 [0,1,0,0,0,1|1,0,0]=3 1076 B12R1.21 CC(C)COc1ccc(cn1)Cl 7644f0b62ceae011d9bc3001c519b209 [0,1,0,0,0,1|2,0,0]=4 1077 B12R1.21 CC(C)COc1ccc(cn1)F d8047addd92359ec92c2a0f4a9db82e5 [0,1,0,0,0,1|2,0,0]=4 1078 B12R1.21 CC(C)COc1ccc(cn1)I 13cb687e6b43dbc8c66a5b339f34fae3 [0,1,0,0,0,1|2,0,0]=4 1079 B12R1.21 CC(C)COc1ccc(nc1)Br 6cab0d3607c8822f4e69470f0506e296 [0,1,0,0,0,1|0,0,0]=2 1080 B12R1.21 CC(C)COc1ccc(nc1)Cl 10704f4ae7612096859276a99ef4643b [0,1,0,0,0,1|0,0,0]=2 1081 B12R1.21 CC(C)COc1ccc(nc1)F fe25916c3c5d8a0c73f1742e4890c4b4 [0,1,0,0,0,1|0,0,0]=2 1082 B12R1.21 CC(C)COc1ccc(nc1)I f8c7ca358dc5afbf7199c955088be042 [0,1,0,0,0,1|0,0,0]=2 1083 B12R1.21 CC(C)COc1ccc(nn1)Br 799c729e80d47f7d3d32d1afe87f05c0 [0,1,0,0,0,1|1,0,0]=3 1084 B12R1.21 CC(C)COc1ccc(nn1)Cl 3e4728701f30e1aa83e4a90da81c6b1c [0,1,0,0,0,1|1,0,0]=3 1085 B12R1.21 CC(C)COc1cnc(cn1)Br e92ebf9486df5d151f1c7be494efd94e [0,1,0,0,0,1|1,0,0]=3 1086 B12R1.21 CC(C)COc1cnc(cn1)Cl a85fadd95373c67946c552f45276c3e7 [0,1,0,0,0,1|1,0,0]=3 1087 B12R1.21 CC(C)COc1cnc(cn1)I 4afc5550dc517fb69cb3d37c65622e1d [0,1,0,0,0,1|1,0,0]=3 1088 B12R1.21 CC(C)COc1cnc(nc1)Br 7c991ffe2f11bde69f2b7d8fd4c1783c [0,1,0,0,0,1|1,0,0]=3 1089 B12R1.21 CC(C)COc1cnc(nc1)Cl 8ebe94d46c35ad1fb48a306897b558a1 [0,1,0,0,0,1|1,0,0]=3 1090 B12R1.21 CC(C)NCc1ccc(=O)[nH]c1 f5fff734176dc5499671c9909abad5b3 [0,1,0,0,0,1|0,0,1]=3 1091 B12R1.21 CC(C)NCc1ccc(cc1)Br 37c09d76c90c7ae49ec6a65ce3a6a041 [0,1,0,0,0,1|1,0,0]=3 1092 B12R1.21 CC(C)NCc1ccc(cc1)Cl 19728114897127fa755988490a2025d5 [0,1,0,0,0,1|1,0,0]=3 1093 B12R1.21 CC(C)NCc1ccc(cc1)F 76a0754a7751d3d66ff80ab158c9f2b0 [0,1,0,0,0,1|1,0,0]=3 1094 B12R1.21 CC(C)NCc1ccc(cc1)I 49ceb1852914812d45311ac4b38b1f31 [0,1,0,0,0,1|1,0,0]=3 1095 B12R1.21 CC(C)NCc1ccc(cn1)Cl c4f69fa6d84754b6825b9b1c6de7fed8 [0,1,0,0,0,1|2,0,0]=4 1096 B12R1.21 CC(C)NCc1ccc(cn1)F c4865c3c8142a2d416d4be6ac231c6e4 [0,1,0,0,0,1|2,0,0]=4 1097 B12R1.21 CC(C)NCc1ccc(nc1)Br 66c358003a2aeaecd114c0fca0aabd06 [0,1,0,0,0,1|0,0,0]=2 1098 B12R1.21 CC(C)NCc1ccc(nc1)Cl b141e36d256d8ba46ce47c529972ed91 [0,1,0,0,0,1|0,0,0]=2 1099 B12R1.21 CC(C)NCc1ccc(nc1)F c68d5f2c5bc0cadc3f885e96b8ce170e [0,1,0,0,0,1|0,0,0]=2 1100 B12R1.21 CC(C)NCc1ccc(nn1)Cl 61cebff1ea99f09b41702993f7dabfd6 [0,1,0,0,0,1|1,0,0]=3 1101 B12R1.21 CC(C)NCc1cnc(cn1)Cl 50d27bdd6b7849aceb40b85497d36e1e [0,1,0,0,0,1|1,0,0]=3 1102 B12R1.21 CC(C)NCc1cnc(nc1)Cl 332059fa3a76fd39c87a0f33e42c969c [0,1,0,0,0,1|1,0,0]=3 1103 B12R1.21 CC(C)OCc1cc[n+](cc1)[O-] ad48718861e57a0359d9b9f53b66d92f [0,1,0,0,0,1|2,0,0]=4 1104 B12R1.21 CC(C)OCc1ccc(cc1)Br bb4176ce0b9ad4d7fb8568832a43e29a [0,1,0,0,0,1|1,0,0]=3 1105 B12R1.21 CC(C)OCc1ccc(cc1)Cl abfc8ca1cd1171daf8ae63ae6bec02b0 [0,1,0,0,0,1|1,0,0]=3 1106 B12R1.21 CC(C)OCc1ccc(cc1)F ac9a18f3d487a18e76f77222965a393f [0,1,0,0,0,1|1,0,0]=3 1107 B12R1.21 CC(C)OCc1ccc(cc1)I a45cec946311a49c5890d06f9a04aef0 [0,1,0,0,0,1|1,0,0]=3 1108 B12R1.21 CC(C)OCc1ccc(cc1)S 8bebaeb2cc5402024d06e9416cbf6988 [0,1,0,0,0,1|1,0,0]=3 1109 B12R1.21 CC(C)OCc1ccc(cn1)Cl e6b6d6a6b704e48f9bad6d91e44552d4 [0,1,0,0,0,1|2,0,0]=4 1110 B12R1.21 CC(C)OCc1ccc(cn1)F cb42a6ce37282edad9aea9a5be279e31 [0,1,0,0,0,1|2,0,0]=4 1111 B12R1.21 CC(C)OCc1ccc(cn1)I d91e2bc09c51ae21ccaab7c4ab76b331 [0,1,0,0,0,1|2,0,0]=4 1112 B12R1.21 CC(C)OCc1ccc(nc1)Br af871ec452ce610ac0391d6007c2df16 [0,1,0,0,0,1|0,0,0]=2 1113 B12R1.21 CC(C)OCc1ccc(nc1)Cl 410f08f8c81d19a105b5a2a9721c4558 [0,1,0,0,0,1|0,0,0]=2 1114 B12R1.21 CC(C)OCc1ccc(nc1)F ba373ea2643bfa56519dd6f4851e18e6 [0,1,0,0,0,1|0,0,0]=2 1115 B12R1.21 CC(C)OCc1ccc(nn1)Cl 1325213318013ac65d7a1be01e77aa3e [0,1,0,0,0,1|1,0,0]=3 1116 B12R1.21 CC(C)OCc1cnc(cn1)Cl 9ac6314172687d4058364b44cd8d251a [0,1,0,0,0,1|1,0,0]=3 1117 B12R1.21 CC(C)OCc1cnc(nc1)Br 41f76f675ecdd4f2d209dff07824cbb1 [0,1,0,0,0,1|1,0,0]=3 1118 B12R1.21 CC(C)OCc1cnc(nc1)Cl 9b9065acb0eb0b7066838dccf8c7e37e [0,1,0,0,0,1|1,0,0]=3 1119 B12R1.21 CC(O)CNc1ccc(=O)[nH]c1 fe0ef9f5074b82f8f95ef30bad6eaaec [0,1,0,0,0,1|1,0,1]=4 1120 B12R1.21 CC(O)CNc1ccc(cc1)Br 6cc2dd3906a998fe7a5d4e2a8d208d21 [0,1,0,0,0,1|2,0,0]=4 1121 B12R1.21 CC(O)CNc1ccc(cc1)Cl 30612ac8d45eff6171f59f16b2492f67 [0,1,0,0,0,1|2,0,0]=4 1122 B12R1.21 CC(O)CNc1ccc(cc1)F 44764ce23148993885c02e8cea63902c [0,1,0,0,0,1|2,0,0]=4 1123 B12R1.21 CC(O)CNc1ccc(cc1)I 8fb5974b6715edad9e8863320d6bae04 [0,1,0,0,0,1|2,0,0]=4 1124 B12R1.21 CC(O)CNc1ccc(cc1)S 6ef936aebb7976c5c92d176540ed67f0 [0,1,0,0,0,1|2,0,0]=4 1125 B12R1.21 CC(O)CNc1ccc(nc1)Br a542c1d9e7cf0e130887ca34de5abc7f [0,1,0,0,0,1|1,0,0]=3 1126 B12R1.21 CC(O)CNc1ccc(nc1)Cl 2a1cbdbd92bca6158a94cb2d7caacea7 [0,1,0,0,0,1|1,0,0]=3 1127 B12R1.21 CC(O)CNc1ccc(nc1)F dab207a7d149400a047fe59c6dd352b8 [0,1,0,0,0,1|1,0,0]=3 1128 B12R1.21 CC(O)CNc1ccc(nc1)I ed5e8982e5c801e62f5181b175b31078 [0,1,0,0,0,1|1,0,0]=3 1129 B12R1.21 CC(O)CNc1ccc(nn1)Br 586f2fe0961d8185422997160e94b9f6 [0,1,0,0,0,1|2,0,0]=4 1130 B12R1.21 CC(O)CNc1ccc(nn1)Cl edabaeddbd0fb712f6c063614ab5b671 [0,1,0,0,0,1|2,0,0]=4 1131 B12R1.21 CC(O)CNc1ccc(nn1)F 88dab1a5ad7268069190af9fd1a1ca1a [0,1,0,0,0,1|2,0,0]=4 1132 B12R1.21 CC(O)CNc1ccc(nn1)I f77600c9a3df2886c46799568bcaeb2a [0,1,0,0,0,1|2,0,0]=4 1133 B12R1.21 CC(O)CNc1cnc(=O)[nH]c1 d3b2ef21be0f330a52a5008a12c6bd45 [0,1,0,0,0,1|2,0,0]=4 1134 B12R1.21 CC(O)CNc1cnc(cn1)Br 51025a49aafe58a598530ae7d929f721 [0,1,0,0,0,1|2,0,0]=4 1135 B12R1.21 CC(O)CNc1cnc(cn1)Cl 2abdfa449c14107463c52a053b1f5793 [0,1,0,0,0,1|2,0,0]=4 1136 B12R1.21 CC(O)CNc1cnc(cn1)I cfa39ae31309ddd5fab610ca39761e5b [0,1,0,0,0,1|2,0,0]=4 1137 B12R1.21 CC(O)CNc1cnc(nc1)Br 2a9ede44affcccd4f98e723eb2edaced [0,1,0,0,0,1|2,0,0]=4 1138 B12R1.21 CC(O)CNc1cnc(nc1)Cl 0fb87fed0b212934033308ca3f286a78 [0,1,0,0,0,1|2,0,0]=4 1139 B12R1.21 CC(O)CNc1cnc(nc1)I eb1839395d0c3c2096ac834d3aa08400 [0,1,0,0,0,1|2,0,0]=4 1140 B12R1.21 CN(C)CNc1ccc(=O)[nH]c1 d866ec0e55ec42863246f6dc91fb1b27 [0,1,0,0,0,1|1,0,1]=4 1141 B12R1.21 CN(C)CNc1ccc(cc1)Br d70bd3e201d4e3984a2cbe371116b356 [0,1,0,0,0,1|2,0,0]=4 1142 B12R1.21 CN(C)CNc1ccc(cc1)Cl 84d82794d22fd2615e84d614fa4d76e4 [0,1,0,0,0,1|2,0,0]=4 1143 B12R1.21 CN(C)CNc1ccc(cc1)F c53489144a229a82a42fe108426a5611 [0,1,0,0,0,1|2,0,0]=4 1144 B12R1.21 CN(C)CNc1ccc(cc1)I 9ce69571ab45326b30512a54a577d9b1 [0,1,0,0,0,1|2,0,0]=4 1145 B12R1.21 CN(C)CNc1ccc(cc1)S 5aa5c6e46c584a58cd79277c7decaaf0 [0,1,0,0,0,1|2,0,0]=4 1146 B12R1.21 CN(C)CNc1ccc(nc1)Br e80f449570a977513cdb24a195c7eceb [0,1,0,0,0,1|1,0,0]=3 1147 B12R1.21 CN(C)CNc1ccc(nc1)Cl 6e5cc6c49da0d2d4b074c0845085349c [0,1,0,0,0,1|1,0,0]=3 1148 B12R1.21 CN(C)CNc1ccc(nc1)F bca8942389d8eca425c4be89291d69a8 [0,1,0,0,0,1|1,0,0]=3 1149 B12R1.21 CN(C)CNc1ccc(nc1)I 4b8d40d70f50c470035ee4b97ad43a27 [0,1,0,0,0,1|1,0,0]=3 1150 B12R1.21 CN(C)CNc1ccc(nn1)Br a8e548dc650717cbf8ef3fdb7e815316 [0,1,0,0,0,1|2,0,0]=4 1151 B12R1.21 CN(C)CNc1ccc(nn1)Cl cb76bfd00e2d406e0f904c9f78a7b1fe [0,1,0,0,0,1|2,0,0]=4 1152 B12R1.21 CN(C)CNc1ccc(nn1)F d98ff55ea363d0981bc007bf7819da4d [0,1,0,0,0,1|2,0,0]=4 1153 B12R1.21 CN(C)CNc1ccc(nn1)I 559a892589b7f317e2fd983ee7829144 [0,1,0,0,0,1|2,0,0]=4 1154 B12R1.21 CN(C)CNc1cnc(cn1)Br e72066dedccfb140afc7fa7f50a83f60 [0,1,0,0,0,1|2,0,0]=4 1155 B12R1.21 CN(C)CNc1cnc(cn1)Cl 05ec1f351f91e01206e2d9de9e55a300 [0,1,0,0,0,1|2,0,0]=4 1156 B12R1.21 CN(C)CNc1cnc(cn1)I 89aeb5845a96fc2da089bd90782fcd95 [0,1,0,0,0,1|2,0,0]=4 1157 B12R1.21 CN(C)CNc1cnc(nc1)Br 3457e1836b9a7753e3f088dd7b2e0c4e [0,1,0,0,0,1|2,0,0]=4 1158 B12R1.21 CN(C)CNc1cnc(nc1)Cl 10708cd8c6d0caf5c12d7222e45ed1f4 [0,1,0,0,0,1|2,0,0]=4 1159 B12R1.21 CN(C)CNc1cnc(nc1)I a1bd7701a8dee9074f7039d48968a14a [0,1,0,0,0,1|2,0,0]=4 1160 B12R1.21 CN(C)COc1ccc(cc1)Br 1ae60d05f401b4677bf02579aec9f4e3 [0,1,0,0,0,1|2,0,0]=4 1161 B12R1.21 CN(C)COc1ccc(cc1)Cl 31a0679c78f3b12cc66bbe20f49b9a4e [0,1,0,0,0,1|2,0,0]=4 1162 B12R1.21 CN(C)COc1ccc(cc1)F 47f9c488aaff7ce417b7673dfdc64bd4 [0,1,0,0,0,1|2,0,0]=4 1163 B12R1.21 CN(C)COc1ccc(cc1)I 2c421eec61bc06e369712388216897f9 [0,1,0,0,0,1|2,0,0]=4 1164 B12R1.21 CN(C)COc1ccc(cc1)S 90858c38fd8e55792e84d69d8884b1c6 [0,1,0,0,0,1|2,0,0]=4 1165 B12R1.21 CN(C)COc1ccc(nc1)Br ee50b54e1423226cdbfc5eb345fd49c4 [0,1,0,0,0,1|1,0,0]=3 1166 B12R1.21 CN(C)COc1ccc(nc1)Cl 0903804184e163bc963a96eb0926e663 [0,1,0,0,0,1|1,0,0]=3 1167 B12R1.21 CN(C)COc1ccc(nc1)F 080f9ec01f2c76065f561622b94ed66f [0,1,0,0,0,1|1,0,0]=3 1168 B12R1.21 CN(C)COc1ccc(nc1)I fe8966e3c1e3fba2f39e1e306de86dff [0,1,0,0,0,1|1,0,0]=3 1169 B12R1.21 CN(C)COc1ccc(nn1)Br 7f6d26a83756ea65979fac1407990cc0 [0,1,0,0,0,1|2,0,0]=4 1170 B12R1.21 CN(C)COc1ccc(nn1)Cl c67c8990d1d4f999742a586d6900db52 [0,1,0,0,0,1|2,0,0]=4 1171 B12R1.21 CN(C)COc1cnc(cn1)Br de00a9b7d18d5143d8371c3dfa63a4a6 [0,1,0,0,0,1|2,0,0]=4 1172 B12R1.21 CN(C)COc1cnc(cn1)Cl f88676f2238d968501475108cd4c43a2 [0,1,0,0,0,1|2,0,0]=4 1173 B12R1.21 CN(C)COc1cnc(cn1)I dcfed3e9582de601e18a9128e7baac19 [0,1,0,0,0,1|2,0,0]=4 1174 B12R1.21 CN(C)COc1cnc(nc1)Br 3c2e3433eae6e547488d29b75917d5e5 [0,1,0,0,0,1|2,0,0]=4 1175 B12R1.21 CN(C)COc1cnc(nc1)Cl 8afea71bbf7e041fb0732e9427f7ddcb [0,1,0,0,0,1|2,0,0]=4 1176 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Br 2ad4df23c69dfa44e26a216951079c17 [0,1,0,0,0,1|2,0,0]=4 1177 B12R1.21 C[C@@H](O)CNc1ccc(cc1)F d13032a00d782f9fd58bde9b7b7e5b40 [0,1,0,0,0,1|2,0,0]=4 1178 B12R1.21 C[C@@H](O)CNc1ccc(cc1)I fcafc0398c9f6631b1e264180519d9a5 [0,1,0,0,0,1|2,0,0]=4 1179 B12R1.21 C[C@@H](O)CNc1ccc(cc1)S c5036038618daf9d110f2837b38cc7f0 [0,1,0,0,0,1|2,0,0]=4 1180 B12R1.21 C[C@@H](O)CNc1ccc(nc1)Cl 0b072a983c28bdb115b4e0bd834036bd [0,1,0,0,0,1|1,0,0]=3 1181 B12R1.21 C[C@@H](O)CNc1ccc(nc1)F b382e47334999ee55f54bd8309b42c71 [0,1,0,0,0,1|1,0,0]=3 1182 B12R1.21 C[C@@H](O)CNc1ccc(nn1)Br ba31c84ceed4cf6fceeb521bdb3f8e03 [0,1,0,0,0,1|2,0,0]=4 1183 B12R1.21 C[C@@H](O)CNc1ccc(nn1)F 745008f42c8807e75983fedffc366bd7 [0,1,0,0,0,1|2,0,0]=4 1184 B12R1.21 C[C@@H](O)CNc1ccc(nn1)I 525d816b6f5ec382eea5d1032b0bf906 [0,1,0,0,0,1|2,0,0]=4 1185 B12R1.21 C[C@@H](O)CNc1cnc(nc1)Cl b3b26e216cab9ed4e8987cdb9d970b8e [0,1,0,0,0,1|2,0,0]=4 1186 B12R1.21 C[C@H](O)CNc1ccc(=O)[nH]c1 3af6b84894ad5bd91e3770aa97cb289c [0,1,0,0,0,1|1,0,1]=4 1187 B12R1.21 C[C@H](O)CNc1ccc(cc1)Br dfc814dc76baf36262caaec8d25f4215 [0,1,0,0,0,1|2,0,0]=4 1188 B12R1.21 C[C@H](O)CNc1ccc(cc1)Cl 8fb7f0b55d9fe9f1cdafd45ef42c2de4 [0,1,0,0,0,1|2,0,0]=4 1189 B12R1.21 C[C@H](O)CNc1ccc(cc1)F 4385cb997d0b526c90619c1645b8b1ad [0,1,0,0,0,1|2,0,0]=4 1190 B12R1.21 C[C@H](O)CNc1ccc(cc1)I 7222c72737ac92de3960850b939145d2 [0,1,0,0,0,1|2,0,0]=4 1191 B12R1.21 C[C@H](O)CNc1ccc(cc1)S 638aabe1512824e4dc38e2389b85f596 [0,1,0,0,0,1|2,0,0]=4 1192 B12R1.21 C[C@H](O)CNc1ccc(nc1)Br 9c48efee9c9cff6d5a96217167e77ce3 [0,1,0,0,0,1|1,0,0]=3 1193 B12R1.21 C[C@H](O)CNc1ccc(nc1)Cl e4468ea427969982ddeeb854ca54009a [0,1,0,0,0,1|1,0,0]=3 1194 B12R1.21 C[C@H](O)CNc1ccc(nc1)F a8cb8979fd8f15707d9df65901983e8d [0,1,0,0,0,1|1,0,0]=3 1195 B12R1.21 C[C@H](O)CNc1ccc(nc1)I d890ed11396f2cae41a408b951219b57 [0,1,0,0,0,1|1,0,0]=3 1196 B12R1.21 C[C@H](O)CNc1ccc(nn1)Br b3c8a78413d52d41f729656da28364ca [0,1,0,0,0,1|2,0,0]=4 1197 B12R1.21 C[C@H](O)CNc1ccc(nn1)Cl 91f1a141d7161749c729eb312e06f7c5 [0,1,0,0,0,1|2,0,0]=4 1198 B12R1.21 C[C@H](O)CNc1ccc(nn1)F 0b055e081d93599a27805dd351d4d8cc [0,1,0,0,0,1|2,0,0]=4 1199 B12R1.21 C[C@H](O)CNc1ccc(nn1)I c8d7fb2dd5211b68660e13415dee2ad5 [0,1,0,0,0,1|2,0,0]=4 1200 B12R1.21 C[C@H](O)CNc1cnc(=O)[nH]c1 1678fbb97d45a12c7b16de36186f0ab2 [0,1,0,0,0,1|2,0,0]=4 1201 B12R1.21 C[C@H](O)CNc1cnc(cn1)Br 4662bea4670ab2397559aadc8dddb0ff [0,1,0,0,0,1|2,0,0]=4 1202 B12R1.21 C[C@H](O)CNc1cnc(cn1)Cl 1a915ee9a47c0dcbcfcbc9f6ece66da2 [0,1,0,0,0,1|2,0,0]=4 1203 B12R1.21 C[C@H](O)CNc1cnc(cn1)I c9e4835e94db2f5a60f06cabb8d0f951 [0,1,0,0,0,1|2,0,0]=4 1204 B12R1.21 C[C@H](O)CNc1cnc(nc1)Br df538a4d64271ef3f42260d6d907f743 [0,1,0,0,0,1|2,0,0]=4 1205 B12R1.21 C[C@H](O)CNc1cnc(nc1)Cl 9f15ee61a730e4c5194de5c11856f32c [0,1,0,0,0,1|2,0,0]=4 1206 B12R1.21 C[C@H](O)CNc1cnc(nc1)I 8e8bb445fc94170f9c8f5c32abcb7089 [0,1,0,0,0,1|2,0,0]=4 1207 B12R1.21 Cc1ccc(cc1)CNC(C)C 9f3293af5f5347150ac2434f1c0f5ea3 [0,1,0,0,0,1|1,0,0]=3 1208 B12R1.21 Cc1ccc(cc1)COC(C)C 7eda3a9e7a3c4601d0edf3097f1c1fb1 [0,1,0,0,0,1|1,0,0]=3 1209 B12R1.21 Cc1ccc(cc1)NCC(C)C d33fe3d6c1e672a348e9fedb377a9185 [0,1,0,0,0,1|1,0,0]=3 1210 B12R1.21 Cc1ccc(cc1)NCC(C)O 8379462492ffae9a9aea5a1dcd1f96eb [0,1,0,0,0,1|2,0,0]=4 1211 B12R1.21 Cc1ccc(cc1)NCN(C)C f410d4238a7fc65021317765c852db2f [0,1,0,0,0,1|2,0,0]=4 1212 B12R1.21 Cc1ccc(cc1)NC[C@@H](C)O a5239ddc3731748474623fb5c2811c3d [0,1,0,0,0,1|2,0,0]=4 1213 B12R1.21 Cc1ccc(cc1)NC[C@H](C)O 07456d37e9494f0c908a5c4ac8161df3 [0,1,0,0,0,1|2,0,0]=4 1214 B12R1.21 Cc1ccc(cc1)OCC(C)C c1aa096b3782800b4571efa5c0f498bc [0,1,0,0,0,1|1,0,0]=3 1215 B12R1.21 Cc1ccc(cc1)OCN(C)C 8df4da1e8ff5f1a2a333a699e01425b0 [0,1,0,0,0,1|2,0,0]=4 1216 B12R1.21 Cc1ccc(cn1)CNC(C)C dcca654450af647880d19bcbcad782d0 [0,1,0,0,0,1|0,0,0]=2 1217 B12R1.21 Cc1ccc(cn1)COC(C)C c818a7f0551a9b355b44729de8a8ae60 [0,1,0,0,0,1|0,0,0]=2 1218 B12R1.21 Cc1ccc(cn1)NCC(C)C 4aba7b7e95dd3d9152b31c769536eac4 [0,1,0,0,0,1|0,0,0]=2 1219 B12R1.21 Cc1ccc(cn1)NCC(C)O f2810c201523a66605acea892064dd67 [0,1,0,0,0,1|1,0,0]=3 1220 B12R1.21 Cc1ccc(cn1)NCC(F)F 7bf14d1c06689f60ce4f4dd6b2f95a23 [0,1,0,0,0,1|2,0,0]=4 1221 B12R1.21 Cc1ccc(cn1)NCN(C)C 2bcdc96b8cd73bdd8f9a377c0073585e [0,1,0,0,0,1|1,0,0]=3 1222 B12R1.21 Cc1ccc(cn1)NC[C@H](C)O ece7c29ab5bb61a6fc85f34a024e2877 [0,1,0,0,0,1|1,0,0]=3 1223 B12R1.21 Cc1ccc(cn1)OCC(C)C 69c2bcf05b8548d6cd0c9b6f80a2281a [0,1,0,0,0,1|0,0,0]=2 1224 B12R1.21 Cc1ccc(cn1)OCC(F)F fe6400860c02f3a07b7733e7f056d257 [0,1,0,0,0,1|2,0,0]=4 1225 B12R1.21 Cc1ccc(cn1)OCN(C)C aaf2a23228a647542036204ee141fcd3 [0,1,0,0,0,1|1,0,0]=3 1226 B12R1.21 Cc1ccc(nc1)CNC(C)C 1873ba9dced7d99c6e146a54f65349ff [0,1,0,0,0,1|2,0,0]=4 1227 B12R1.21 Cc1ccc(nc1)COC(C)C 268c71dd25830b86e2dc9d4896798456 [0,1,0,0,0,1|2,0,0]=4 1228 B12R1.21 Cc1ccc(nc1)NCC(C)C b0a45bd99f228701345f0b0569d4055c [0,1,0,0,0,1|2,0,0]=4 1229 B12R1.21 Cc1ccc(nc1)OCC(C)C 3690188a26d66aaddf7d44e6d0ccd16a [0,1,0,0,0,1|2,0,0]=4 1230 B12R1.21 Cc1ccc(nn1)CNC(C)C 321370b256caf366dadc3d338d91b1c7 [0,1,0,0,0,1|1,0,0]=3 1231 B12R1.21 Cc1ccc(nn1)COC(C)C 8b493afbef8c2102fe84accacf26686a [0,1,0,0,0,1|1,0,0]=3 1232 B12R1.21 Cc1ccc(nn1)NCC(C)C 8dee1a05cbd61fe013e731897888fa3d [0,1,0,0,0,1|1,0,0]=3 1233 B12R1.21 Cc1ccc(nn1)NCC(C)O 8edbf5597162a7b21ef866c17baca375 [0,1,0,0,0,1|2,0,0]=4 1234 B12R1.21 Cc1ccc(nn1)NCN(C)C 4cebfd876150633698ccace49646ea50 [0,1,0,0,0,1|2,0,0]=4 1235 B12R1.21 Cc1ccc(nn1)NC[C@@H](C)O b52a906c547c3d90ae483e437ee26c46 [0,1,0,0,0,1|2,0,0]=4 1236 B12R1.21 Cc1ccc(nn1)NC[C@H](C)O ab1ef6848ae542f9e5fb1d1de8fc1e3c [0,1,0,0,0,1|2,0,0]=4 1237 B12R1.21 Cc1ccc(nn1)OCC(C)C 6da9de78424c17e7a3e462263fa4b283 [0,1,0,0,0,1|1,0,0]=3 1238 B12R1.21 Cc1ccc(nn1)OCN(C)C f664b8fe315d931efdef9e17897b2900 [0,1,0,0,0,1|2,0,0]=4 1239 B12R1.21 Cc1cnc(cn1)CNC(C)C ccca1b65d279b844db896923386ce7b2 [0,1,0,0,0,1|1,0,0]=3 1240 B12R1.21 Cc1cnc(cn1)NCC(C)C 0febfa82e01feed731d1f72b471f6762 [0,1,0,0,0,1|1,0,0]=3 1241 B12R1.21 Cc1cnc(cn1)NCC(C)O 8618f6965d727cdcfe628a18be90efe0 [0,1,0,0,0,1|2,0,0]=4 1242 B12R1.21 Cc1cnc(cn1)NCN(C)C 407728238c32770c25c89fd4c51f1050 [0,1,0,0,0,1|2,0,0]=4 1243 B12R1.21 Cc1cnc(cn1)NC[C@H](C)O dbd6a6042d91e71d77707bdf7b65b5dd [0,1,0,0,0,1|2,0,0]=4 1244 B12R1.21 Cc1cnc(cn1)OCC(C)C 77b6a8c369b2a96f1b584d8f2a0088fd [0,1,0,0,0,1|1,0,0]=3 1245 B12R1.21 Cc1cnc(cn1)OCN(C)C d40d1618bdc917c2e20bcd6039b03a1b [0,1,0,0,0,1|2,0,0]=4 1246 B12R1.21 Cc1ncc(cn1)CNC(C)C 8049992a2fb854e513d85ce333b8cd10 [0,1,0,0,0,1|1,0,0]=3 1247 B12R1.21 Cc1ncc(cn1)COC(C)C 0c14be26c317ed9fbeb266f498a0a9f7 [0,1,0,0,0,1|1,0,0]=3 1248 B12R1.21 Cc1ncc(cn1)NCC(C)C 63c48a71b94c7507fbc426a2daad35cb [0,1,0,0,0,1|1,0,0]=3 1249 B12R1.21 Cc1ncc(cn1)NCC(C)O c0fd457c51f7903c3c0e1abcbb73a5ba [0,1,0,0,0,1|2,0,0]=4 1250 B12R1.21 Cc1ncc(cn1)NCN(C)C ea22f32cc3b5c0d88a8a8ce3269c4857 [0,1,0,0,0,1|2,0,0]=4 1251 B12R1.21 Cc1ncc(cn1)NC[C@H](C)O 50a3b9bfc4dbb33cf094bdb62dbba3c7 [0,1,0,0,0,1|2,0,0]=4 1252 B12R1.21 Cc1ncc(cn1)OCC(C)C 883f596fb70812bdba37a867e595bbe2 [0,1,0,0,0,1|1,0,0]=3 1253 B12R1.21 Cc1ncc(cn1)OCN(C)C 2a0a873902f14c925fc57d0daa3ab56e [0,1,0,0,0,1|2,0,0]=4 1254 B12R1.21 FC(F)CNc1ccc(nc1)Br 902aacef85a259fb88e4e4ba6e504992 [0,1,0,0,0,1|2,0,0]=4 1255 B12R1.21 FC(F)CNc1ccc(nc1)Cl 6e1df7c0598d1a6dcfe04a6ad576584a [0,1,0,0,0,1|2,0,0]=4 1256 B12R1.21 FC(F)CNc1ccc(nc1)I 91aa4a6ff703f7ba8686becaa58256d6 [0,1,0,0,0,1|2,0,0]=4 1257 B12R1.21 FC(F)COc1ccc(nc1)Br fa336beff9238b1685ef5021fa03c6d1 [0,1,0,0,0,1|2,0,0]=4 1258 B12R1.21 FC(F)COc1ccc(nc1)Cl 38fa37598e660aac7fe7f20f26aad91d [0,1,0,0,0,1|2,0,0]=4 1259 B12R1.21 FC(F)COc1ccc(nc1)I de26cf4fec3be85c87dd0cd3dae14d3f [0,1,0,0,0,1|2,0,0]=4 1260 B12R1.21 Fc1ccc(cn1)NCC(F)F dcd0f8b66a73ecb494f39dbf8e3ed2a4 [0,1,0,0,0,1|2,0,0]=4 1261 B12R1.21 Fc1ccc(cn1)OCC(F)F d9485b9f8a9fb76857d7b1ca96cc2e4c [0,1,0,0,0,1|2,0,0]=4 1262 B12R1.27 BrCC(Br)CNc1ccccc1 e7e12b5e4c30a5d2720e1014017ec37c [0,1,0,0,0,1|2,0,0]=4 1263 B12R1.27 BrCC(Br)CNc1cccnc1 2c59232d0724c99794ed52d831828438 [0,1,0,0,0,1|1,0,0]=3 1264 B12R1.27 BrCC(Br)CNc1cccnn1 056ad6b7cf3fc14ad663c6de04924ee3 [0,1,0,0,0,1|2,0,0]=4 1265 B12R1.27 BrCC(Br)CNc1cnccn1 1f184251eec548e9e3933b2f4153f491 [0,1,0,0,0,1|2,0,0]=4 1266 B12R1.27 C#CC(C)NCc1ccccc1 0c823c8410acc72523ada4697880703b [0,1,0,0,0,1|1,0,1]=4 1267 B12R1.27 C#CC(C)NCc1cccnc1 23b4a60f70f0a6facc411dde8b81b065 [0,1,0,0,0,1|0,0,1]=3 1268 B12R1.27 C#CC(C)NCc1cccnn1 6e0a8ee4768975e6ae3857823a13fce8 [0,1,0,0,0,1|1,0,1]=4 1269 B12R1.27 C#CC(C)NCc1ccnnc1 524f2a9afa7eff82c57fd01a51ee63e1 [0,1,0,0,0,1|1,0,1]=4 1270 B12R1.27 C#CC(C)NCc1cnccn1 c67b65ad9bb4aa4866be84c7c962c9c0 [0,1,0,0,0,1|1,0,1]=4 1271 B12R1.27 C#CC(C)NCc1cncnc1 b39a5bae262444dbd951e137ad9581f0 [0,1,0,0,0,1|1,0,1]=4 1272 B12R1.27 C#CC(C)OCc1ccccc1 f6359202a87cde289007d81369eaa165 [0,1,0,0,0,1|1,0,1]=4 1273 B12R1.27 C#CC(C)OCc1cccnc1 27bc712e2a2f5b54ccb587c26321c64b [0,1,0,0,0,1|0,0,1]=3 1274 B12R1.27 C#CC(C)OCc1cccnn1 9509181281f3fc3f21f042c89f2fbb97 [0,1,0,0,0,1|1,0,1]=4 1275 B12R1.27 C#CC(C)OCc1cnccn1 ec585cebe3068813ffea29ee9daeca91 [0,1,0,0,0,1|1,0,1]=4 1276 B12R1.27 C#CC(C)OCc1cncnc1 a6ad6f9786553f9a1989fea26f8f9e6b [0,1,0,0,0,1|1,0,1]=4 1277 B12R1.27 C#C[C@@H](C)NCc1ccccc1 51fd06b5dc99f337c53516eb04becf75 [0,1,0,0,0,1|1,0,1]=4 1278 B12R1.27 C#C[C@@H](C)NCc1cccnc1 fd4a88a1da68e3b7aab4cf836a2705d2 [0,1,0,0,0,1|0,0,1]=3 1279 B12R1.27 C#C[C@@H](C)NCc1cccnn1 4adabd3fa0ffce5d3e6289518b19308d [0,1,0,0,0,1|1,0,1]=4 1280 B12R1.27 C#C[C@@H](C)NCc1cncnc1 6c50b2b458af2e80d553f3c7eeb6fc64 [0,1,0,0,0,1|1,0,1]=4 1281 B12R1.27 C#C[C@@H](C)OCc1ccccc1 5a1f683c3ddc74682e7065902596ab4b [0,1,0,0,0,1|1,0,1]=4 1282 B12R1.27 C#C[C@@H](C)OCc1cccnc1 31f57c38c83a01a7e153c545431ffed8 [0,1,0,0,0,1|0,0,1]=3 1283 B12R1.27 C#C[C@@H](C)OCc1cccnn1 19fb21c02bc6c3870a140f447ccf36bc [0,1,0,0,0,1|1,0,1]=4 1284 B12R1.27 C#C[C@@H](C)OCc1cncnc1 d12f4f8c96c984bfed77d8a75855a2e3 [0,1,0,0,0,1|1,0,1]=4 1285 B12R1.27 C#C[C@H](C)NCc1ccccc1 5c0b47a0f6d5613da204666041aaf216 [0,1,0,0,0,1|1,0,1]=4 1286 B12R1.27 C#C[C@H](C)NCc1cccnc1 b7f630fa157fcfc92e6054ac0ba18e1f [0,1,0,0,0,1|0,0,1]=3 1287 B12R1.27 C#C[C@H](C)NCc1cccnn1 2f94b8c279649d446c2cf5169d1ea762 [0,1,0,0,0,1|1,0,1]=4 1288 B12R1.27 C#C[C@H](C)NCc1cncnc1 c7a09910f5bbcd8ea397c6b8a66c11ee [0,1,0,0,0,1|1,0,1]=4 1289 B12R1.27 C#C[C@H](C)OCc1ccccc1 760d62af860bc17bf4194987b15f5245 [0,1,0,0,0,1|1,0,1]=4 1290 B12R1.27 C#C[C@H](C)OCc1cccnc1 0a831b0ff4f14fb1e4243b0eac6fb036 [0,1,0,0,0,1|0,0,1]=3 1291 B12R1.27 C#C[C@H](C)OCc1cccnn1 dcf27838d00d57379ffddb8ce6f31660 [0,1,0,0,0,1|1,0,1]=4 1292 B12R1.27 C#C[C@H](C)OCc1cncnc1 dac55825856d0e707ed2acec47cc7f13 [0,1,0,0,0,1|1,0,1]=4 1293 B12R1.27 C=C(CC)CNc1cccnc1 8cbdf3584644d8652491ffda9c8df985 [0,1,0,0,0,1|0,0,2]=4 1294 B12R1.27 C=C(CC)COc1cccnc1 23f2aa6e96c6366735818713517c20fd [0,1,0,0,0,1|0,0,2]=4 1295 B12R1.27 C=C(CNc1cccnc1)OC 16f5c6a181503e92db9c7517f408c15a [0,1,0,0,0,1|0,0,2]=4 1296 B12R1.27 C=C(CO)CNc1cccnc1 0fd79a449234686b43f3fbd5309569ce [0,1,0,0,0,1|0,0,2]=4 1297 B12R1.27 C=C(COc1cccnc1)OC 3ff9797a1ba9a3ae1d012481d7824603 [0,1,0,0,0,1|0,0,2]=4 1298 B12R1.27 C=CC(C)NCc1ccccc1 a2d84df39e96bf4d63bb9a0f31cf21bd [0,1,0,0,0,1|1,0,1]=4 1299 B12R1.27 C=CC(C)NCc1cccnc1 7cec8fd02050ec361d8281c4552c4fe2 [0,1,0,0,0,1|0,0,1]=3 1300 B12R1.27 C=CC(C)NCc1cccnn1 8c7bc6d5b57596359f4dca2ca2aa05b8 [0,1,0,0,0,1|1,0,1]=4 1301 B12R1.27 C=CC(C)NCc1ccnnc1 62071ae1719ce300b7775b97b89cd0c0 [0,1,0,0,0,1|1,0,1]=4 1302 B12R1.27 C=CC(C)NCc1cnccn1 8ddabd6bd7f8072902771a596bc64276 [0,1,0,0,0,1|1,0,1]=4 1303 B12R1.27 C=CC(C)NCc1cncnc1 5c1a067693437b72bdc6257394b1ab62 [0,1,0,0,0,1|1,0,1]=4 1304 B12R1.27 C=CC(C)OCc1ccccc1 5eba3aa739773a1c08ab0c58859512d1 [0,1,0,0,0,1|1,0,1]=4 1305 B12R1.27 C=CC(C)OCc1cccnc1 0e2ae91440488b0d8d3e25a4e88da374 [0,1,0,0,0,1|0,0,1]=3 1306 B12R1.27 C=CC(C)OCc1cccnn1 ccda418f885f89e6337c4c84edd002bc [0,1,0,0,0,1|1,0,1]=4 1307 B12R1.27 C=CC(C)OCc1ccnnc1 b944ab2ee60a8378b2fbdf7765948c1e [0,1,0,0,0,1|1,0,1]=4 1308 B12R1.27 C=CC(C)OCc1cnccn1 f7d5645560c34e1d7d3ca1e28096be5c [0,1,0,0,0,1|1,0,1]=4 1309 B12R1.27 C=CC(C)OCc1cncnc1 59cdb7aa3fe9368b9a713246c66a4a59 [0,1,0,0,0,1|1,0,1]=4 1310 B12R1.27 C=CC(O)CNc1cccnc1 c9f671afde3f30ddf69ac90ee2fa441b [0,1,0,0,0,1|1,0,1]=4 1311 B12R1.27 C=C[C@H](C)OCc1ccccc1 723c5fd60a5c4ba97fa272fb1c420579 [0,1,0,0,0,1|1,0,1]=4 1312 B12R1.27 C=C[C@H](C)OCc1cccnc1 06e7b3e5ebf7969bdca7cd59c31810f0 [0,1,0,0,0,1|0,0,1]=3 1313 B12R1.27 C=C[C@H](C)OCc1cccnn1 22c51ae750b178aa2b87a5c87f810598 [0,1,0,0,0,1|1,0,1]=4 1314 B12R1.27 C=C[C@H](C)OCc1cncnc1 cb0d99deff838e68d850b7443833ad98 [0,1,0,0,0,1|1,0,1]=4 1315 B12R1.27 CC(C#N)CNc1ccccc1 bca83eb9ab77da1cbd259e8c3d4283ee [0,1,0,0,0,1|1,0,1]=4 1316 B12R1.27 CC(C#N)CNc1cccnc1 036abd006575b41a44c75a3611809cf9 [0,1,0,0,0,1|0,0,1]=3 1317 B12R1.27 CC(C#N)CNc1cccnn1 ffdd819700eed9670d3cb0981045cdae [0,1,0,0,0,1|1,0,1]=4 1318 B12R1.27 CC(C#N)CNc1ccnnc1 d87f4aa7b0b41046742c5dfcb03890df [0,1,0,0,0,1|1,0,1]=4 1319 B12R1.27 CC(C#N)CNc1cnccn1 5ebd415e7833dce25f3107176809240e [0,1,0,0,0,1|1,0,1]=4 1320 B12R1.27 CC(C#N)CNc1cncnc1 964b0036f221142cf3f59865e93fabba [0,1,0,0,0,1|1,0,1]=4 1321 B12R1.27 CC(C#N)COc1cccnc1 552960b934c9d47c3d5b0d1587169ff1 [0,1,0,0,0,1|0,0,1]=3 1322 B12R1.27 CC(C#N)COc1ccnnc1 effcf7e9aeba251dd09261f1a5c26600 [0,1,0,0,0,1|1,0,1]=4 1323 B12R1.27 CC(C#N)COc1cnccn1 1ebbb03f06733134a93f9d5b3752d6ea [0,1,0,0,0,1|1,0,1]=4 1324 B12R1.27 CC(C#N)NCc1ccccc1 a297cbe65f4070e0226da02d61e71151 [0,1,0,0,0,1|1,0,1]=4 1325 B12R1.27 CC(C#N)NCc1cccnc1 16d2d1def443ebc45b6ba0670a49cf7b [0,1,0,0,0,1|0,0,1]=3 1326 B12R1.27 CC(C#N)NCc1cccnn1 69c62e6fe1eb9be4d783e2415a386bb5 [0,1,0,0,0,1|1,0,1]=4 1327 B12R1.27 CC(C#N)NCc1cncnc1 c7cff94f8d620d8545f3906a757b6089 [0,1,0,0,0,1|1,0,1]=4 1328 B12R1.27 CC(C#N)OCc1cccnn1 06aebbba38da5b67aaf5c4e2395c7656 [0,1,0,0,0,1|1,0,1]=4 1329 B12R1.27 CC(C=O)NCc1ccccc1 52acbe8f861a146c2fae15c546c154ce [0,1,0,0,0,1|1,0,1]=4 1330 B12R1.27 CC(C=O)NCc1cccnc1 355f37186fa2df6a1fe0c1b99c16c994 [0,1,0,0,0,1|0,0,1]=3 1331 B12R1.27 CC(C=O)NCc1cccnn1 f7914194e335d384b13fecaa58dee496 [0,1,0,0,0,1|1,0,1]=4 1332 B12R1.27 CC(C=O)NCc1ccnnc1 52b349a4763579658bdc30f4bde2e0bd [0,1,0,0,0,1|1,0,1]=4 1333 B12R1.27 CC(C=O)NCc1cnccn1 fafdb43f2983d03f73f0520daec21fcc [0,1,0,0,0,1|1,0,1]=4 1334 B12R1.27 CC(C=O)NCc1cncnc1 33619c76650c2d7e10da97c61483ea1f [0,1,0,0,0,1|1,0,1]=4 1335 B12R1.27 CC(C=O)OCc1ccccc1 dab13d83530825bb9c7bbbb7bc6908d9 [0,1,0,0,0,1|1,0,1]=4 1336 B12R1.27 CC(C=O)OCc1cccnc1 51ede6b99e44af095a1dfaa30f3ea80e [0,1,0,0,0,1|0,0,1]=3 1337 B12R1.27 CC(C=O)OCc1cccnn1 21123c033370273565f926229effccf6 [0,1,0,0,0,1|1,0,1]=4 1338 B12R1.27 CC(C=O)OCc1ccnnc1 01995c46ed0068289e44318f7b6f16cf [0,1,0,0,0,1|1,0,1]=4 1339 B12R1.27 CC(C=O)OCc1cnccn1 a6bf276b7123bc8a9730bc60a4ba9730 [0,1,0,0,0,1|1,0,1]=4 1340 B12R1.27 CC(C=O)OCc1cncnc1 873c7d55de57e0e879e212bf7698f9be [0,1,0,0,0,1|1,0,1]=4 1341 B12R1.27 CC(CF)OCc1ccccc1 c18da580e3dabe7992624a35c25d53e8 [0,1,0,0,0,1|1,0,0]=3 1342 B12R1.27 CC(CF)OCc1ccccn1 0d7b7c864206636c9235d181d09d6b15 [0,1,0,0,0,1|2,0,0]=4 1343 B12R1.27 CC(CF)OCc1cccnc1 dcd165da872903498dbd39f6392c4596 [0,1,0,0,0,1|0,0,0]=2 1344 B12R1.27 CC(CF)OCc1cccnn1 2c6b5889e411e9f53b3bd7e4e48410da [0,1,0,0,0,1|1,0,0]=3 1345 B12R1.27 CC(CF)OCc1cncnc1 b8fd096cbc6c93ca7d0bf968668f45d4 [0,1,0,0,0,1|1,0,0]=3 1346 B12R1.27 CC(CO)CNc1ccccc1 f07a32871260f72c2fb2363a7f611104 [0,1,0,0,0,1|1,0,0]=3 1347 B12R1.27 CC(CO)CNc1ccccn1 9228158f05cdce3bcf2332746a0d5a23 [0,1,0,0,0,1|2,0,0]=4 1348 B12R1.27 CC(CO)CNc1cccnc1 801122522d7c4cbfe437832579f981bf [0,1,0,0,0,1|0,0,0]=2 1349 B12R1.27 CC(CO)CNc1cccnn1 98d1904fab5d41362a075c11e1efa1aa [0,1,0,0,0,1|1,0,0]=3 1350 B12R1.27 CC(CO)CNc1ccncc1 40e833cdc1404a8681b4db576acfe323 [0,1,0,0,0,1|2,0,0]=4 1351 B12R1.27 CC(CO)CNc1ccnnc1 78eb7b62c61d117d7bf1280befe623f5 [0,1,0,0,0,1|1,0,0]=3 1352 B12R1.27 CC(CO)CNc1cnccn1 4467f0cfd9c9dbc876a653a533aa52f9 [0,1,0,0,0,1|1,0,0]=3 1353 B12R1.27 CC(CO)CNc1cncnc1 c1db632a973f58d02699cb672a9bc766 [0,1,0,0,0,1|1,0,0]=3 1354 B12R1.27 CC(CO)CNc1cnncn1 1a9eb317c77b1a680f7b166803fdc38b [0,1,0,0,0,1|2,0,0]=4 1355 B12R1.27 CC(CO)CNc1nccnn1 506d874710e2222e9931c0f1b3a94fd9 [0,1,0,0,0,1|2,0,0]=4 1356 B12R1.27 CC(CO)NCc1ccccc1 8f2e7b2c99e7f1ec8ee06bbaf841b37c [0,1,0,0,0,1|1,0,0]=3 1357 B12R1.27 CC(CO)NCc1ccccn1 dc606027ab1cf21842521e3cd6aab041 [0,1,0,0,0,1|2,0,0]=4 1358 B12R1.27 CC(CO)NCc1cccnc1 80adcdefa26a29e6989696dff2f189ce [0,1,0,0,0,1|0,0,0]=2 1359 B12R1.27 CC(CO)NCc1cccnn1 c0ae66a6706b4b09ae7fbfdd61df0b00 [0,1,0,0,0,1|1,0,0]=3 1360 B12R1.27 CC(CO)NCc1ccncc1 9672e7a66b4b38bfe57c10026c0328a2 [0,1,0,0,0,1|2,0,0]=4 1361 B12R1.27 CC(CO)NCc1ccnnc1 b000a1f808d028c5c52000e71e5aa2bc [0,1,0,0,0,1|1,0,0]=3 1362 B12R1.27 CC(CO)NCc1cnccn1 c4d9086c3d359aa0fead8d59b651d860 [0,1,0,0,0,1|1,0,0]=3 1363 B12R1.27 CC(CO)NCc1cncnc1 4baf132c2cabed4f1213cc5f82034422 [0,1,0,0,0,1|1,0,0]=3 1364 B12R1.27 CC(CS)OCc1ccccc1 bf9173a456888d57225f0e1203a32c5e [0,1,0,0,0,1|1,0,0]=3 1365 B12R1.27 CC(CS)OCc1ccccn1 d5c25dfa8bcef5c73ff7d0ae8229ced9 [0,1,0,0,0,1|2,0,0]=4 1366 B12R1.27 CC(CS)OCc1cccnc1 c6dbc5eba4423fac160580b226332d7c [0,1,0,0,0,1|0,0,0]=2 1367 B12R1.27 CC(CS)OCc1cccnn1 a0872fdb6d741d866e92a6ca3a80681f [0,1,0,0,0,1|1,0,0]=3 1368 B12R1.27 CC(CS)OCc1cncnc1 9b9e3a5e726b1263c15615ccb674f86d [0,1,0,0,0,1|1,0,0]=3 1369 B12R1.27 CCC(=O)CNc1cccnc1 1504cf6a29e5927e00fbb7fbe9fae424 [0,1,0,0,0,1|1,0,1]=4 1370 B12R1.27 CCC(=O)COc1cccnc1 b80719a3406cee7589ce2d1a152f5933 [0,1,0,0,0,1|1,0,1]=4 1371 B12R1.27 CCC(=O)NCc1cccnc1 163349dbb40d7f18c251a823056c2629 [0,1,0,0,0,1|1,0,1]=4 1372 B12R1.27 CCC(C)CNc1ccccc1 fb8ee4288bf8853fd57c8a217184507f [0,1,0,0,0,1|1,0,0]=3 1373 B12R1.27 CCC(C)CNc1ccccn1 6f2b4521dfa3e14ebf77bc9e288b8c6c [0,1,0,0,0,1|2,0,0]=4 1374 B12R1.27 CCC(C)CNc1cccnc1 799d2535ec95c75adc3efc07c94a55e6 [0,1,0,0,0,1|0,0,0]=2 1375 B12R1.27 CCC(C)CNc1cccnn1 fe60a93e339912dde949c52c81965e44 [0,1,0,0,0,1|1,0,0]=3 1376 B12R1.27 CCC(C)CNc1ccncc1 1d114bdb53eb8bc5873d9cc0853c5acf [0,1,0,0,0,1|2,0,0]=4 1377 B12R1.27 CCC(C)CNc1ccnnc1 5473148c247b3b210e0915bca10818ae [0,1,0,0,0,1|1,0,0]=3 1378 B12R1.27 CCC(C)CNc1cnccn1 3cf63567314cf83ced5941a4b5546fbb [0,1,0,0,0,1|1,0,0]=3 1379 B12R1.27 CCC(C)CNc1cncnc1 2aa3c6a64d8877fb76a2636fae9c6ecf [0,1,0,0,0,1|1,0,0]=3 1380 B12R1.27 CCC(C)CNc1cnncn1 6d72a6f9e1301c8ce1098ad663d57751 [0,1,0,0,0,1|2,0,0]=4 1381 B12R1.27 CCC(C)CNc1nccnn1 57f3d440302fc8184936cfcffe3767dd [0,1,0,0,0,1|2,0,0]=4 1382 B12R1.27 CCC(C)COc1ccccn1 068a7be24dc7922a67d6964a1394c7d6 [0,1,0,0,0,1|2,0,0]=4 1383 B12R1.27 CCC(C)COc1cccnc1 0c32f61d8566e65294b7d65adcb5b70b [0,1,0,0,0,1|0,0,0]=2 1384 B12R1.27 CCC(C)COc1ccncc1 60b90e0040b7a2f08da03a263d76f7dc [0,1,0,0,0,1|2,0,0]=4 1385 B12R1.27 CCC(C)COc1ccnnc1 937cb3c217aa7cf9901b76b71db0043e [0,1,0,0,0,1|1,0,0]=3 1386 B12R1.27 CCC(C)COc1cnccn1 c288149b64550ff633a3f83434c9440a [0,1,0,0,0,1|1,0,0]=3 1387 B12R1.27 CCC(C)COc1cncnc1 ff4047eade71c2d2f301d3014ce3d877 [0,1,0,0,0,1|1,0,0]=3 1388 B12R1.27 CCC(C)COc1cncnn1 c83a8d8b5fd62552650db277a1811352 [0,1,0,0,0,1|2,0,0]=4 1389 B12R1.27 CCC(C)NCc1ccccc1 ab8df84230779f2ea3e6a09700944eac [0,1,0,0,0,1|1,0,0]=3 1390 B12R1.27 CCC(C)NCc1ccccn1 600531c2c0367b3cbfd9810ef9c18666 [0,1,0,0,0,1|2,0,0]=4 1391 B12R1.27 CCC(C)NCc1cccnc1 03aa38772555301826d5e6a7450f6276 [0,1,0,0,0,1|0,0,0]=2 1392 B12R1.27 CCC(C)NCc1cccnn1 e88f67ed586eb144bc95e5bd7bcb62fb [0,1,0,0,0,1|1,0,0]=3 1393 B12R1.27 CCC(C)NCc1ccncc1 8f2ef9d0f5df7ed3c4b3d292b12e10fb [0,1,0,0,0,1|2,0,0]=4 1394 B12R1.27 CCC(C)NCc1ccnnc1 b2a3a49ec235fd158c647f3b0ce00c43 [0,1,0,0,0,1|1,0,0]=3 1395 B12R1.27 CCC(C)NCc1cnccn1 a0930806765eb19590abfca69771946b [0,1,0,0,0,1|1,0,0]=3 1396 B12R1.27 CCC(C)NCc1cncnc1 989a6a6711ad5abe60fde74bbcaf88a3 [0,1,0,0,0,1|1,0,0]=3 1397 B12R1.27 CCC(C)OCc1ccccc1 ecd56e0e8d83f20f8ba3d53f4367b277 [0,1,0,0,0,1|1,0,0]=3 1398 B12R1.27 CCC(C)OCc1ccccn1 cdbc114ff1e98274e0c76d4efba7fd19 [0,1,0,0,0,1|2,0,0]=4 1399 B12R1.27 CCC(C)OCc1cccnc1 48e9afbe8701af90763c0a4646314a57 [0,1,0,0,0,1|0,0,0]=2 1400 B12R1.27 CCC(C)OCc1cccnn1 931286049d3813ef6a988d4bb07d95ff [0,1,0,0,0,1|1,0,0]=3 1401 B12R1.27 CCC(C)OCc1ccncc1 a48ab0f470a95fc03f35a49430e127c9 [0,1,0,0,0,1|2,0,0]=4 1402 B12R1.27 CCC(C)OCc1ccnnc1 6a16e1bd70177a493b3b9c8dbfb1e9da [0,1,0,0,0,1|1,0,0]=3 1403 B12R1.27 CCC(C)OCc1cnccn1 989f83298573eea5a35c1e5bc64dd4aa [0,1,0,0,0,1|1,0,0]=3 1404 B12R1.27 CCC(C)OCc1cncnc1 2ea00c80b231a702b7043d7784076322 [0,1,0,0,0,1|1,0,0]=3 1405 B12R1.27 CCC(O)CNc1ccccc1 3a32ac0a6b49d877750df15cf382268b [0,1,0,0,0,1|2,0,0]=4 1406 B12R1.27 CCC(O)CNc1cccnc1 5ec705eaa989393421bbf1121531428c [0,1,0,0,0,1|1,0,0]=3 1407 B12R1.27 CCC(O)CNc1cccnn1 ac8c3cdae8804672bacb52140e53905b [0,1,0,0,0,1|2,0,0]=4 1408 B12R1.27 CCC(O)CNc1ccnnc1 fe0e786ee5d88fafe3b7ed52c4168ced [0,1,0,0,0,1|2,0,0]=4 1409 B12R1.27 CCC(O)CNc1cnccn1 6334d1439105446d009be2bfcd484584 [0,1,0,0,0,1|2,0,0]=4 1410 B12R1.27 CCC(O)CNc1cncnc1 4bd5a3ed92eaf9c981e18e753f2261c5 [0,1,0,0,0,1|2,0,0]=4 1411 B12R1.27 CCN(C)CCc1ccccc1 7c4ca4f684c66e96c63c7f2e129ac623 [0,1,0,0,0,1|2,0,0]=4 1412 B12R1.27 CCN(C)CCc1cccnc1 8f102e3d75ada77333a942e239825207 [0,1,0,0,0,1|1,0,0]=3 1413 B12R1.27 CC[C@@H](C)CNc1ccccc1 7adb7de69cc286747885efdd5e0d3ab0 [0,1,0,0,0,1|1,0,0]=3 1414 B12R1.27 CC[C@@H](C)CNc1ccccn1 b147644fe4c42e26e6b4ca990988fc8c [0,1,0,0,0,1|2,0,0]=4 1415 B12R1.27 CC[C@@H](C)CNc1cccnc1 1eb105ddecf8c3249110848ecff4eaa7 [0,1,0,0,0,1|0,0,0]=2 1416 B12R1.27 CC[C@@H](C)CNc1cccnn1 f138a0d0c9267c29c52fe7f61c67828a [0,1,0,0,0,1|1,0,0]=3 1417 B12R1.27 CC[C@@H](C)CNc1ccncc1 ea454cc837b589ad6fa29f9da9abac60 [0,1,0,0,0,1|2,0,0]=4 1418 B12R1.27 CC[C@@H](C)CNc1ccnnc1 5eb7bcc5ff366c82960e8062c22b3647 [0,1,0,0,0,1|1,0,0]=3 1419 B12R1.27 CC[C@@H](C)CNc1cnccn1 03c5733ba7940e2549808a371cd40c8d [0,1,0,0,0,1|1,0,0]=3 1420 B12R1.27 CC[C@@H](C)CNc1cncnc1 af1b51f81d6b82bb23c8c72456f2e669 [0,1,0,0,0,1|1,0,0]=3 1421 B12R1.27 CC[C@@H](C)CNc1cnncn1 cce845849acdf356a4fb8233fd6c64ab [0,1,0,0,0,1|2,0,0]=4 1422 B12R1.27 CC[C@@H](C)CNc1nccnn1 94611cb70ff9bf45b3491622bc2df22e [0,1,0,0,0,1|2,0,0]=4 1423 B12R1.27 CC[C@@H](C)COc1ccccn1 874982a66f916edcb8896717a7802590 [0,1,0,0,0,1|2,0,0]=4 1424 B12R1.27 CC[C@@H](C)COc1cccnc1 58227191aae01f35afcd7cf132697857 [0,1,0,0,0,1|0,0,0]=2 1425 B12R1.27 CC[C@@H](C)COc1ccncc1 d0894bc1ae7cda042c896f44faa1550c [0,1,0,0,0,1|2,0,0]=4 1426 B12R1.27 CC[C@@H](C)COc1ccnnc1 e8ad9748a8dbf608af64e03ea8d16197 [0,1,0,0,0,1|1,0,0]=3 1427 B12R1.27 CC[C@@H](C)COc1cnccn1 7b3f825b503a154f58403ce019b27176 [0,1,0,0,0,1|1,0,0]=3 1428 B12R1.27 CC[C@@H](C)COc1cncnc1 b23a6462adfd0aef4d41a1fc1323a03b [0,1,0,0,0,1|1,0,0]=3 1429 B12R1.27 CC[C@@H](C)COc1cncnn1 68dcc5b8420837a8199c57e6694db34a [0,1,0,0,0,1|2,0,0]=4 1430 B12R1.27 CC[C@@H](C)NCc1ccccc1 1448d746eef22413d3964f8047936159 [0,1,0,0,0,1|1,0,0]=3 1431 B12R1.27 CC[C@@H](C)NCc1ccccn1 abcbefa3b0b43406c128be8257adf8b2 [0,1,0,0,0,1|2,0,0]=4 1432 B12R1.27 CC[C@@H](C)NCc1cccnc1 b119e02beb918b7f43cb64ab2c69b801 [0,1,0,0,0,1|0,0,0]=2 1433 B12R1.27 CC[C@@H](C)NCc1cccnn1 67c35e96e8b22c34c0f9f2bf0dbc7c53 [0,1,0,0,0,1|1,0,0]=3 1434 B12R1.27 CC[C@@H](C)NCc1cncnc1 b6e420feea948573cc317ba983efd3a5 [0,1,0,0,0,1|1,0,0]=3 1435 B12R1.27 CC[C@@H](C)OCc1ccccc1 0a5e215baf34a258dd8987ff4d2156b3 [0,1,0,0,0,1|1,0,0]=3 1436 B12R1.27 CC[C@@H](C)OCc1ccccn1 01fb0c2d8a73e699c5cca2351e7c51da [0,1,0,0,0,1|2,0,0]=4 1437 B12R1.27 CC[C@@H](C)OCc1cccnc1 2a740981d9be19ca809d229b469f45a2 [0,1,0,0,0,1|0,0,0]=2 1438 B12R1.27 CC[C@@H](C)OCc1cccnn1 2fac72deb935cb1047377c76377e9d51 [0,1,0,0,0,1|1,0,0]=3 1439 B12R1.27 CC[C@@H](C)OCc1cncnc1 bcc96b1e54394299fc88f0441148dce2 [0,1,0,0,0,1|1,0,0]=3 1440 B12R1.27 CC[C@@H](O)CNc1ccccc1 765034dc37ea09fed7d7c3321191febe [0,1,0,0,0,1|2,0,0]=4 1441 B12R1.27 CC[C@@H](O)CNc1cccnc1 804d6049e9a11075b053115d69a8a4fd [0,1,0,0,0,1|1,0,0]=3 1442 B12R1.27 CC[C@H](C)CNc1ccccc1 1ad1285ada078333483cb7913624769f [0,1,0,0,0,1|1,0,0]=3 1443 B12R1.27 CC[C@H](C)CNc1ccccn1 75c9b55178b9e6cbffbfe52153637e1b [0,1,0,0,0,1|2,0,0]=4 1444 B12R1.27 CC[C@H](C)CNc1cccnc1 2e0a2075fe988129d1dcbf5d21b158ec [0,1,0,0,0,1|0,0,0]=2 1445 B12R1.27 CC[C@H](C)CNc1cccnn1 f45f47606b109d68254290173d5081e6 [0,1,0,0,0,1|1,0,0]=3 1446 B12R1.27 CC[C@H](C)CNc1ccncc1 1476b49c3603a7542420a49c2bf3dc59 [0,1,0,0,0,1|2,0,0]=4 1447 B12R1.27 CC[C@H](C)CNc1ccnnc1 52e80b93e094d9fec0a29d13d158665b [0,1,0,0,0,1|1,0,0]=3 1448 B12R1.27 CC[C@H](C)CNc1cnccn1 8ecdfdf7b0f098ad2d5cb8d4d77444ce [0,1,0,0,0,1|1,0,0]=3 1449 B12R1.27 CC[C@H](C)CNc1cncnc1 9c99c80b549f16dfabdf711e3d54d23f [0,1,0,0,0,1|1,0,0]=3 1450 B12R1.27 CC[C@H](C)CNc1cnncn1 93e26faa6eea2540f42bb35fe390a07e [0,1,0,0,0,1|2,0,0]=4 1451 B12R1.27 CC[C@H](C)CNc1nccnn1 26821168c217d3f15e15d954537c94e7 [0,1,0,0,0,1|2,0,0]=4 1452 B12R1.27 CC[C@H](C)COc1ccccn1 f5b749782758cf24dab04e1718b2b720 [0,1,0,0,0,1|2,0,0]=4 1453 B12R1.27 CC[C@H](C)COc1cccnc1 07e42e29a9d594c30776c88035bd838e [0,1,0,0,0,1|0,0,0]=2 1454 B12R1.27 CC[C@H](C)COc1ccncc1 91877b6a13f619eb114c1ca0ccf0b7a7 [0,1,0,0,0,1|2,0,0]=4 1455 B12R1.27 CC[C@H](C)COc1ccnnc1 350322cd064e62f86a14401591342865 [0,1,0,0,0,1|1,0,0]=3 1456 B12R1.27 CC[C@H](C)COc1cnccn1 cab76278093fc45be19b2bc8e97ced1c [0,1,0,0,0,1|1,0,0]=3 1457 B12R1.27 CC[C@H](C)COc1cncnc1 45181fabde01105f70c7947078738859 [0,1,0,0,0,1|1,0,0]=3 1458 B12R1.27 CC[C@H](C)COc1cncnn1 97c445a9830c8bf9f171e601386da812 [0,1,0,0,0,1|2,0,0]=4 1459 B12R1.27 CC[C@H](C)NCc1ccccc1 1d652b15c79b972376b40d93f2c0c28b [0,1,0,0,0,1|1,0,0]=3 1460 B12R1.27 CC[C@H](C)NCc1ccccn1 db87df854d63d8a538c09dd589fcce72 [0,1,0,0,0,1|2,0,0]=4 1461 B12R1.27 CC[C@H](C)NCc1cccnc1 fa7be05a72600688ba61bb2a45c0e2c1 [0,1,0,0,0,1|0,0,0]=2 1462 B12R1.27 CC[C@H](C)NCc1cccnn1 afb2d02055de31c3b13c38e7426238a5 [0,1,0,0,0,1|1,0,0]=3 1463 B12R1.27 CC[C@H](C)NCc1cncnc1 6c530c9353f472ab075d4e138de6e7b6 [0,1,0,0,0,1|1,0,0]=3 1464 B12R1.27 CC[C@H](C)OCc1ccccc1 b8de8bd5177d460679bde97bee24bb31 [0,1,0,0,0,1|1,0,0]=3 1465 B12R1.27 CC[C@H](C)OCc1ccccn1 095ff59c775b3964aafbd1681dc69b03 [0,1,0,0,0,1|2,0,0]=4 1466 B12R1.27 CC[C@H](C)OCc1cccnc1 dc7942b08bf13064943cbe342b7c887c [0,1,0,0,0,1|0,0,0]=2 1467 B12R1.27 CC[C@H](C)OCc1cccnn1 140744aee80ca8123abb7507b4305d28 [0,1,0,0,0,1|1,0,0]=3 1468 B12R1.27 CC[C@H](C)OCc1cncnc1 13b1c6e0aa4db96427c863609dca197b [0,1,0,0,0,1|1,0,0]=3 1469 B12R1.27 CN(C=O)CCc1cccnc1 ccdb98ff89857da134ddd0f017e9db4f [0,1,0,0,0,1|1,0,1]=4 1470 B12R1.27 CN(CF)CCc1ccccc1 af958a660e6bf737d02c2dfab1bc467d [0,1,0,0,0,1|2,0,0]=4 1471 B12R1.27 CN(CF)CCc1cccnc1 e55726a3c32e233d630a4f29602b811f [0,1,0,0,0,1|1,0,0]=3 1472 B12R1.27 CN(CO)CCc1ccccc1 c9a67cdf713e4c874ec2d63ed5e8590a [0,1,0,0,0,1|2,0,0]=4 1473 B12R1.27 CN(CO)CCc1cccnc1 b13669a1ddf1ac46ef1460e055843b9e [0,1,0,0,0,1|1,0,0]=3 1474 B12R1.27 CNC(=O)CNc1cccnc1 e74073d8f4796974c660596e377c33cf [0,1,0,0,0,1|1,0,1]=4 1475 B12R1.27 CNC(=O)COc1cccnc1 609ec57943b9a9b0a728c8221c1b3313 [0,1,0,0,0,1|1,0,1]=4 1476 B12R1.27 COC(=O)CNc1cccnc1 bb8fa453cbe767f1bfa38300e2133b6f [0,1,0,0,0,1|1,0,1]=4 1477 B12R1.27 COC(=O)COc1cccnc1 4796298b812d84cf06b77d8bd60f9b41 [0,1,0,0,0,1|1,0,1]=4 1478 B12R1.27 COC(C)CNc1ccccc1 8b7aea6540e0014f2969161722152c0a [0,1,0,0,0,1|1,0,0]=3 1479 B12R1.27 COC(C)CNc1ccccn1 aa1fffc4826b028b66ca3b6131bb2129 [0,1,0,0,0,1|2,0,0]=4 1480 B12R1.27 COC(C)CNc1cccnc1 22ea1776f5c64fa404e2b1d10875769b [0,1,0,0,0,1|0,0,0]=2 1481 B12R1.27 COC(C)CNc1cccnn1 57b8f2e31a89437037bb968036b0a7ad [0,1,0,0,0,1|1,0,0]=3 1482 B12R1.27 COC(C)CNc1ccncc1 8583756de850d35d798b9d18e790369d [0,1,0,0,0,1|2,0,0]=4 1483 B12R1.27 COC(C)CNc1ccnnc1 1ef6344f5f57a524b522bc16ce4f3f7a [0,1,0,0,0,1|1,0,0]=3 1484 B12R1.27 COC(C)CNc1cnccn1 4934fe98e881c8caac1de5e17b4dc92d [0,1,0,0,0,1|1,0,0]=3 1485 B12R1.27 COC(C)CNc1cncnc1 76d1148a167534b4fcc70bd965040319 [0,1,0,0,0,1|1,0,0]=3 1486 B12R1.27 COC(C)CNc1cnncn1 5bb2ec6d9dd14914b019e4f393d54c7a [0,1,0,0,0,1|2,0,0]=4 1487 B12R1.27 COC(C)CNc1nccnn1 c427842542b2d45807932d688f9e8d20 [0,1,0,0,0,1|2,0,0]=4 1488 B12R1.27 COC(C)COc1ccccn1 f8dc8bfeccf22df73c7ed2e356fc48da [0,1,0,0,0,1|2,0,0]=4 1489 B12R1.27 COC(C)COc1cccnc1 9293f71aa0063e3b71a6c85117d16856 [0,1,0,0,0,1|0,0,0]=2 1490 B12R1.27 COC(C)COc1ccncc1 5fbc7e5892edbad02dcb9a66b68a62df [0,1,0,0,0,1|2,0,0]=4 1491 B12R1.27 COC(C)COc1ccnnc1 c736b03fcccbeacc05d0d73575cc4d1b [0,1,0,0,0,1|1,0,0]=3 1492 B12R1.27 COC(C)COc1cnccn1 168521879b84e34b8c393d32fd7d174c [0,1,0,0,0,1|1,0,0]=3 1493 B12R1.27 COC(C)COc1cncnc1 018a2a8d74b79afe6852ad6a79d6a6d6 [0,1,0,0,0,1|1,0,0]=3 1494 B12R1.27 COC(C)COc1cncnn1 3522cbbde3bc4e35a710657e091b22c0 [0,1,0,0,0,1|2,0,0]=4 1495 B12R1.27 CO[C@@H](C)CNc1ccccc1 1db51b6397d595cc5bd1ef07b3dce178 [0,1,0,0,0,1|1,0,0]=3 1496 B12R1.27 CO[C@@H](C)CNc1ccccn1 3f6f24d683b32bf983db741333c2969d [0,1,0,0,0,1|2,0,0]=4 1497 B12R1.27 CO[C@@H](C)CNc1cccnc1 ed45e74a30d0fad7831c896f4455a3e9 [0,1,0,0,0,1|0,0,0]=2 1498 B12R1.27 CO[C@@H](C)CNc1cccnn1 a7aab28edd21d3a5ef3d70cba3e8d7f9 [0,1,0,0,0,1|1,0,0]=3 1499 B12R1.27 CO[C@@H](C)CNc1ccncc1 321a70901c24d6141307a3fd83345c5f [0,1,0,0,0,1|2,0,0]=4 1500 B12R1.27 CO[C@@H](C)CNc1ccnnc1 bd91b33e1ab00e0320ecd558add50c2b [0,1,0,0,0,1|1,0,0]=3 1501 B12R1.27 CO[C@@H](C)CNc1cnccn1 53ae0935256e105b3eb7c609b854c909 [0,1,0,0,0,1|1,0,0]=3 1502 B12R1.27 CO[C@@H](C)CNc1cncnc1 ae65d70c0954de37db4895592764b4d0 [0,1,0,0,0,1|1,0,0]=3 1503 B12R1.27 CO[C@@H](C)CNc1cnncn1 70675b7b34d8454e55d101f9d036ea3a [0,1,0,0,0,1|2,0,0]=4 1504 B12R1.27 CO[C@@H](C)CNc1nccnn1 3f319315f8461a0301bc59faf9c380e8 [0,1,0,0,0,1|2,0,0]=4 1505 B12R1.27 CO[C@@H](C)COc1ccccn1 74e5eb55678aa99f2f01dd02e58c0f99 [0,1,0,0,0,1|2,0,0]=4 1506 B12R1.27 CO[C@@H](C)COc1cccnc1 4625df0874e428ea62a16a84848b31c3 [0,1,0,0,0,1|0,0,0]=2 1507 B12R1.27 CO[C@@H](C)COc1ccncc1 a06e60f07f6a57574e8cbc8ff90265e7 [0,1,0,0,0,1|2,0,0]=4 1508 B12R1.27 CO[C@@H](C)COc1ccnnc1 6c807b2fe478ce11e5850217979ae864 [0,1,0,0,0,1|1,0,0]=3 1509 B12R1.27 CO[C@@H](C)COc1cnccn1 b74633bf8dc1ffc4614cbf0963cc0979 [0,1,0,0,0,1|1,0,0]=3 1510 B12R1.27 CO[C@@H](C)COc1cncnc1 b7287c1396ba7fd311664ce2851613b9 [0,1,0,0,0,1|1,0,0]=3 1511 B12R1.27 CO[C@@H](C)COc1cncnn1 f098bf292fb80f3c4cf2844255e2e8d8 [0,1,0,0,0,1|2,0,0]=4 1512 B12R1.27 CO[C@H](C)CNc1ccccc1 b7b86a2dea3233b080c54d71a8f46990 [0,1,0,0,0,1|1,0,0]=3 1513 B12R1.27 CO[C@H](C)CNc1ccccn1 04ec0231ca9bc4cf1eff96f841c37724 [0,1,0,0,0,1|2,0,0]=4 1514 B12R1.27 CO[C@H](C)CNc1cccnc1 3d28dbb191d334198e2e90ddce2fa1a4 [0,1,0,0,0,1|0,0,0]=2 1515 B12R1.27 CO[C@H](C)CNc1cccnn1 308d9b61ca0613da225819a6631aa0ff [0,1,0,0,0,1|1,0,0]=3 1516 B12R1.27 CO[C@H](C)CNc1ccncc1 bd2ba612a637b68c883a6591cf32e881 [0,1,0,0,0,1|2,0,0]=4 1517 B12R1.27 CO[C@H](C)CNc1ccnnc1 0b1e03d7a3c7cf42a00b9ce336a3dc0b [0,1,0,0,0,1|1,0,0]=3 1518 B12R1.27 CO[C@H](C)CNc1cnccn1 b719a317b586b472c3ca3ba92317ee19 [0,1,0,0,0,1|1,0,0]=3 1519 B12R1.27 CO[C@H](C)CNc1cncnc1 57edc74303f1d79aedad731207c3d117 [0,1,0,0,0,1|1,0,0]=3 1520 B12R1.27 CO[C@H](C)CNc1cnncn1 c507692e57cc61356ccbdb5636c25478 [0,1,0,0,0,1|2,0,0]=4 1521 B12R1.27 CO[C@H](C)CNc1nccnn1 9d6ce3a63018ecb573892488d0574039 [0,1,0,0,0,1|2,0,0]=4 1522 B12R1.27 CO[C@H](C)COc1ccccn1 48788836bfd03aade6f0bd2c51b60c5c [0,1,0,0,0,1|2,0,0]=4 1523 B12R1.27 CO[C@H](C)COc1cccnc1 a0e969ee0f3c10fe22a63e3d03e64109 [0,1,0,0,0,1|0,0,0]=2 1524 B12R1.27 CO[C@H](C)COc1ccncc1 8e99d9b0419ebb5515c91639e755a31d [0,1,0,0,0,1|2,0,0]=4 1525 B12R1.27 CO[C@H](C)COc1ccnnc1 f945c9bbfb6b3f9636756fc0824691de [0,1,0,0,0,1|1,0,0]=3 1526 B12R1.27 CO[C@H](C)COc1cnccn1 f10e17992a6825010ede7d0e515d88a7 [0,1,0,0,0,1|1,0,0]=3 1527 B12R1.27 CO[C@H](C)COc1cncnc1 2e85b0fd0e5e5e9f49a37e10ec2a6b1b [0,1,0,0,0,1|1,0,0]=3 1528 B12R1.27 CO[C@H](C)COc1cncnn1 e7b4c7d00c64a96fbc6c915b59481402 [0,1,0,0,0,1|2,0,0]=4 1529 B12R1.27 C[C@@H](CO)CNc1ccccc1 8acaf8396f10bf3948fe3b52f4656e75 [0,1,0,0,0,1|1,0,0]=3 1530 B12R1.27 C[C@@H](CO)CNc1ccccn1 af016b84d95f1080f07ef6f02d15824a [0,1,0,0,0,1|2,0,0]=4 1531 B12R1.27 C[C@@H](CO)CNc1cccnc1 6052f0c67d4cdd3f80ceffbd11480331 [0,1,0,0,0,1|0,0,0]=2 1532 B12R1.27 C[C@@H](CO)CNc1cccnn1 0b6a2fb6d9427f1ca932a4a2c6e94db3 [0,1,0,0,0,1|1,0,0]=3 1533 B12R1.27 C[C@@H](CO)CNc1ccncc1 f14674535a69f3232455d568e370ba78 [0,1,0,0,0,1|2,0,0]=4 1534 B12R1.27 C[C@@H](CO)CNc1ccnnc1 a6db6be48967f658cf422398cf0ac2af [0,1,0,0,0,1|1,0,0]=3 1535 B12R1.27 C[C@@H](CO)CNc1cnccn1 b34ebd6399cbc236ef2ab5ac79900198 [0,1,0,0,0,1|1,0,0]=3 1536 B12R1.27 C[C@@H](CO)CNc1cncnc1 f7b57f8d63359c7bfa45b0eb0355141f [0,1,0,0,0,1|1,0,0]=3 1537 B12R1.27 C[C@@H](CO)CNc1cnncn1 ce5b9079878930fa9d0bd1703e79eed4 [0,1,0,0,0,1|2,0,0]=4 1538 B12R1.27 C[C@@H](CO)CNc1nccnn1 44679a6048e67aae5032c61f6eb201d5 [0,1,0,0,0,1|2,0,0]=4 1539 B12R1.27 C[C@@H](CO)NCc1ccccc1 a52866c987a35d6e1a5b62fda8afddea [0,1,0,0,0,1|1,0,0]=3 1540 B12R1.27 C[C@@H](CO)NCc1ccccn1 24b346e5ac8cec24f6566fe18f21e557 [0,1,0,0,0,1|2,0,0]=4 1541 B12R1.27 C[C@@H](CO)NCc1cccnc1 c05978b6b00adbcee4f88cca44b079ed [0,1,0,0,0,1|0,0,0]=2 1542 B12R1.27 C[C@@H](CO)NCc1cccnn1 05a1dc5c207ae3eee6144f6e1c657205 [0,1,0,0,0,1|1,0,0]=3 1543 B12R1.27 C[C@@H](CO)NCc1ccncc1 5b07b762d221cbddc1d819cacc34979c [0,1,0,0,0,1|2,0,0]=4 1544 B12R1.27 C[C@@H](CO)NCc1ccnnc1 602b58db0892c99d23481e8ecf4bc7eb [0,1,0,0,0,1|1,0,0]=3 1545 B12R1.27 C[C@@H](CO)NCc1cnccn1 848c1433beb181bd59c54d3b96b16fa8 [0,1,0,0,0,1|1,0,0]=3 1546 B12R1.27 C[C@@H](CO)NCc1cncnc1 7062307e6488c38c00784838f500b75b [0,1,0,0,0,1|1,0,0]=3 1547 B12R1.27 C[C@H](C=O)NCc1ccccc1 645b627cd889138b5240bcb1ce686b72 [0,1,0,0,0,1|1,0,1]=4 1548 B12R1.27 C[C@H](C=O)NCc1cccnc1 47cfbb35f7e7c7b0499ef97765177bd2 [0,1,0,0,0,1|0,0,1]=3 1549 B12R1.27 C[C@H](C=O)NCc1cccnn1 657071ba38b6ea55f45a9b75d84e4c25 [0,1,0,0,0,1|1,0,1]=4 1550 B12R1.27 C[C@H](C=O)NCc1ccnnc1 30bbe09a0e1bf762a9f45548cdf600ee [0,1,0,0,0,1|1,0,1]=4 1551 B12R1.27 C[C@H](C=O)NCc1cnccn1 00a48b8902f9721f5a3d11f6dee664fc [0,1,0,0,0,1|1,0,1]=4 1552 B12R1.27 C[C@H](C=O)NCc1cncnc1 01df7ca352bd706abbb7ccfad7fc8a21 [0,1,0,0,0,1|1,0,1]=4 1553 B12R1.27 C[C@H](C=O)OCc1ccccc1 d71860644cbe1541da13b3966902f7f7 [0,1,0,0,0,1|1,0,1]=4 1554 B12R1.27 C[C@H](C=O)OCc1cccnc1 56d6eb81a4dd63eb667314ef58479328 [0,1,0,0,0,1|0,0,1]=3 1555 B12R1.27 C[C@H](C=O)OCc1cccnn1 65266623877ef171e93c3c92f1781a12 [0,1,0,0,0,1|1,0,1]=4 1556 B12R1.27 C[C@H](C=O)OCc1ccnnc1 94e75e6c1ab8851d21e971f511695336 [0,1,0,0,0,1|1,0,1]=4 1557 B12R1.27 C[C@H](C=O)OCc1cnccn1 a1de2c21d85cbf557f40a4ba5e6a0c0d [0,1,0,0,0,1|1,0,1]=4 1558 B12R1.27 C[C@H](C=O)OCc1cncnc1 419007f6b3ca08c358af5b7dc07b657a [0,1,0,0,0,1|1,0,1]=4 1559 B12R1.27 C[C@H](CO)CNc1ccccc1 de01f7c1f1d3b008ec664fad35110bba [0,1,0,0,0,1|1,0,0]=3 1560 B12R1.27 C[C@H](CO)CNc1ccccn1 e822e956d48a344afeb617359365dcfb [0,1,0,0,0,1|2,0,0]=4 1561 B12R1.27 C[C@H](CO)CNc1cccnc1 27ef93a68bfc032deefa13733949bda2 [0,1,0,0,0,1|0,0,0]=2 1562 B12R1.27 C[C@H](CO)CNc1cccnn1 560938529d62da9a8aac673de498ec01 [0,1,0,0,0,1|1,0,0]=3 1563 B12R1.27 C[C@H](CO)CNc1ccncc1 4fd9d26d176ae9102178ddd2e18bcf70 [0,1,0,0,0,1|2,0,0]=4 1564 B12R1.27 C[C@H](CO)CNc1ccnnc1 8de1988db6879a452006eab050105901 [0,1,0,0,0,1|1,0,0]=3 1565 B12R1.27 C[C@H](CO)CNc1cnccn1 de693ece84470b212343000297ad249f [0,1,0,0,0,1|1,0,0]=3 1566 B12R1.27 C[C@H](CO)CNc1cncnc1 f499f8ec27d7f7988221cad8c244b04a [0,1,0,0,0,1|1,0,0]=3 1567 B12R1.27 C[C@H](CO)CNc1cnncn1 98b2d21e8bfaa474c3a894782abfb70f [0,1,0,0,0,1|2,0,0]=4 1568 B12R1.27 C[C@H](CO)CNc1nccnn1 193d5b8ecca065c23ac52a80442960ab [0,1,0,0,0,1|2,0,0]=4 1569 B12R1.27 C[C@H](CO)NCc1ccccc1 6eed9f4ff81e8b8226b9282b8f3ad13f [0,1,0,0,0,1|1,0,0]=3 1570 B12R1.27 C[C@H](CO)NCc1ccccn1 f876cbcb18ab33a44cd48067a6e0c620 [0,1,0,0,0,1|2,0,0]=4 1571 B12R1.27 C[C@H](CO)NCc1cccnc1 21544267eb570ab70ec823c251a550b0 [0,1,0,0,0,1|0,0,0]=2 1572 B12R1.27 C[C@H](CO)NCc1cccnn1 1a2bd735b97b66ca6ea47e333ae5c2c6 [0,1,0,0,0,1|1,0,0]=3 1573 B12R1.27 C[C@H](CO)NCc1ccncc1 7dbeacc2c2607a95fa1f0ce20b03a078 [0,1,0,0,0,1|2,0,0]=4 1574 B12R1.27 C[C@H](CO)NCc1ccnnc1 74241780e18870a69ac7c87826b5a58a [0,1,0,0,0,1|1,0,0]=3 1575 B12R1.27 C[C@H](CO)NCc1cnccn1 aa92059eda1f440fdfb5e1dbb18875a2 [0,1,0,0,0,1|1,0,0]=3 1576 B12R1.27 C[C@H](CO)NCc1cncnc1 8e45c1650fb11b8b52cada27361a54d9 [0,1,0,0,0,1|1,0,0]=3 1577 B12R1.27 C[C@H](CS)OCc1ccccc1 76a62ad706fe4942b152f21141bdace8 [0,1,0,0,0,1|1,0,0]=3 1578 B12R1.27 C[C@H](CS)OCc1ccccn1 bfa2f3c46950c58e36e3009f57740457 [0,1,0,0,0,1|2,0,0]=4 1579 B12R1.27 C[C@H](CS)OCc1cccnc1 ac5d95777938b777033779188a5a5b0a [0,1,0,0,0,1|0,0,0]=2 1580 B12R1.27 C[C@H](CS)OCc1cccnn1 ed596dc0487d88f9c4050fab00936dd6 [0,1,0,0,0,1|1,0,0]=3 1581 B12R1.27 C[C@H](CS)OCc1cncnc1 27466e64ef4bd3a766e0a36ea2722f43 [0,1,0,0,0,1|1,0,0]=3 1582 B12R1.27 N#CC(F)NCc1cccnc1 6a7b2c650d7c635340178a595dd1532a [0,1,0,0,0,1|1,0,1]=4 1583 B12R1.27 O=C(CF)NCc1cccnc1 55aee9f781bad42df720fff04950da75 [0,1,0,0,0,1|1,0,1]=4 1584 B12R1.27 O=C(CO)CNc1cccnc1 2c6f296e217cf230fda521b9de841c22 [0,1,0,0,0,1|1,0,1]=4 1585 B12R1.27 O=C(CO)NCc1cccnc1 accc53643db8ccf06656b79e4c302034 [0,1,0,0,0,1|1,0,1]=4 1586 B12R1.27 O=C(CS)NCc1cccnc1 5a5dc7c7f2b3649e173a6d2509493bc1 [0,1,0,0,0,1|1,0,1]=4 1587 B12R1.27 OC(CF)CNc1ccccc1 e518893c8dbaaac7e0289d266d42fc20 [0,1,0,0,0,1|2,0,0]=4 1588 B12R1.27 OC(CF)CNc1cccnc1 d4c1cc0570898fb9377efaef5e2305e5 [0,1,0,0,0,1|1,0,0]=3 1589 B12R1.27 OC(CF)CNc1cccnn1 29f1003d9f08ef42ebf9fbe7bc31121a [0,1,0,0,0,1|2,0,0]=4 1590 B12R1.27 OC(CF)CNc1ccnnc1 fa10282c8783ec42b25f89ded8112a84 [0,1,0,0,0,1|2,0,0]=4 1591 B12R1.27 OC(CF)CNc1cnccn1 ee6cb5aa7b22cf43e37825f709173987 [0,1,0,0,0,1|2,0,0]=4 1592 B12R1.27 OC(CF)CNc1cncnc1 4c7efbb3f256465736ae79d2f2a05dcc [0,1,0,0,0,1|2,0,0]=4 1593 B12R1.27 OCC(F)CNc1ccccc1 12f6637854cd5607d7beeb33d98c9d66 [0,1,0,0,0,1|2,0,0]=4 1594 B12R1.27 OCC(F)CNc1cccnc1 15292281630b121a7c03a4f02b41c1f1 [0,1,0,0,0,1|1,0,0]=3 1595 B12R1.27 OCC(F)CNc1cccnn1 3206d2a2e5405671183d9fbae6b6f869 [0,1,0,0,0,1|2,0,0]=4 1596 B12R1.27 OCC(F)CNc1ccnnc1 778659f5a32d49b90f52e287a00e863d [0,1,0,0,0,1|2,0,0]=4 1597 B12R1.27 OCC(F)CNc1cnccn1 afb9dfd6639eb50d2d5ff1a29359175d [0,1,0,0,0,1|2,0,0]=4 1598 B12R1.27 OCC(O)CNc1ccccc1 2c98ea52c81c0230088b12196d6eb24a [0,1,0,0,0,1|2,0,0]=4 1599 B12R1.27 OCC(O)CNc1cccnc1 1b47ebf45ca013920823a1b9e2030f55 [0,1,0,0,0,1|1,0,0]=3 1600 B12R1.27 OCC(O)CNc1cccnn1 c37660606513696fffd56ba0becf4339 [0,1,0,0,0,1|2,0,0]=4 1601 B12R1.27 OCC(O)CNc1ccnnc1 32360f9a05f168d3d26cfbec11317622 [0,1,0,0,0,1|2,0,0]=4 1602 B12R1.27 OCC(O)CNc1cnccn1 38f4f717546be1a1edb1cb90ca085d60 [0,1,0,0,0,1|2,0,0]=4 1603 B12R1.27 OCC(O)CNc1cncnc1 8dad7ccc42d9ab0ac0019baeaf4da201 [0,1,0,0,0,1|2,0,0]=4 1604 B12R1.27 OCC(O)COc1cccnc1 16ebbab500126aa2ce0f1a83627b97a0 [0,1,0,0,0,1|1,0,0]=3 1605 B12R1.27 OCC(O)COc1ccnnc1 cf0397c1ca36c85913dbb6935af38a04 [0,1,0,0,0,1|2,0,0]=4 1606 B12R1.27 OCC(O)COc1cnccn1 11df0c63b0f6b4d8bd464a325e4a7069 [0,1,0,0,0,1|2,0,0]=4 1607 B12R1.27 OCC(O)COc1cncnc1 bf36ce90ecbc962c27719fe389906c71 [0,1,0,0,0,1|2,0,0]=4 1608 B12R1.27 OC[C@@H](F)CNc1ccccc1 df0a72159854bbc7d14ee531e659ec9c [0,1,0,0,0,1|2,0,0]=4 1609 B12R1.27 OC[C@@H](F)CNc1cccnc1 27174b986a871a35ff2a2528d99fe670 [0,1,0,0,0,1|1,0,0]=3 1610 B12R1.27 OC[C@@H](F)CNc1cccnn1 c59c212ecfe4a38d71370a6090a4c76b [0,1,0,0,0,1|2,0,0]=4 1611 B12R1.27 OC[C@@H](F)CNc1ccnnc1 7999d111eb264b6e07703d2f25744d98 [0,1,0,0,0,1|2,0,0]=4 1612 B12R1.27 OC[C@@H](F)CNc1cnccn1 908a6074f6ae5123691476cafb870574 [0,1,0,0,0,1|2,0,0]=4 1613 B12R1.27 OC[C@@H](O)CNc1ccccc1 d5ed593b781b051c17ac5c0f665c9b28 [0,1,0,0,0,1|2,0,0]=4 1614 B12R1.27 OC[C@@H](O)CNc1cccnc1 8c575336f8c6d4fe624442e780d70b20 [0,1,0,0,0,1|1,0,0]=3 1615 B12R1.27 OC[C@@H](O)CNc1cccnn1 58a3e678159e6534b8b3409e8c95293a [0,1,0,0,0,1|2,0,0]=4 1616 B12R1.27 OC[C@@H](O)CNc1ccnnc1 acb1c01bc9eb17a8a3fcbee3135f100f [0,1,0,0,0,1|2,0,0]=4 1617 B12R1.27 OC[C@@H](O)CNc1cnccn1 7407429709e17e3ed0b8a23970e73740 [0,1,0,0,0,1|2,0,0]=4 1618 B12R1.27 OC[C@@H](O)CNc1cncnc1 194f45f86576854268b66d8b98ccefef [0,1,0,0,0,1|2,0,0]=4 1619 B12R1.27 OC[C@@H](O)COc1cccnc1 67d57f427db75d1af6a0440a66710d9f [0,1,0,0,0,1|1,0,0]=3 1620 B12R1.27 OC[C@@H](O)COc1ccnnc1 765093cc1e790d6c8ddeca68a451daca [0,1,0,0,0,1|2,0,0]=4 1621 B12R1.27 OC[C@@H](O)COc1cnccn1 0eed07766913688fb589489d701afc2f [0,1,0,0,0,1|2,0,0]=4 1622 B12R1.27 OC[C@@H](O)COc1cncnc1 202f6dbc78ec2ff0e3b381ae227e6fe3 [0,1,0,0,0,1|2,0,0]=4 1623 B12R1.27 OC[C@H](F)CNc1ccccc1 9734eac13b001b84d3ee28ab012b0276 [0,1,0,0,0,1|2,0,0]=4 1624 B12R1.27 OC[C@H](F)CNc1cccnc1 4b4d10ed0c8ade13b1cf2e37b68a476b [0,1,0,0,0,1|1,0,0]=3 1625 B12R1.27 OC[C@H](F)CNc1cccnn1 629ab3e247071759d1dae6b893a9e5b7 [0,1,0,0,0,1|2,0,0]=4 1626 B12R1.27 OC[C@H](F)CNc1ccnnc1 320d6b233d32ff5b7626549ede1b5b77 [0,1,0,0,0,1|2,0,0]=4 1627 B12R1.27 OC[C@H](F)CNc1cnccn1 d3061d41a310308078c944c00d350274 [0,1,0,0,0,1|2,0,0]=4 1628 B12R1.27 OC[C@H](O)CNc1ccccc1 4df6835ea35fcadc1546d95d2a23469d [0,1,0,0,0,1|2,0,0]=4 1629 B12R1.27 OC[C@H](O)CNc1cccnc1 f403b2d413b3dfc5460a701b3f32906f [0,1,0,0,0,1|1,0,0]=3 1630 B12R1.27 OC[C@H](O)CNc1cccnn1 087448f1183ed7f43bb3b961de8ba49d [0,1,0,0,0,1|2,0,0]=4 1631 B12R1.27 OC[C@H](O)CNc1ccnnc1 0d2b84acb37073cd849272b6d1955d3f [0,1,0,0,0,1|2,0,0]=4 1632 B12R1.27 OC[C@H](O)CNc1cnccn1 ee79647d0d893b6c2e8e16a89ef61985 [0,1,0,0,0,1|2,0,0]=4 1633 B12R1.27 OC[C@H](O)CNc1cncnc1 e539fd22c8ae62559eaa8fbad559d609 [0,1,0,0,0,1|2,0,0]=4 1634 B12R1.27 OC[C@H](O)COc1cccnc1 2642a621d8fa510d1c90c0e4fdb0b054 [0,1,0,0,0,1|1,0,0]=3 1635 B12R1.27 OC[C@H](O)COc1ccnnc1 666300e94135e6a4b7f5ad0aa796298e [0,1,0,0,0,1|2,0,0]=4 1636 B12R1.27 OC[C@H](O)COc1cnccn1 f148bf1e896930240548bc4612b4a608 [0,1,0,0,0,1|2,0,0]=4 1637 B12R1.27 OC[C@H](O)COc1cncnc1 ce721f5fd4bf850299ea6d479f05c805 [0,1,0,0,0,1|2,0,0]=4 1638 B12R1.43 CC(=O)C(C)Nc1cccnc1 3d27b1337cf87a2e303ecaa21680f482 [0,1,0,0,0,1|1,0,1]=4 1639 B12R1.43 CC(=O)C(C)Oc1cccnc1 d1f1a212071c4449516b5cfa8f21cb1c [0,1,0,0,0,1|1,0,1]=4 1640 B12R1.43 CC(=O)N(C)Cc1cccnc1 68d654439a46d431d82ead819a36e573 [0,1,0,0,0,1|1,0,1]=4 1641 B12R1.43 CC(C)C(C)Nc1ccccc1 48093fab6ce2f9bea5eaf7557d6a555a [0,1,0,0,0,1|1,0,0]=3 1642 B12R1.43 CC(C)C(C)Nc1ccccn1 56417f300787c21b824e0c0aa0c41aee [0,1,0,0,0,1|2,0,0]=4 1643 B12R1.43 CC(C)C(C)Nc1cccnc1 d9c105ac720d93c173804a1a7215f55a [0,1,0,0,0,1|0,0,0]=2 1644 B12R1.43 CC(C)C(C)Nc1cccnn1 0a469f37b5444077b8692f36de1c05b8 [0,1,0,0,0,1|1,0,0]=3 1645 B12R1.43 CC(C)C(C)Nc1ccncc1 f569432198f25ecd4f5fab536aa2585a [0,1,0,0,0,1|2,0,0]=4 1646 B12R1.43 CC(C)C(C)Nc1ccnnc1 9a0ebb0ca9a19f398ab26a2ed85f0e14 [0,1,0,0,0,1|1,0,0]=3 1647 B12R1.43 CC(C)C(C)Nc1cnccn1 b5f607b374481fe7f7c596bdd3172c1b [0,1,0,0,0,1|1,0,0]=3 1648 B12R1.43 CC(C)C(C)Nc1cncnc1 fb46b922f99d7228fa2f2cc8dc8f6320 [0,1,0,0,0,1|1,0,0]=3 1649 B12R1.43 CC(C)C(C)Nc1cnncn1 7a7f61f70c037eaec193b34068d50f7b [0,1,0,0,0,1|2,0,0]=4 1650 B12R1.43 CC(C)C(C)Nc1nccnn1 4c6d154f03e634e1b07c5ebef5d5585b [0,1,0,0,0,1|2,0,0]=4 1651 B12R1.43 CC(C)C(C)Oc1ccccn1 0d1f1b8bafc8f4ae0cafc9a3a285e8fd [0,1,0,0,0,1|2,0,0]=4 1652 B12R1.43 CC(C)C(C)Oc1cccnc1 7dd98d846884613a0fa0dacf726d609e [0,1,0,0,0,1|0,0,0]=2 1653 B12R1.43 CC(C)C(C)Oc1ccncc1 e9f09d2447e1596ae903cb10648aeae2 [0,1,0,0,0,1|2,0,0]=4 1654 B12R1.43 CC(C)C(C)Oc1ccnnc1 7670e7c290ffe9092658d26a57808e26 [0,1,0,0,0,1|1,0,0]=3 1655 B12R1.43 CC(C)C(C)Oc1cnccn1 f783fc9cd6692dcbaa9e73f9e16f312b [0,1,0,0,0,1|1,0,0]=3 1656 B12R1.43 CC(C)N(C)Cc1ccccc1 d5edd43e495581ab07d4c878cf7efc6a [0,1,0,0,0,1|1,0,0]=3 1657 B12R1.43 CC(C)N(C)Cc1ccccn1 1f5d3f68b51d0d1177f99817ac8f4046 [0,1,0,0,0,1|2,0,0]=4 1658 B12R1.43 CC(C)N(C)Cc1cccnc1 1e873a4fbb2a3d762374aea8e87346b5 [0,1,0,0,0,1|0,0,0]=2 1659 B12R1.43 CC(C)N(C)Cc1cccnn1 56b270dc77c53b384e585bf122092d3b [0,1,0,0,0,1|1,0,0]=3 1660 B12R1.43 CC(C)N(C)Cc1ccncc1 46734e331886f41f4f5306fbbfbe60e0 [0,1,0,0,0,1|2,0,0]=4 1661 B12R1.43 CC(C)N(C)Cc1ccnnc1 8d91952028bedc4c9720cd70a8d0575c [0,1,0,0,0,1|1,0,0]=3 1662 B12R1.43 CC(C)N(C)Cc1cnccn1 b2491d397acf9864492335ec9ed2ee8b [0,1,0,0,0,1|1,0,0]=3 1663 B12R1.43 CC(C)N(C)Cc1cncnc1 c55fe74299f4ee111d827e97914ac8eb [0,1,0,0,0,1|1,0,0]=3 1664 B12R1.43 CC(C)[C@@H](C)Nc1ccccc1 638de983f09ad8573a19e829866f679b [0,1,0,0,0,1|1,0,0]=3 1665 B12R1.43 CC(C)[C@@H](C)Nc1cccnc1 8cc5cb560100920359a30d0b936931d0 [0,1,0,0,0,1|0,0,0]=2 1666 B12R1.43 CC(C)[C@H](C)Nc1ccccc1 37a4cc2968d8598e2dd44bb0f3ee65d4 [0,1,0,0,0,1|1,0,0]=3 1667 B12R1.43 CC(C)[C@H](C)Nc1cccnc1 a0486500948362bfb0f4d9c857b8c881 [0,1,0,0,0,1|0,0,0]=2 1668 B12R1.43 CC(F)C(=O)Nc1cccnc1 8e06904db02f28f8551a4c62cdb0567e [0,1,0,0,0,1|1,0,1]=4 1669 B12R1.43 CC(O)C(=O)Nc1cccnc1 a6d8461b9d4871e9e14a4c125c563fab [0,1,0,0,0,1|1,0,1]=4 1670 B12R1.43 CC(O)C(C)Nc1ccccc1 807016486516eda629177f9c4eb1e753 [0,1,0,0,0,1|2,0,0]=4 1671 B12R1.43 CC(O)C(C)Nc1cccnc1 16f61952065d032141860c15b03f12c0 [0,1,0,0,0,1|1,0,0]=3 1672 B12R1.43 CC(S)C(=O)Nc1cccnc1 b6b76bef58796b77c7a1a29b3613d6b6 [0,1,0,0,0,1|1,0,1]=4 1673 B12R1.43 C[C@@H](F)C(=O)Nc1cccnc1 b1353115539c393aa2db2fafcea74748 [0,1,0,0,0,1|1,0,1]=4 1674 B12R1.43 C[C@@H](Nc1cccnc1)C(F)F 9f055549f7a1b8602a4aa87678ade496 [0,1,0,0,0,1|2,0,0]=4 1675 B12R1.43 C[C@@H](O)C(=O)Nc1cccnc1 1f46b38a6f9fc93718ab3b927f346130 [0,1,0,0,0,1|1,0,1]=4 1676 B12R1.43 C[C@H](F)C(=O)Nc1cccnc1 83b362882ee5612e2ec945e60b0e5b9c [0,1,0,0,0,1|1,0,1]=4 1677 B12R1.43 C[C@H](Nc1cccnc1)C(F)F 634e78ba16a8b1f2eb21096e468bb1d8 [0,1,0,0,0,1|2,0,0]=4 1678 B12R1.43 C[C@H](O)C(=O)Nc1cccnc1 ec61428d6808a30af6e5a1bbccc688ed [0,1,0,0,0,1|1,0,1]=4 1679 B12R1.107 C=C(C)CN(C)c1cccnc1 e50c7afa90f0bf64a70584d26164e186 [0,1,0,0,0,1|0,0,2]=4 1680 B12R1.107 CC(=O)NC(C)c1cccnc1 bd3e42a6def30cb8723774fd29dfd160 [0,1,0,0,0,1|1,0,1]=4 1681 B12R1.107 CC(=O)N[C@@H](C)c1cccnc1 053abbdf2a9a3a050db980212be86e97 [0,1,0,0,0,1|1,0,1]=4 1682 B12R1.107 CC(=O)N[C@H](C)c1cccnc1 6f5e2b5e5c3e848b6c8230b33688a8e9 [0,1,0,0,0,1|1,0,1]=4 1683 B12R1.107 CC(C)CN(C)c1ccccc1 95fef0ba310b862ee7742e989aa00371 [0,1,0,0,0,1|1,0,0]=3 1684 B12R1.107 CC(C)CN(C)c1ccccn1 8902d7360de5bdf38f8ffbb3d266f9d8 [0,1,0,0,0,1|2,0,0]=4 1685 B12R1.107 CC(C)CN(C)c1cccnc1 a80b388d9409df9822a700b6b9414c72 [0,1,0,0,0,1|0,0,0]=2 1686 B12R1.107 CC(C)CN(C)c1cccnn1 f9c00f6f7f31a5b889a8a3c14d4b2b89 [0,1,0,0,0,1|1,0,0]=3 1687 B12R1.107 CC(C)CN(C)c1ccncc1 190e4353355d3998c1470756e6537d1f [0,1,0,0,0,1|2,0,0]=4 1688 B12R1.107 CC(C)CN(C)c1ccnnc1 3439d27c002bf146846f824c70d2db32 [0,1,0,0,0,1|1,0,0]=3 1689 B12R1.107 CC(C)CN(C)c1cnccn1 5feafdf4bd62bccb51c88ca1c5c90660 [0,1,0,0,0,1|1,0,0]=3 1690 B12R1.107 CC(C)CN(C)c1nccnn1 499daacb7cfc21f82c0a393bb86838c8 [0,1,0,0,0,1|2,0,0]=4 1691 B12R1.107 CC(C)NC(C)c1ccccn1 7a8a49744ff2dc697705e105a4d29b31 [0,1,0,0,0,1|2,0,0]=4 1692 B12R1.107 CC(C)NC(C)c1cccnc1 f83045cb9bb475cbbd0d72c753be3dbb [0,1,0,0,0,1|0,0,0]=2 1693 B12R1.107 CC(C)NC(C)c1cccnn1 26293dd49f70df18d847319875299dbd [0,1,0,0,0,1|1,0,0]=3 1694 B12R1.107 CC(C)NC(C)c1ccncc1 4565af1a01c9e3a5c5433e3411958097 [0,1,0,0,0,1|2,0,0]=4 1695 B12R1.107 CC(C)NC(C)c1ccnnc1 475e52aa855dc49f4a73dbb8df1a24c0 [0,1,0,0,0,1|1,0,0]=3 1696 B12R1.107 CC(C)NC(C)c1cnccn1 84a7f59b7fa5379e0f7e834f97b5b6f2 [0,1,0,0,0,1|1,0,0]=3 1697 B12R1.107 CC(C)NC(C)c1cncnc1 8496c8424c2b1fc47af5a5810ad22763 [0,1,0,0,0,1|1,0,0]=3 1698 B12R1.107 CC(C)N[C@@H](C)c1ccccn1 5a8182a5c2834a1b8d14a1d525ca73eb [0,1,0,0,0,1|2,0,0]=4 1699 B12R1.107 CC(C)N[C@@H](C)c1cccnc1 bba252309d650ecc30069f3dddd1b105 [0,1,0,0,0,1|0,0,0]=2 1700 B12R1.107 CC(C)N[C@@H](C)c1ccncc1 775d0cb56d3dd6bc4738e2685aee9f6a [0,1,0,0,0,1|2,0,0]=4 1701 B12R1.107 CC(C)N[C@@H](C)c1cncnc1 7f9d564822cff27b866047c1aa71c76c [0,1,0,0,0,1|1,0,0]=3 1702 B12R1.107 CC(C)N[C@H](C)c1ccccn1 8a594a7c5da3e31c163d1068dcac9471 [0,1,0,0,0,1|2,0,0]=4 1703 B12R1.107 CC(C)N[C@H](C)c1cccnc1 ce94c3a37523dd9db9b3b4f768ea9506 [0,1,0,0,0,1|0,0,0]=2 1704 B12R1.107 CC(C)N[C@H](C)c1ccncc1 a8f7ac5675fa91c5d895f344e2b2bc66 [0,1,0,0,0,1|2,0,0]=4 1705 B12R1.107 CC(C)N[C@H](C)c1cncnc1 36a595fba2f40eee623f7ff68e11ad71 [0,1,0,0,0,1|1,0,0]=3 1706 B12R1.107 CC(C)OC(C)c1ccccc1 c88937e1bba3e11ca71331a692d3263d [0,1,0,0,0,1|1,0,0]=3 1707 B12R1.107 CC(C)OC(C)c1ccccn1 e36bdb169f8c2820d6238217cf2c0c9b [0,1,0,0,0,1|2,0,0]=4 1708 B12R1.107 CC(C)OC(C)c1cccnc1 a720356d264ae2e2bd94268a34af0246 [0,1,0,0,0,1|0,0,0]=2 1709 B12R1.107 CC(C)OC(C)c1cccnn1 b9a675cb0413e62ea73a2fc61b472f4c [0,1,0,0,0,1|1,0,0]=3 1710 B12R1.107 CC(C)OC(C)c1ccncc1 dff8cce62d02c112ddba22a89b06b30b [0,1,0,0,0,1|2,0,0]=4 1711 B12R1.107 CC(C)OC(C)c1cnccn1 49dbbb014eb1d6d6604592a692551887 [0,1,0,0,0,1|1,0,0]=3 1712 B12R1.107 CC(C)O[C@@H](C)c1ccccc1 cd312c9ad337f3d7e7cf959a697dd297 [0,1,0,0,0,1|1,0,0]=3 1713 B12R1.107 CC(C)O[C@@H](C)c1ccccn1 6a258a3944fb55be34cbeaa329643f08 [0,1,0,0,0,1|2,0,0]=4 1714 B12R1.107 CC(C)O[C@@H](C)c1cccnc1 e078965ffd7282aede11459af9dd81de [0,1,0,0,0,1|0,0,0]=2 1715 B12R1.107 CC(C)O[C@@H](C)c1ccncc1 a72003c25fd185808d9c1b428a24fd38 [0,1,0,0,0,1|2,0,0]=4 1716 B12R1.107 CC(C)O[C@@H](C)c1cnccn1 009a5e07c5407526fe204e5b95c47bc3 [0,1,0,0,0,1|1,0,0]=3 1717 B12R1.107 CC(C)O[C@H](C)c1ccccc1 b2ce62b73f9b987a3fea9afe8162e394 [0,1,0,0,0,1|1,0,0]=3 1718 B12R1.107 CC(C)O[C@H](C)c1ccccn1 328ee8bf306075f10d7c4472fab39f5c [0,1,0,0,0,1|2,0,0]=4 1719 B12R1.107 CC(C)O[C@H](C)c1cccnc1 8b46fac7478602a39d5771164fd44ea8 [0,1,0,0,0,1|0,0,0]=2 1720 B12R1.107 CC(C)O[C@H](C)c1cccnn1 258869d92b5c7432895492f62b948e1d [0,1,0,0,0,1|1,0,0]=3 1721 B12R1.107 CC(C)O[C@H](C)c1ccncc1 0ca354191167bd77b68c3f542b91cfff [0,1,0,0,0,1|2,0,0]=4 1722 B12R1.107 CC(C)O[C@H](C)c1cnccn1 9a9e1989e4a9739b76eb56e3ea916435 [0,1,0,0,0,1|1,0,0]=3 1723 B12R1.107 CC(O)CN(C)c1ccccc1 f96f86be852a8f681918c1e7f925b14c [0,1,0,0,0,1|2,0,0]=4 1724 B12R1.107 CC(O)CN(C)c1cccnc1 d715257cc205a3ad1ba2a7c44829d24d [0,1,0,0,0,1|1,0,0]=3 1725 B12R1.107 CC(O)CN(C)c1cccnn1 1c322cd267a516fbadcd110637f977e6 [0,1,0,0,0,1|2,0,0]=4 1726 B12R1.107 CC(O)CN(C)c1ccnnc1 f44b90e814259fc1e28b3523e5113fa9 [0,1,0,0,0,1|2,0,0]=4 1727 B12R1.107 CC(O)CN(C)c1cnccn1 0c5963eca3b43b7dbe63fc25f7d89dfb [0,1,0,0,0,1|2,0,0]=4 1728 B12R1.107 CN(C)CN(C)c1cccnc1 17000ec11c79f4e844f611d67c0b548d [0,1,0,0,0,1|1,0,0]=3 1729 B12R1.107 CN(C)CN(C)c1ccnnc1 ad83de29e07af3febb46fcdac7a00318 [0,1,0,0,0,1|2,0,0]=4 1730 B12R1.107 CN(C)CN(C)c1cnccn1 8ca0bdcec584bedf935db872bad4aa03 [0,1,0,0,0,1|2,0,0]=4 1731 B12R1.107 CN(CC(F)F)c1cccnc1 eaa0c7a9af9a6e265b004114949cfd1d [0,1,0,0,0,1|2,0,0]=4 1732 B12R1.107 C[C@H](O)CN(C)c1ccccc1 623c379093f4d5c87dbfc7a6a5452bce [0,1,0,0,0,1|2,0,0]=4 1733 B12R1.107 C[C@H](O)CN(C)c1cccnc1 7e2d3b3bc5bbd8f2620cee39b367bf51 [0,1,0,0,0,1|1,0,0]=3 1734 B12R1.107 C[C@H](O)CN(C)c1cccnn1 30d1677c9624272e2ac32f5aadc53724 [0,1,0,0,0,1|2,0,0]=4 1735 B12R1.107 C[C@H](O)CN(C)c1ccnnc1 2d2aa89216503e25b21f18f322770b32 [0,1,0,0,0,1|2,0,0]=4 1736 B12R1.107 C[C@H](O)CN(C)c1cnccn1 e7140e82e0ba3da361ffbb30c9119f91 [0,1,0,0,0,1|2,0,0]=4 1737 B12R1.125 C=C(C)CNc1cccnc1Br 5f715880a7b331fa44940eaf305d88fc [0,1,0,0,0,1|0,0,2]=4 1738 B12R1.125 C=C(C)CNc1cccnc1C 8d8e91bb9e97248f603268bbfb486af3 [0,1,0,0,0,1|0,0,2]=4 1739 B12R1.125 C=C(C)CNc1cccnc1Cl f82c6b83d7109b0b9a3cf8f6ec4c55c4 [0,1,0,0,0,1|0,0,2]=4 1740 B12R1.125 C=C(C)CNc1cccnc1F 0fadac8ec6b45b3ea6652ff2f551faa9 [0,1,0,0,0,1|0,0,2]=4 1741 B12R1.125 C=C(C)CNc1cccnc1I ea02542acf6d04c090032ec836def10c [0,1,0,0,0,1|0,0,2]=4 1742 B12R1.125 C=C(C)CNc1cnccc1Br affb35af05d62465835ede268855f127 [0,1,0,0,0,1|0,0,2]=4 1743 B12R1.125 C=C(C)CNc1cnccc1C c215b8529a1ec595be14cdc00e3e9c75 [0,1,0,0,0,1|0,0,2]=4 1744 B12R1.125 C=C(C)CNc1cnccc1Cl 5a7d16f79692239b71034d7b1a03b939 [0,1,0,0,0,1|0,0,2]=4 1745 B12R1.125 C=C(C)CNc1cnccc1F 0def50b9bd5f9f634e10ffec7ca52482 [0,1,0,0,0,1|0,0,2]=4 1746 B12R1.125 C=C(C)CNc1cnccc1I 10e740ea811bab386dcb557a6126d58f [0,1,0,0,0,1|0,0,2]=4 1747 B12R1.125 C=C(C)COc1cccnc1Br 6ef003f0ec03c4f8595a581086973830 [0,1,0,0,0,1|0,0,2]=4 1748 B12R1.125 C=C(C)COc1cccnc1C c1129f53f45acd0e6c2f2ba5543bc999 [0,1,0,0,0,1|0,0,2]=4 1749 B12R1.125 C=C(C)COc1cccnc1Cl 1f687ae65825be21ecc8e2ab7da86f7e [0,1,0,0,0,1|0,0,2]=4 1750 B12R1.125 C=C(C)COc1cccnc1F cfc3c11692f78cc1e9554ee91539a4aa [0,1,0,0,0,1|0,0,2]=4 1751 B12R1.125 C=C(C)COc1cccnc1I 3d081f92d44d55235555ce73490d9418 [0,1,0,0,0,1|0,0,2]=4 1752 B12R1.125 C=C(C)COc1cnccc1Br d9174fb5f313eb578d3e8eed5f4d9f91 [0,1,0,0,0,1|0,0,2]=4 1753 B12R1.125 C=C(C)COc1cnccc1C 79c65f44b317c25843e86a0c532f6475 [0,1,0,0,0,1|0,0,2]=4 1754 B12R1.125 C=C(C)COc1cnccc1Cl 4e5ebbb8f9fca046196f523f90787174 [0,1,0,0,0,1|0,0,2]=4 1755 B12R1.125 C=C(C)COc1cnccc1F f5d00e365b65243e4bb71c4a945e49ed [0,1,0,0,0,1|0,0,2]=4 1756 B12R1.125 C=C(C)COc1cnccc1I 804914bfef30820374cdd146cc426610 [0,1,0,0,0,1|0,0,2]=4 1757 B12R1.125 CC(=O)CNc1cccnc1S c348971cb8a885ae3653005661e2c515 [0,1,0,0,0,1|1,0,1]=4 1758 B12R1.125 CC(=O)CNc1cnccc1C 84479f65b78e69bba41540a17f93e08c [0,1,0,0,0,1|1,0,1]=4 1759 B12R1.125 CC(=O)CNc1cnccc1F 5c8df6dbf1541c5a46cc31528751e049 [0,1,0,0,0,1|1,0,1]=4 1760 B12R1.125 CC(=O)NCc1cccnc1Br 62f6e20039d072bcd7738e6e2318ec61 [0,1,0,0,0,1|1,0,1]=4 1761 B12R1.125 CC(=O)NCc1cccnc1C b81f4e2602bed8897ba4d3d274e56b6d [0,1,0,0,0,1|1,0,1]=4 1762 B12R1.125 CC(=O)NCc1cccnc1Cl 5ae7fa168c653f1a409fed2b9dc0d75d [0,1,0,0,0,1|1,0,1]=4 1763 B12R1.125 CC(=O)NCc1cccnc1F f0671dbd7cff55cce0cc54eb3ae10bb2 [0,1,0,0,0,1|1,0,1]=4 1764 B12R1.125 CC(=O)NCc1cnccc1C 59344c28bf73867bd1874b4bbab5feeb [0,1,0,0,0,1|1,0,1]=4 1765 B12R1.125 CC(C)CNc1c[nH]ccc1=O 3b03ea0bb77f8e7d321e8ba0c96772d1 [0,1,0,0,0,1|0,0,1]=3 1766 B12R1.125 CC(C)CNc1c[nH]cnc1=O 10c6a603c0033eddac1af1888cd56de5 [0,1,0,0,0,1|1,0,0]=3 1767 B12R1.125 CC(C)CNc1ccc[nH]c1=S 8e3a62399c7f1ac89cf2c2b861315f33 [0,1,0,0,0,1|0,0,1]=3 1768 B12R1.125 CC(C)CNc1cccc[n+]1[O-] 689b30fb24174281715b1e2295d6fd1b [0,1,0,0,0,1|2,0,0]=4 1769 B12R1.125 CC(C)CNc1ccccc1Br 97dcb5c3c65ce65124839fce143060ed [0,1,0,0,0,1|1,0,0]=3 1770 B12R1.125 CC(C)CNc1ccccc1Cl 75d6f72f33e1b81eaa5975119e7851a7 [0,1,0,0,0,1|1,0,0]=3 1771 B12R1.125 CC(C)CNc1ccccc1F 1f6d990d4611c55e81ba435b4de3227f [0,1,0,0,0,1|1,0,0]=3 1772 B12R1.125 CC(C)CNc1ccccc1I 8137d11aab68af4ff87c3b0c458aeadf [0,1,0,0,0,1|1,0,0]=3 1773 B12R1.125 CC(C)CNc1ccccc1S abeaa0222adaeba5cb90e228335806a0 [0,1,0,0,0,1|1,0,0]=3 1774 B12R1.125 CC(C)CNc1cccnc1Br e4e35cf9a45e8464362812984f0dcb29 [0,1,0,0,0,1|0,0,0]=2 1775 B12R1.125 CC(C)CNc1cccnc1Cl e27f120938cdfad22a9d53ca2ece2161 [0,1,0,0,0,1|0,0,0]=2 1776 B12R1.125 CC(C)CNc1cccnc1F 96b3802c2db207930b95c94df62440dc [0,1,0,0,0,1|0,0,0]=2 1777 B12R1.125 CC(C)CNc1cccnc1I 48231421f771901ae224cd2d83518b5a [0,1,0,0,0,1|0,0,0]=2 1778 B12R1.125 CC(C)CNc1ccn[nH]c1=O ab0db15890bfed26f938ad6d4edfb7b1 [0,1,0,0,0,1|1,0,1]=4 1779 B12R1.125 CC(C)CNc1ccn[nH]c1=S 415bb27780d0f64f44a8964284f88318 [0,1,0,0,0,1|1,0,1]=4 1780 B12R1.125 CC(C)CNc1ccncc1Br c2ed8fd4459e567e6fc82d9899d25f80 [0,1,0,0,0,1|2,0,0]=4 1781 B12R1.125 CC(C)CNc1ccncc1Cl 1a3dd903c6829977355f03ea4926eb4b [0,1,0,0,0,1|2,0,0]=4 1782 B12R1.125 CC(C)CNc1ccncc1F 5747fbc5541ea5634e0d79e127688ce0 [0,1,0,0,0,1|2,0,0]=4 1783 B12R1.125 CC(C)CNc1ccncc1I 1554741b1b824ec64a61799e1f57cd4a [0,1,0,0,0,1|2,0,0]=4 1784 B12R1.125 CC(C)CNc1ccnnc1Br b5d06aa9c301cdd5fdc13c34abee78cc [0,1,0,0,0,1|1,0,0]=3 1785 B12R1.125 CC(C)CNc1ccnnc1Cl ce8426f708d7469f95a1487632a676c5 [0,1,0,0,0,1|1,0,0]=3 1786 B12R1.125 CC(C)CNc1cnccc1Br a1750953a126ec3c55ead7f1bbd124cb [0,1,0,0,0,1|0,0,0]=2 1787 B12R1.125 CC(C)CNc1cnccc1Cl ea676dc248bf0bb68510cef98a5c2721 [0,1,0,0,0,1|0,0,0]=2 1788 B12R1.125 CC(C)CNc1cnccc1F bd64b3b317a29392a4044c03bdb541d5 [0,1,0,0,0,1|0,0,0]=2 1789 B12R1.125 CC(C)CNc1cnccc1I 05e43f5b8e6667c6fbf8f845bd4fb066 [0,1,0,0,0,1|0,0,0]=2 1790 B12R1.125 CC(C)CNc1cnccc1S 24918fb93412c853be460e7bc090cec7 [0,1,0,0,0,1|0,0,0]=2 1791 B12R1.125 CC(C)CNc1cncnc1Br bbcdbc12ff77c72e3af3fd9d8e52886a [0,1,0,0,0,1|1,0,0]=3 1792 B12R1.125 CC(C)CNc1cncnc1Cl 8063cf7e0e6ddf8258ff1f020aefa847 [0,1,0,0,0,1|1,0,0]=3 1793 B12R1.125 CC(C)CNc1cncnc1I 359bd0659f70c2db93eacb79ca8be2c7 [0,1,0,0,0,1|1,0,0]=3 1794 B12R1.125 CC(C)CNc1cnncc1Br eb6e0f20a1bf47b09eb8f38f40f0df36 [0,1,0,0,0,1|1,0,0]=3 1795 B12R1.125 CC(C)CNc1cnncc1Cl 071a91416bb49aac900e865d0c8a3dd0 [0,1,0,0,0,1|1,0,0]=3 1796 B12R1.125 CC(C)CNc1ncccc1Br fae7f676714f4f0b4d9a3346ec38d262 [0,1,0,0,0,1|2,0,0]=4 1797 B12R1.125 CC(C)CNc1ncccc1Cl 6854bd1dac0bcfd1589f4cde44ac0686 [0,1,0,0,0,1|2,0,0]=4 1798 B12R1.125 CC(C)CNc1ncccc1F c9b843ec39757011d12a4f0d9d477f19 [0,1,0,0,0,1|2,0,0]=4 1799 B12R1.125 CC(C)CNc1ncccc1I a8a8c3c3e1f4d6c6293dd19e4366ca81 [0,1,0,0,0,1|2,0,0]=4 1800 B12R1.125 CC(C)CNc1nccnc1Br 7a3db6762f00c94b79cab8721cfb0e6c [0,1,0,0,0,1|1,0,0]=3 1801 B12R1.125 CC(C)CNc1nccnc1Cl dd927439bde3f8a81ffb69ed26a09444 [0,1,0,0,0,1|1,0,0]=3 1802 B12R1.125 CC(C)CNc1nccnc1I 23302d05465fc43a29a79514291627f0 [0,1,0,0,0,1|1,0,0]=3 1803 B12R1.125 CC(C)COc1c[nH]cnc1=O 51c5a83e91d09958d1be1a3eb9cf2007 [0,1,0,0,0,1|1,0,0]=3 1804 B12R1.125 CC(C)COc1ccc[nH]c1=S 7cf31679b8b84a26df7d913fb8de737f [0,1,0,0,0,1|0,0,1]=3 1805 B12R1.125 CC(C)COc1cccc[n+]1[O-] 90f4e1bdff35950ddac633fbe78456a9 [0,1,0,0,0,1|2,0,0]=4 1806 B12R1.125 CC(C)COc1ccccc1Br 15e4cd0efed59b74bb1886c65548b9ce [0,1,0,0,0,1|1,0,0]=3 1807 B12R1.125 CC(C)COc1ccccc1Cl ec2a4d693a1f337c73c825dab32a22e8 [0,1,0,0,0,1|1,0,0]=3 1808 B12R1.125 CC(C)COc1ccccc1F 3d250d7b85e326d2d954c337a0f1907d [0,1,0,0,0,1|1,0,0]=3 1809 B12R1.125 CC(C)COc1ccccc1I 179013c2eef1a81cfd9d0470359a57c5 [0,1,0,0,0,1|1,0,0]=3 1810 B12R1.125 CC(C)COc1ccccc1S 3c07cbd446137458a8a811b24d5966d2 [0,1,0,0,0,1|1,0,0]=3 1811 B12R1.125 CC(C)COc1cccnc1Br 0278dcd8e75402c6e226bd0d671b7cf3 [0,1,0,0,0,1|0,0,0]=2 1812 B12R1.125 CC(C)COc1cccnc1Cl 41fd6af4f5d26b414a821e4b03b3d8fa [0,1,0,0,0,1|0,0,0]=2 1813 B12R1.125 CC(C)COc1cccnc1F fd7af796a2b1344ab209b53adf573de3 [0,1,0,0,0,1|0,0,0]=2 1814 B12R1.125 CC(C)COc1cccnc1I 8818acbf89666f4ebe1942f8299c4bc1 [0,1,0,0,0,1|0,0,0]=2 1815 B12R1.125 CC(C)COc1cccoc1=O 45df10a23fce7e58eaab8fa4ac81b508 [0,1,0,0,0,1|1,0,0]=3 1816 B12R1.125 CC(C)COc1ccncc1Br 76b5f88eb65a5cfb6ae6b530d5f76337 [0,1,0,0,0,1|2,0,0]=4 1817 B12R1.125 CC(C)COc1ccncc1Cl f28708ed6a61c93329f92a369d11035a [0,1,0,0,0,1|2,0,0]=4 1818 B12R1.125 CC(C)COc1ccncc1F 6c709eb8750c3a8924247fa6b8a79fc8 [0,1,0,0,0,1|2,0,0]=4 1819 B12R1.125 CC(C)COc1ccnnc1Cl 717e788fe144f0d76b3696965d9a1dd2 [0,1,0,0,0,1|1,0,0]=3 1820 B12R1.125 CC(C)COc1cnccc1Br baa265ac6db9382ad621fb0e3d2e4286 [0,1,0,0,0,1|0,0,0]=2 1821 B12R1.125 CC(C)COc1cnccc1Cl f1a754cc7617bfcd453fe7e24b90cd5e [0,1,0,0,0,1|0,0,0]=2 1822 B12R1.125 CC(C)COc1cnccc1F d2888be0656caedf957d8f1373572b95 [0,1,0,0,0,1|0,0,0]=2 1823 B12R1.125 CC(C)COc1cnccc1I 446f87702702d377df3b308dd5125063 [0,1,0,0,0,1|0,0,0]=2 1824 B12R1.125 CC(C)COc1cncnc1I 6094900d3c5eec8d205c8314b7399139 [0,1,0,0,0,1|1,0,0]=3 1825 B12R1.125 CC(C)COc1cnncc1Br bee4dee5f97d0df739e68f92e4937768 [0,1,0,0,0,1|1,0,0]=3 1826 B12R1.125 CC(C)COc1cnncc1Cl a3307e5282f21c6e7fa378e1204aa0ff [0,1,0,0,0,1|1,0,0]=3 1827 B12R1.125 CC(C)COc1coccc1=O 614bed8cd5a90cce22ec40c4fdcd726a [0,1,0,0,0,1|1,0,0]=3 1828 B12R1.125 CC(C)COc1ncccc1Br 3f386d7d47b34b2ac46f0a2ae6e73e95 [0,1,0,0,0,1|2,0,0]=4 1829 B12R1.125 CC(C)COc1ncccc1Cl 6de14ae7428ddbeb75053110c130c498 [0,1,0,0,0,1|2,0,0]=4 1830 B12R1.125 CC(C)COc1ncccc1F a9cb4a7eade6381f71dc5eb3e7f6b4ad [0,1,0,0,0,1|2,0,0]=4 1831 B12R1.125 CC(C)COc1nccnc1Br 6e621a660be38c569afa1cdfd4e4a619 [0,1,0,0,0,1|1,0,0]=3 1832 B12R1.125 CC(C)COc1nnccc1Cl 6aa320793d459924367c709b3023d874 [0,1,0,0,0,1|1,0,0]=3 1833 B12R1.125 CC(C)COc1nnccc1I 108465f2559ff3785f8f5314c7d646bf [0,1,0,0,0,1|1,0,0]=3 1834 B12R1.125 CC(C)COn1ccccc1=N e29cdf3d114d78764214cf0d7bd88c1b [0,1,0,0,0,1|2,0,0]=4 1835 B12R1.125 CC(C)COn1ccccc1=O 520cbc87b96c5de6e4f7512692f10f1c [0,1,0,0,0,1|2,0,0]=4 1836 B12R1.125 CC(C)COn1ccccc1=S 6836594d7ae7c3a48edd8c4299ac9353 [0,1,0,0,0,1|2,0,0]=4 1837 B12R1.125 CC(C)NCc1cccc[n+]1[O-] 75c78e72999a2a9c82d82071968cfcf8 [0,1,0,0,0,1|2,0,0]=4 1838 B12R1.125 CC(C)NCc1ccccc1Cl 9b9897219917fd3530700a473a4db4bc [0,1,0,0,0,1|1,0,0]=3 1839 B12R1.125 CC(C)NCc1ccccc1F 22106e2f6b32da238c4d16ecaebf9107 [0,1,0,0,0,1|1,0,0]=3 1840 B12R1.125 CC(C)NCc1ccccc1I 3b248e8d40a66b793c94674298302a5d [0,1,0,0,0,1|1,0,0]=3 1841 B12R1.125 CC(C)NCc1cccnc1Br 22459f2ca835d8f7937b98fb2a9c12c5 [0,1,0,0,0,1|0,0,0]=2 1842 B12R1.125 CC(C)NCc1cccnc1Cl 1a6e41b1638b07ef5214929c520cab92 [0,1,0,0,0,1|0,0,0]=2 1843 B12R1.125 CC(C)NCc1cccnc1F 25593b5896d79eeec200973b3dd6952c [0,1,0,0,0,1|0,0,0]=2 1844 B12R1.125 CC(C)NCc1ccncc1Br d81e7ee16e73504478b6791c384b9ec3 [0,1,0,0,0,1|2,0,0]=4 1845 B12R1.125 CC(C)NCc1ccncc1Cl 251b95b9f8185cc37c498345c403ee2f [0,1,0,0,0,1|2,0,0]=4 1846 B12R1.125 CC(C)NCc1ccncc1F 3fd62883cc180b7243d81db6adc63828 [0,1,0,0,0,1|2,0,0]=4 1847 B12R1.125 CC(C)NCc1ncccc1Br ba070c387cfb926f8a021c30b52f1b8f [0,1,0,0,0,1|2,0,0]=4 1848 B12R1.125 CC(C)NCc1ncccc1Cl 1546787973be24b721a8bc7496cac392 [0,1,0,0,0,1|2,0,0]=4 1849 B12R1.125 CC(C)NCc1ncccc1F aa0069dced2d7cc22965885f3f7a9397 [0,1,0,0,0,1|2,0,0]=4 1850 B12R1.125 CC(C)NCc1nccnc1Cl 74733b782e009da747c4009745ad32b0 [0,1,0,0,0,1|1,0,0]=3 1851 B12R1.125 CC(C)NCc1nnc[nH]c1=O 74992fe247281a1b75df777b6b1bfff8 [0,1,0,0,0,1|2,0,0]=4 1852 B12R1.125 CC(C)OCc1ccc[nH]c1=O e297c1be086c22b1e84c5a8b3babb68d [0,1,0,0,0,1|0,0,1]=3 1853 B12R1.125 CC(C)OCc1ccccc1Cl f1d0578f20039107ab7831c744270352 [0,1,0,0,0,1|1,0,0]=3 1854 B12R1.125 CC(C)OCc1ccccc1F 88ffe0c3ffb1a7712dee49c51d8757cb [0,1,0,0,0,1|1,0,0]=3 1855 B12R1.125 CC(C)OCc1ccccc1I 091e4f6992ab541edd05dc5206b2152a [0,1,0,0,0,1|1,0,0]=3 1856 B12R1.125 CC(C)OCc1cccnc1Br 054a1fa90d466c66e80e2f94ee0cc8ad [0,1,0,0,0,1|0,0,0]=2 1857 B12R1.125 CC(C)OCc1cccnc1Cl 9341dccfc0e34600d7a9f7d86868c180 [0,1,0,0,0,1|0,0,0]=2 1858 B12R1.125 CC(C)OCc1cccnc1F 43198bce1943ba438eca35cf747bbab3 [0,1,0,0,0,1|0,0,0]=2 1859 B12R1.125 CC(C)OCc1ccncc1Cl b2bd70abc2680c5faca01e36afe3c508 [0,1,0,0,0,1|2,0,0]=4 1860 B12R1.125 CC(C)OCc1ccncc1F e0f664bd9f24e773b8099a6425861e38 [0,1,0,0,0,1|2,0,0]=4 1861 B12R1.125 CC(C)OCc1ccncc1I a9ac24f885be578976859e0b73ccf536 [0,1,0,0,0,1|2,0,0]=4 1862 B12R1.125 CC(C)OCc1cnccc1Br 3e276621683da2bb94d01c109be41823 [0,1,0,0,0,1|0,0,0]=2 1863 B12R1.125 CC(C)OCc1cnccc1Cl eb99f0c34344c7f47466de55040bd0d4 [0,1,0,0,0,1|0,0,0]=2 1864 B12R1.125 CC(C)OCc1cnccc1F 68c200210a3748d543a35abac99f931b [0,1,0,0,0,1|0,0,0]=2 1865 B12R1.125 CC(C)OCc1cncnc1Cl 1c8ae603c93cbb2ad6de8cf4e153463a [0,1,0,0,0,1|1,0,0]=3 1866 B12R1.125 CC(C)OCc1ncccc1Br 4614c9d7b350005a40859c2bd40e6e3d [0,1,0,0,0,1|2,0,0]=4 1867 B12R1.125 CC(C)OCc1ncccc1Cl 4451d4ad31d9d68f63a26b0996be1d97 [0,1,0,0,0,1|2,0,0]=4 1868 B12R1.125 CC(C)OCc1ncccc1F a6ff5296d7d94bb454d989a3d95e21c4 [0,1,0,0,0,1|2,0,0]=4 1869 B12R1.125 CC(C)OCc1nccnc1Cl cf955ada05304600400341f0a06ba741 [0,1,0,0,0,1|1,0,0]=3 1870 B12R1.125 CC(O)CNc1c[nH]ccc1=O 3d53fb936c3f25e29733d7792976e8ad [0,1,0,0,0,1|1,0,1]=4 1871 B12R1.125 CC(O)CNc1c[nH]cnc1=O 11156e59abf00c4555fa24b195c69a63 [0,1,0,0,0,1|2,0,0]=4 1872 B12R1.125 CC(O)CNc1ccc[nH]c1=S b34bbcf0ab8a0d7c87dba4f3ad419b1b [0,1,0,0,0,1|1,0,1]=4 1873 B12R1.125 CC(O)CNc1ccccc1Br 4a8178895a974705dd8c5d47896d821f [0,1,0,0,0,1|2,0,0]=4 1874 B12R1.125 CC(O)CNc1ccccc1Cl 18a1aeb377915ff3d7752e638825109f [0,1,0,0,0,1|2,0,0]=4 1875 B12R1.125 CC(O)CNc1ccccc1F 2118f4d689b50b2f5bf4fe77b0346bb5 [0,1,0,0,0,1|2,0,0]=4 1876 B12R1.125 CC(O)CNc1ccccc1I 4ba68e475ff4710ffb78d3e623e4dd83 [0,1,0,0,0,1|2,0,0]=4 1877 B12R1.125 CC(O)CNc1ccccc1S c9cd17787d858b75a205fbdc344be6ff [0,1,0,0,0,1|2,0,0]=4 1878 B12R1.125 CC(O)CNc1cccnc1Br f249a4b8744d03a02e24b0b13450af63 [0,1,0,0,0,1|1,0,0]=3 1879 B12R1.125 CC(O)CNc1cccnc1Cl 95b371b3e779eaabee26b45d4e140a5e [0,1,0,0,0,1|1,0,0]=3 1880 B12R1.125 CC(O)CNc1cccnc1F e14799916c7fb7239e2d571cef33ba0a [0,1,0,0,0,1|1,0,0]=3 1881 B12R1.125 CC(O)CNc1cccnc1I a1f63668ebab19c97abdffaea4e72eb2 [0,1,0,0,0,1|1,0,0]=3 1882 B12R1.125 CC(O)CNc1ccnnc1Br d4a9af1bdd3358be87acf09717f499c5 [0,1,0,0,0,1|2,0,0]=4 1883 B12R1.125 CC(O)CNc1ccnnc1Cl ca779b49832389d00df67edb9ea0d0b9 [0,1,0,0,0,1|2,0,0]=4 1884 B12R1.125 CC(O)CNc1cnccc1Br eaf65a54847da2d7542db29233cc1f77 [0,1,0,0,0,1|1,0,0]=3 1885 B12R1.125 CC(O)CNc1cnccc1Cl 9a0a7220cc2978dd9e3bc2e3be28b091 [0,1,0,0,0,1|1,0,0]=3 1886 B12R1.125 CC(O)CNc1cnccc1F ea8f2671d1611ccf384a8e9cbfdfd0a7 [0,1,0,0,0,1|1,0,0]=3 1887 B12R1.125 CC(O)CNc1cnccc1I 02315c0170c733e27427e65855199904 [0,1,0,0,0,1|1,0,0]=3 1888 B12R1.125 CC(O)CNc1cnccc1S 95f61ff7061c672b64fb2292d23abb71 [0,1,0,0,0,1|1,0,0]=3 1889 B12R1.125 CC(O)CNc1cncnc1Br d67a2adc72cca1cb636156167dc3e80a [0,1,0,0,0,1|2,0,0]=4 1890 B12R1.125 CC(O)CNc1cncnc1Cl 9099cb05d28b2c8a65dd09153ce861bf [0,1,0,0,0,1|2,0,0]=4 1891 B12R1.125 CC(O)CNc1cncnc1I fa4ba537930f64b91e6f29e725a8445c [0,1,0,0,0,1|2,0,0]=4 1892 B12R1.125 CC(O)CNc1cnncc1Br 6203140f081c23f1e78e6a2978ee87e4 [0,1,0,0,0,1|2,0,0]=4 1893 B12R1.125 CC(O)CNc1cnncc1Cl e43b9c5d2c71083435b478a63103b6ea [0,1,0,0,0,1|2,0,0]=4 1894 B12R1.125 CC(O)CNc1nccnc1Br cc4d4b08fae26fb04cdddfd3aca5f05a [0,1,0,0,0,1|2,0,0]=4 1895 B12R1.125 CC(O)CNc1nccnc1Cl 6834193a32564dc37ba03b5264bcaa81 [0,1,0,0,0,1|2,0,0]=4 1896 B12R1.125 CC(O)CNc1nccnc1I 59f1472df2ab39c7f7ac33aea6f92d3d [0,1,0,0,0,1|2,0,0]=4 1897 B12R1.125 CN(C)CNc1c[nH]cnc1=O f9d2bfb55425fa26604f37b8b3dccb7c [0,1,0,0,0,1|2,0,0]=4 1898 B12R1.125 CN(C)CNc1ccccc1I 9db091b00fc74cd0330b59002f1d7c8a [0,1,0,0,0,1|2,0,0]=4 1899 B12R1.125 CN(C)CNc1cccnc1Br bd386e074f73296ec576ffc32a90f798 [0,1,0,0,0,1|1,0,0]=3 1900 B12R1.125 CN(C)CNc1cccnc1Cl 84b59f1f940cc037a687c19e993dbad6 [0,1,0,0,0,1|1,0,0]=3 1901 B12R1.125 CN(C)CNc1cccnc1F 2d661df76fafeb203a27b28ae2bf98ad [0,1,0,0,0,1|1,0,0]=3 1902 B12R1.125 CN(C)CNc1cccnc1I bdb76fa718a3855078e3010cd9bb0c01 [0,1,0,0,0,1|1,0,0]=3 1903 B12R1.125 CN(C)CNc1ccnnc1Br 3acbd60364bcc3ba65b803788d32758a [0,1,0,0,0,1|2,0,0]=4 1904 B12R1.125 CN(C)CNc1ccnnc1Cl 007d77e61e386f9f3d3b712687c93f0f [0,1,0,0,0,1|2,0,0]=4 1905 B12R1.125 CN(C)CNc1cnccc1Cl 8a2d21f53aa90419b141481044af9671 [0,1,0,0,0,1|1,0,0]=3 1906 B12R1.125 CN(C)CNc1cnccc1F 1251ccae38a57fd9370ebdf9685f3c45 [0,1,0,0,0,1|1,0,0]=3 1907 B12R1.125 CN(C)CNc1cnccc1I 43a23b01b72e6c1a1233cfca31d7128e [0,1,0,0,0,1|1,0,0]=3 1908 B12R1.125 CN(C)CNc1cnncc1Br 34977f3b283d0869932b602755aeae42 [0,1,0,0,0,1|2,0,0]=4 1909 B12R1.125 CN(C)CNc1cnncc1Cl 10b09920d4ae2dc98cd5b7ce24f0545c [0,1,0,0,0,1|2,0,0]=4 1910 B12R1.125 CN(C)CNc1nccnc1Br 391e9cdf5cba9a3392d4a10de234aebb [0,1,0,0,0,1|2,0,0]=4 1911 B12R1.125 CN(C)CNc1nccnc1Cl 94b2aa3e4919ffee61b0cd4ad1881ca8 [0,1,0,0,0,1|2,0,0]=4 1912 B12R1.125 CN(C)CNc1nccnc1I 9942d75a30f4732a0737076cb0f1ab87 [0,1,0,0,0,1|2,0,0]=4 1913 B12R1.125 CN(C)COc1c[nH]cnc1=O 73b7a63fd3b81aa78e2365220dc6416d [0,1,0,0,0,1|2,0,0]=4 1914 B12R1.125 CN(C)COc1ccc[nH]c1=S f4f83cc450ee8bb2b2dd236b418e6e4f [0,1,0,0,0,1|1,0,1]=4 1915 B12R1.125 CN(C)COc1ccccc1Cl 97615d5e6a9b6d2759b55d0ad129882e [0,1,0,0,0,1|2,0,0]=4 1916 B12R1.125 CN(C)COc1ccccc1F d924d84b19d4fe40db67235213a44035 [0,1,0,0,0,1|2,0,0]=4 1917 B12R1.125 CN(C)COc1ccccc1I 6002f90dd33e7c9d3ab5ef7fc55225a1 [0,1,0,0,0,1|2,0,0]=4 1918 B12R1.125 CN(C)COc1cccnc1Br 242b27ffd99378b6b7640204b209e93a [0,1,0,0,0,1|1,0,0]=3 1919 B12R1.125 CN(C)COc1cccnc1Cl 4b05600672b279d74d8fbda1c84f5737 [0,1,0,0,0,1|1,0,0]=3 1920 B12R1.125 CN(C)COc1cccnc1F 9aaa3779ef0b520ab61f3d7237cbbeec [0,1,0,0,0,1|1,0,0]=3 1921 B12R1.125 CN(C)COc1cccnc1I fd9ccd4d6058565d8f89bcdfcd387e73 [0,1,0,0,0,1|1,0,0]=3 1922 B12R1.125 CN(C)COc1cccoc1=O 229ebe32adb657003d94fa573e0215cf [0,1,0,0,0,1|2,0,0]=4 1923 B12R1.125 CN(C)COc1ccnnc1Cl 97579e392985da3bdee3eedbc9bb847d [0,1,0,0,0,1|2,0,0]=4 1924 B12R1.125 CN(C)COc1cnccc1Br 9f4c6f0a38a0f69397390bf90a0d7588 [0,1,0,0,0,1|1,0,0]=3 1925 B12R1.125 CN(C)COc1cnccc1Cl 51c7eb2f3ba6adc7955864238f1647b7 [0,1,0,0,0,1|1,0,0]=3 1926 B12R1.125 CN(C)COc1cnccc1F 8cf834d15c2627168517527bea4b603f [0,1,0,0,0,1|1,0,0]=3 1927 B12R1.125 CN(C)COc1cnccc1I 0a6fbae639b8a8afd493715af1748385 [0,1,0,0,0,1|1,0,0]=3 1928 B12R1.125 CN(C)COc1cncnc1I e492c95ad2b1c4742c2d9d6e4ec1060c [0,1,0,0,0,1|2,0,0]=4 1929 B12R1.125 CN(C)COc1cnncc1Br a15f7d32a996f72ecb72945ad1524c57 [0,1,0,0,0,1|2,0,0]=4 1930 B12R1.125 CN(C)COc1cnncc1Cl 1627f2f087880bdb0697fc4698741ffc [0,1,0,0,0,1|2,0,0]=4 1931 B12R1.125 CN(C)COc1coccc1=O 83c2b99bf672905bbfb346ccc2e12b00 [0,1,0,0,0,1|2,0,0]=4 1932 B12R1.125 CN(C)COc1nccnc1Br 5a98f03358b01b961bf7a552238955dd [0,1,0,0,0,1|2,0,0]=4 1933 B12R1.125 CN(C)COc1nnccc1Cl e3deb3143fe78d8f1d57f2fa097c6702 [0,1,0,0,0,1|2,0,0]=4 1934 B12R1.125 CN(C)COc1nnccc1I 7ec2d217773f8d49b64b2446b77c7c62 [0,1,0,0,0,1|2,0,0]=4 1935 B12R1.125 C[C@@H](O)CNc1c[nH]ccc1=O 5f79fe3799d2a83c4e3e87433d3e3608 [0,1,0,0,0,1|1,0,1]=4 1936 B12R1.125 C[C@@H](O)CNc1c[nH]ccc1=S cf033160e241c97b4ca3ce2c552c85c1 [0,1,0,0,0,1|1,0,1]=4 1937 B12R1.125 C[C@@H](O)CNc1c[nH]cnc1=O 8b97f74169fd66bc9d6b677558e2ee4c [0,1,0,0,0,1|2,0,0]=4 1938 B12R1.125 C[C@@H](O)CNc1ccccc1I 9fbcb093ddb932bd7f24eaa426a08c17 [0,1,0,0,0,1|2,0,0]=4 1939 B12R1.125 C[C@@H](O)CNc1ccnnc1Br ebb3cdec3a381fa8790e9ee157ef13d6 [0,1,0,0,0,1|2,0,0]=4 1940 B12R1.125 C[C@@H](O)CNc1ccnnc1Cl de33984caeed8e0d90868093b0d21d41 [0,1,0,0,0,1|2,0,0]=4 1941 B12R1.125 C[C@@H](O)CNc1cnccc1F 95434ac9320d84db3a7117cef5c52be1 [0,1,0,0,0,1|1,0,0]=3 1942 B12R1.125 C[C@@H](O)CNc1cnccc1I 3547ce108436077763fca1e4125b8421 [0,1,0,0,0,1|1,0,0]=3 1943 B12R1.125 C[C@@H](O)CNc1cnncc1Cl 8f640bc1acf143879c240225c3c5f6b1 [0,1,0,0,0,1|2,0,0]=4 1944 B12R1.125 C[C@@H](O)CNc1nccnc1Br 53bc0939e796139317b30a0557107641 [0,1,0,0,0,1|2,0,0]=4 1945 B12R1.125 C[C@@H](O)CNc1nccnc1Cl 84fa54c54da9940b46748dde2bf5da88 [0,1,0,0,0,1|2,0,0]=4 1946 B12R1.125 C[C@@H](O)CNc1nccnc1I d9ba8c3e809b4805db25e99080cd4f46 [0,1,0,0,0,1|2,0,0]=4 1947 B12R1.125 C[C@H](O)CNc1c[nH]ccc1=O 02a4079d850e6605d93586a6281b70dc [0,1,0,0,0,1|1,0,1]=4 1948 B12R1.125 C[C@H](O)CNc1c[nH]cnc1=O 76cc9baac22dd7b18a7ff1310a1be2cd [0,1,0,0,0,1|2,0,0]=4 1949 B12R1.125 C[C@H](O)CNc1ccc[nH]c1=S c677e475db5a045cf918a4f3dc237770 [0,1,0,0,0,1|1,0,1]=4 1950 B12R1.125 C[C@H](O)CNc1ccccc1Br c817d086f8954ccab620e5f4c72375d6 [0,1,0,0,0,1|2,0,0]=4 1951 B12R1.125 C[C@H](O)CNc1ccccc1Cl 764c54c7fa40fe5604a3aadd5e4b8400 [0,1,0,0,0,1|2,0,0]=4 1952 B12R1.125 C[C@H](O)CNc1ccccc1F 215b77315898b180d735c74dedf26562 [0,1,0,0,0,1|2,0,0]=4 1953 B12R1.125 C[C@H](O)CNc1ccccc1I a750a87f3e2f024043f4659d08af95be [0,1,0,0,0,1|2,0,0]=4 1954 B12R1.125 C[C@H](O)CNc1ccccc1S a2817a071e3134750611d07f0df977a7 [0,1,0,0,0,1|2,0,0]=4 1955 B12R1.125 C[C@H](O)CNc1cccnc1Br cb05ae2c8a7f395c5db1d1cb21241540 [0,1,0,0,0,1|1,0,0]=3 1956 B12R1.125 C[C@H](O)CNc1cccnc1Cl 6a54c1f1bd42de78c04c03ed899e30c5 [0,1,0,0,0,1|1,0,0]=3 1957 B12R1.125 C[C@H](O)CNc1cccnc1F 68e2310190b98f6e1ca376ac9038c5e6 [0,1,0,0,0,1|1,0,0]=3 1958 B12R1.125 C[C@H](O)CNc1cccnc1I c657793bf2063866d445ec116027f6ed [0,1,0,0,0,1|1,0,0]=3 1959 B12R1.125 C[C@H](O)CNc1ccnnc1Br d2f2322b4c56cde568452f4ed8dd436a [0,1,0,0,0,1|2,0,0]=4 1960 B12R1.125 C[C@H](O)CNc1ccnnc1Cl cbeefe0c8e34a9a117a49f6c6aa6e664 [0,1,0,0,0,1|2,0,0]=4 1961 B12R1.125 C[C@H](O)CNc1cnccc1Br 1eee97065adebfcb7a8c4bf3f26df9b7 [0,1,0,0,0,1|1,0,0]=3 1962 B12R1.125 C[C@H](O)CNc1cnccc1Cl 66271cbefbaa5806a0c717c16dbd3a8a [0,1,0,0,0,1|1,0,0]=3 1963 B12R1.125 C[C@H](O)CNc1cnccc1F d336cae90794b05f39090268142b7564 [0,1,0,0,0,1|1,0,0]=3 1964 B12R1.125 C[C@H](O)CNc1cnccc1I 6504d61491ad824c9446f77b28b01dbf [0,1,0,0,0,1|1,0,0]=3 1965 B12R1.125 C[C@H](O)CNc1cnccc1S 02cce5a2da2ad67652071d500e1604b3 [0,1,0,0,0,1|1,0,0]=3 1966 B12R1.125 C[C@H](O)CNc1cncnc1Br 79f2298f54ab7ee82309dd62e4af118d [0,1,0,0,0,1|2,0,0]=4 1967 B12R1.125 C[C@H](O)CNc1cncnc1Cl 94a61cb0abee7a3d16eaa7ebe72ea491 [0,1,0,0,0,1|2,0,0]=4 1968 B12R1.125 C[C@H](O)CNc1cncnc1I 625eb078929cd3cdfbd05f7fa78d7514 [0,1,0,0,0,1|2,0,0]=4 1969 B12R1.125 C[C@H](O)CNc1cnncc1Br dca6e78bbc44724a10d0eef458a3297b [0,1,0,0,0,1|2,0,0]=4 1970 B12R1.125 C[C@H](O)CNc1cnncc1Cl 4b97ff6f1d56ec39e537181979a1a5ee [0,1,0,0,0,1|2,0,0]=4 1971 B12R1.125 C[C@H](O)CNc1nccnc1Br 2b2272ced237b2785135ce64b8f6f5f1 [0,1,0,0,0,1|2,0,0]=4 1972 B12R1.125 C[C@H](O)CNc1nccnc1Cl e2402ce8d2abb48f3c4ce46737c4dcb6 [0,1,0,0,0,1|2,0,0]=4 1973 B12R1.125 C[C@H](O)CNc1nccnc1I 3ab4f844d13dc351cbe56eb74040719a [0,1,0,0,0,1|2,0,0]=4 1974 B12R1.125 Cc1ccccc1CNC(C)C 2dd08d80be2d3e51d4d72fed96629045 [0,1,0,0,0,1|1,0,0]=3 1975 B12R1.125 Cc1ccccc1NCC(C)C 1586ab8e64ea906befcc8bbfad124462 [0,1,0,0,0,1|1,0,0]=3 1976 B12R1.125 Cc1ccccc1NCC(C)O 31ba569e9dedf1c2e9bd352e34766cab [0,1,0,0,0,1|2,0,0]=4 1977 B12R1.125 Cc1ccccc1NC[C@H](C)O f7931a4967f5c286879c882148e8589e [0,1,0,0,0,1|2,0,0]=4 1978 B12R1.125 Cc1ccccc1OCC(C)C 364254b27b947c9392bf52594b3dc819 [0,1,0,0,0,1|1,0,0]=3 1979 B12R1.125 Cc1ccccc1OCN(C)C 352a0cc9d2eab6580b092e8e3f27bcfa [0,1,0,0,0,1|2,0,0]=4 1980 B12R1.125 Cc1cccnc1CNC(C)C 5c608f0fb577a4839d6566b1f8cde4a7 [0,1,0,0,0,1|2,0,0]=4 1981 B12R1.125 Cc1cccnc1COC(C)C d0c708a01280fb6f5078e1dd21e398c6 [0,1,0,0,0,1|2,0,0]=4 1982 B12R1.125 Cc1cccnc1NCC(C)C 282c02e5a453782598cad364ccee854e [0,1,0,0,0,1|2,0,0]=4 1983 B12R1.125 Cc1cccnc1OCC(C)C 573ebe28edc295f62b8c3f4cb7f93024 [0,1,0,0,0,1|2,0,0]=4 1984 B12R1.125 Cc1ccncc1NCC(C)C 0a5762a41cc112098a2ea13f68f3fa1b [0,1,0,0,0,1|0,0,0]=2 1985 B12R1.125 Cc1ccncc1NCC(C)O 2f15eac49afabd0d03f0d0d2b1fae88b [0,1,0,0,0,1|1,0,0]=3 1986 B12R1.125 Cc1ccncc1NCC(F)F 7e1623d476d2d1fcc320cf0fcdaf206f [0,1,0,0,0,1|2,0,0]=4 1987 B12R1.125 Cc1ccncc1NCN(C)C 6c107f1ba62f91a4a2f50f5eaa8ffe0b [0,1,0,0,0,1|1,0,0]=3 1988 B12R1.125 Cc1ccncc1NC[C@H](C)O d11181ba52bc4967fbb62fb9f25aaaec [0,1,0,0,0,1|1,0,0]=3 1989 B12R1.125 Cc1ccncc1OCC(C)C ac9c54ecd0093716288cc6cafb2156d2 [0,1,0,0,0,1|0,0,0]=2 1990 B12R1.125 Cc1ccncc1OCC(F)F f2258574b5c297b2b18ad12b986a79d1 [0,1,0,0,0,1|2,0,0]=4 1991 B12R1.125 Cc1ccncc1OCN(C)C ed0fdc44c3782745a354fe45d8505643 [0,1,0,0,0,1|1,0,0]=3 1992 B12R1.125 Cc1ccnnc1CNC(C)C 053d53ff032d307f2f7189f453930b8b [0,1,0,0,0,1|1,0,0]=3 1993 B12R1.125 Cc1ccnnc1COC(C)C 4efceeefc5d2f3dc52e6096749d82f5a [0,1,0,0,0,1|1,0,0]=3 1994 B12R1.125 Cc1ccnnc1NCC(C)C d5d65ddd29197d95dc730724717c3777 [0,1,0,0,0,1|1,0,0]=3 1995 B12R1.125 Cc1ccnnc1NCC(C)O 94eef95e3cdfc01d10444dd7a9a11f6c [0,1,0,0,0,1|2,0,0]=4 1996 B12R1.125 Cc1ccnnc1NCN(C)C f04b66d95ccda9ae947d4353c2c4693c [0,1,0,0,0,1|2,0,0]=4 1997 B12R1.125 Cc1ccnnc1NC[C@@H](C)O 581d76d91d7628bccd66c456ef25661f [0,1,0,0,0,1|2,0,0]=4 1998 B12R1.125 Cc1ccnnc1NC[C@H](C)O b232633cd438aa76d2ba534ac0c96e8e [0,1,0,0,0,1|2,0,0]=4 1999 B12R1.125 Cc1ccnnc1OCC(C)C b543cf433e7ce1644f0a08f12e56aca3 [0,1,0,0,0,1|1,0,0]=3 2000 B12R1.125 Cc1ccnnc1OCN(C)C 03c41bc7bacfa4b9fcbb1cf5f73ec560 [0,1,0,0,0,1|2,0,0]=4 2001 B12R1.125 Cc1cnccc1CNC(C)C fd3c13616b7aae9904ff75b6dc257c3e [0,1,0,0,0,1|2,0,0]=4 2002 B12R1.125 Cc1cnccc1COC(C)C ff9355dbcebbc16b1ea6e10e3b3965f7 [0,1,0,0,0,1|2,0,0]=4 2003 B12R1.125 Cc1cnccc1NCC(C)C cd6d78737d148d2d51c403a22f81251b [0,1,0,0,0,1|2,0,0]=4 2004 B12R1.125 Cc1cnccc1OCC(C)C c3a7d65c45f030d0d75c0ef6588ca42d [0,1,0,0,0,1|2,0,0]=4 2005 B12R1.125 Cc1cnncc1COC(C)C c2393e5a2e340c1a568e5e5b1d83af12 [0,1,0,0,0,1|1,0,0]=3 2006 B12R1.125 Cc1ncccc1CNC(C)C 9e75f3824b522bcdb845f9a2f15ad81b [0,1,0,0,0,1|0,0,0]=2 2007 B12R1.125 Cc1ncccc1COC(C)C a9da00623a47634eafd7b8cce50e0671 [0,1,0,0,0,1|0,0,0]=2 2008 B12R1.125 Cc1ncccc1NCC(C)C c7474db981f6e5e3e75f25e8d6317671 [0,1,0,0,0,1|0,0,0]=2 2009 B12R1.125 Cc1ncccc1NCC(C)O f0d41d8d2f35341a2155c14f483de914 [0,1,0,0,0,1|1,0,0]=3 2010 B12R1.125 Cc1ncccc1NCC(F)F 1b9d3dc44189c09cedac6fdae1daea5c [0,1,0,0,0,1|2,0,0]=4 2011 B12R1.125 Cc1ncccc1NCN(C)C 9bfc2f5b83209dfdc182f46fc740fc3c [0,1,0,0,0,1|1,0,0]=3 2012 B12R1.125 Cc1ncccc1NC[C@H](C)O cf45cd1f3e8e64b21a2d69dce94d1b86 [0,1,0,0,0,1|1,0,0]=3 2013 B12R1.125 Cc1ncccc1OCC(C)C c4d92e6663fbe07004fa45eda68d9c29 [0,1,0,0,0,1|0,0,0]=2 2014 B12R1.125 Cc1ncccc1OCC(F)F b64b8ace3976f7e24e262f2e62bedf51 [0,1,0,0,0,1|2,0,0]=4 2015 B12R1.125 Cc1ncccc1OCN(C)C 0f01c733d62032c9a8ab086dd0d89f30 [0,1,0,0,0,1|1,0,0]=3 2016 B12R1.125 Cc1nccnc1COC(C)C 17ec3e09c1fd2bbc7c2646442d27bb8d [0,1,0,0,0,1|1,0,0]=3 2017 B12R1.125 Cc1nccnc1NCC(C)C 5e6727e773c0a20a267b34cfe228d269 [0,1,0,0,0,1|1,0,0]=3 2018 B12R1.125 Cc1nccnc1NCC(C)O c6fe08610e3144e5261435fd521f805d [0,1,0,0,0,1|2,0,0]=4 2019 B12R1.125 Cc1nccnc1NCN(C)C 337b17090b5a7b49959264b7c5c3dd7d [0,1,0,0,0,1|2,0,0]=4 2020 B12R1.125 Cc1nccnc1NC[C@@H](C)O 787d4bf46d569ab2aca96e5d43300a12 [0,1,0,0,0,1|2,0,0]=4 2021 B12R1.125 Cc1nccnc1NC[C@H](C)O ef24cce204f0dffa88e8432611e18df9 [0,1,0,0,0,1|2,0,0]=4 2022 B12R1.125 Cc1nccnc1OCC(C)C 3957a235338a92b4686d66572e359399 [0,1,0,0,0,1|1,0,0]=3 2023 B12R1.125 Cc1nccnc1OCN(C)C af001de6fcbb0a2739f4ec49cdf76c3c [0,1,0,0,0,1|2,0,0]=4 2024 B12R1.125 Cc1ncncc1NCC(C)C b1873b909032b2a83cab843a49b26163 [0,1,0,0,0,1|1,0,0]=3 2025 B12R1.125 Cc1ncncc1NCC(C)O 0c8bc0046f2aaf77bf00c5f48beeabbf [0,1,0,0,0,1|2,0,0]=4 2026 B12R1.125 Cc1ncncc1NC[C@H](C)O cdcda8311cdbc07b64b3949abb222a23 [0,1,0,0,0,1|2,0,0]=4 2027 B12R1.125 Cc1ncncc1OCC(C)C 0c517530a00f8f4d0e7375ac036e2d75 [0,1,0,0,0,1|1,0,0]=3 2028 B12R1.125 Cc1ncncc1OCN(C)C 0538398a2b148326d652da2f81e7ef8e [0,1,0,0,0,1|2,0,0]=4 2029 B12R1.125 Cc1nnccc1COC(C)C b9d2433148085c452eaeb5d594a91ec5 [0,1,0,0,0,1|1,0,0]=3 2030 B12R1.125 Cc1nnccc1NCC(C)C a9e1ae04903460efc9917be095d24ad5 [0,1,0,0,0,1|1,0,0]=3 2031 B12R1.125 Cc1nnccc1NCC(C)O d15d931071b93245d7c82be394156251 [0,1,0,0,0,1|2,0,0]=4 2032 B12R1.125 Cc1nnccc1NCN(C)C a7d1a084b3025afcb67be6da149dc9fc [0,1,0,0,0,1|2,0,0]=4 2033 B12R1.125 Cc1nnccc1NC[C@@H](C)O 8b1a381c78f24f0752d69c1cd1eaffd8 [0,1,0,0,0,1|2,0,0]=4 2034 B12R1.125 Cc1nnccc1NC[C@H](C)O 217f26dcbb84da8155db255c8a2b1654 [0,1,0,0,0,1|2,0,0]=4 2035 B12R1.125 FC(F)CNc1cccnc1Br 26539434e8160f2a0ac3518a98679e51 [0,1,0,0,0,1|2,0,0]=4 2036 B12R1.125 FC(F)CNc1cccnc1Cl 70e7b694c6c3b195418b2b405e1285e9 [0,1,0,0,0,1|2,0,0]=4 2037 B12R1.125 FC(F)CNc1cccnc1I 98157a3bcab09e55fa95a3aecc4c5980 [0,1,0,0,0,1|2,0,0]=4 2038 B12R1.125 FC(F)CNc1cnccc1Br d925c5d56ee1c9a15bd4e3d6b4fc1ae9 [0,1,0,0,0,1|2,0,0]=4 2039 B12R1.125 FC(F)CNc1cnccc1Cl 152e2d3dcf4258695eb0742c1c833d2e [0,1,0,0,0,1|2,0,0]=4 2040 B12R1.125 FC(F)CNc1cnccc1I 9c266407844a316e71524564d7aad525 [0,1,0,0,0,1|2,0,0]=4 2041 B12R1.125 FC(F)CNc1cnccc1S e4a34caf4bf72cb8e1bd4a27c9947bc5 [0,1,0,0,0,1|2,0,0]=4 2042 B12R1.125 FC(F)COc1cccnc1Br 6001a8e65031e4ed685d45aed86eb657 [0,1,0,0,0,1|2,0,0]=4 2043 B12R1.125 FC(F)COc1cccnc1Cl f4fd4d32bfe2f9025450832c6295bb44 [0,1,0,0,0,1|2,0,0]=4 2044 B12R1.125 FC(F)COc1cccnc1I 1281bba76bd5266b79c301966c51137b [0,1,0,0,0,1|2,0,0]=4 2045 B12R1.125 FC(F)COc1cnccc1Br ce0dab4ab7cf3dde6cf8dd617b031ead [0,1,0,0,0,1|2,0,0]=4 2046 B12R1.125 FC(F)COc1cnccc1Cl cf11ec4eaae41fa8c68d6135c4a24b9b [0,1,0,0,0,1|2,0,0]=4 2047 B12R1.125 FC(F)COc1cnccc1I 4ba69cc19aaae77528538d56f558c432 [0,1,0,0,0,1|2,0,0]=4 2048 B12R1.125 Fc1ccncc1NCC(F)F 6c364bab3e4704583f77f0560d1e729f [0,1,0,0,0,1|2,0,0]=4 2049 B12R1.125 Fc1ccncc1OCC(F)F c9831dc94cd6b8df0ed1d387e79d1b78 [0,1,0,0,0,1|2,0,0]=4 2050 B12R1.125 Fc1ncccc1NCC(F)F 08989de243fe79a5d78a8d07601cb6ca [0,1,0,0,0,1|2,0,0]=4 2051 B12R1.125 Fc1ncccc1OCC(F)F f17f30a61c8ef3d6ab92b6749ba14bd1 [0,1,0,0,0,1|2,0,0]=4 2052 B12R1.226 C=C(C)CNc1cncc(c1)Br 223ab781943a89e2dce487b10dd71d3b [0,1,0,0,0,1|0,0,2]=4 2053 B12R1.226 C=C(C)CNc1cncc(c1)C 558cdb433230b9a6f53fef1578166ad2 [0,1,0,0,0,1|0,0,2]=4 2054 B12R1.226 C=C(C)CNc1cncc(c1)Cl 8ff2c626d592b54c53188019b1a73239 [0,1,0,0,0,1|0,0,2]=4 2055 B12R1.226 C=C(C)CNc1cncc(c1)F 2216f7448fc829a33649b8b9ed6ee1d6 [0,1,0,0,0,1|0,0,2]=4 2056 B12R1.226 C=C(C)CNc1cncc(c1)I 1e0bb88f58e4cad9210ad27f5196c5be [0,1,0,0,0,1|0,0,2]=4 2057 B12R1.226 C=C(C)COc1cncc(c1)C ea47d755acb2cbc91744a7a204e9fa27 [0,1,0,0,0,1|0,0,2]=4 2058 B12R1.226 C=C(C)COc1cncc(c1)Cl aaf5b37f17a8432321f085778f241170 [0,1,0,0,0,1|0,0,2]=4 2059 B12R1.226 C=C(C)COc1cncc(c1)F a1b8191d45d16f406bf93f3a780e95d6 [0,1,0,0,0,1|0,0,2]=4 2060 B12R1.226 C=C(C)COc1cncc(c1)I 83b0b6d99092e04b443726dd014936a1 [0,1,0,0,0,1|0,0,2]=4 2061 B12R1.226 CC(=O)CNc1cncc(c1)F 72ede5e37e35fcc8ab079e2a27873d52 [0,1,0,0,0,1|1,0,1]=4 2062 B12R1.226 CC(=O)NCc1cncc(c1)Br 98628582e14e1ea7e3b382b4593d9efa [0,1,0,0,0,1|1,0,1]=4 2063 B12R1.226 CC(=O)NCc1cncc(c1)C a0b0222bd9beefb065992dcbb0f9157d [0,1,0,0,0,1|1,0,1]=4 2064 B12R1.226 CC(=O)NCc1cncc(c1)Cl 8cfb134e8659701dd7549b104bf96d89 [0,1,0,0,0,1|1,0,1]=4 2065 B12R1.226 CC(=O)NCc1cncc(c1)F aa4ed4c60f5c266021a898f6861ab12a [0,1,0,0,0,1|1,0,1]=4 2066 B12R1.226 CC(=O)NCc1cncc(c1)O 6871085a4fa5a87c8288016f463922cc [0,1,0,0,0,1|1,0,1]=4 2067 B12R1.226 CC(C)CNc1cc(ccn1)Br 92e025e0f5a2b5ee3ca5c62e3c3e1dcc [0,1,0,0,0,1|2,0,0]=4 2068 B12R1.226 CC(C)CNc1cc(ccn1)Cl d2d6d3ca355190ba86f24e0a8858fa79 [0,1,0,0,0,1|2,0,0]=4 2069 B12R1.226 CC(C)CNc1cc(ccn1)F fefa2d67f700e4e010a470257d2f7319 [0,1,0,0,0,1|2,0,0]=4 2070 B12R1.226 CC(C)CNc1cc(ccn1)I 8615c250cd177f5b70fa7122f7be7ad9 [0,1,0,0,0,1|2,0,0]=4 2071 B12R1.226 CC(C)CNc1cc(cnn1)Br 7c62b0d3703020f71ba5d8b3884f1b65 [0,1,0,0,0,1|1,0,0]=3 2072 B12R1.226 CC(C)CNc1cc(cnn1)Cl c41eb2ed82c930c01a238ec154e3bc94 [0,1,0,0,0,1|1,0,0]=3 2073 B12R1.226 CC(C)CNc1cc[nH]c(=S)c1 6fa2bce60248fa1a55a78ba1b0e6f048 [0,1,0,0,0,1|2,0,0]=4 2074 B12R1.226 CC(C)CNc1cccc(c1)Br 47f96ede91384a2957a9f738bcf7cbb7 [0,1,0,0,0,1|1,0,0]=3 2075 B12R1.226 CC(C)CNc1cccc(c1)Cl b77efea477419bad137ef23a5b33cfdb [0,1,0,0,0,1|1,0,0]=3 2076 B12R1.226 CC(C)CNc1cccc(c1)F 4fe892f19d398f74f696f31fe8fec9d4 [0,1,0,0,0,1|1,0,0]=3 2077 B12R1.226 CC(C)CNc1cccc(c1)I a713b158e8d2e866fe5954e27f6736a8 [0,1,0,0,0,1|1,0,0]=3 2078 B12R1.226 CC(C)CNc1cccc(c1)S d8df0c59c2a95482a973f3e4b2ca8288 [0,1,0,0,0,1|1,0,0]=3 2079 B12R1.226 CC(C)CNc1cccc(n1)Br 7cbe956768fbcb50152ecf7d1bbee778 [0,1,0,0,0,1|2,0,0]=4 2080 B12R1.226 CC(C)CNc1cccc(n1)Cl 275fe9b94c6e556eab72865e8ebbfc62 [0,1,0,0,0,1|2,0,0]=4 2081 B12R1.226 CC(C)CNc1cccc(n1)F 642e3c48e9102d05aba90e53da3173d7 [0,1,0,0,0,1|2,0,0]=4 2082 B12R1.226 CC(C)CNc1cccc(n1)I fa3c8c557f38affcb6d5ab100906efef [0,1,0,0,0,1|2,0,0]=4 2083 B12R1.226 CC(C)CNc1ccnc(c1)Br b7f6e7319a4a3a503754e67c3ba677af [0,1,0,0,0,1|2,0,0]=4 2084 B12R1.226 CC(C)CNc1ccnc(c1)Cl 38b36b62c659df80d9a95e292196ebce [0,1,0,0,0,1|2,0,0]=4 2085 B12R1.226 CC(C)CNc1ccnc(c1)F 1bd28f05743f77b2f662056e62d42111 [0,1,0,0,0,1|2,0,0]=4 2086 B12R1.226 CC(C)CNc1ccnc(c1)I 56c42639de0d700bc834f828eafaa370 [0,1,0,0,0,1|2,0,0]=4 2087 B12R1.226 CC(C)CNc1cn[nH]c(=O)c1 35aeccb76afa052830a7374111b70bb6 [0,1,0,0,0,1|1,0,0]=3 2088 B12R1.226 CC(C)CNc1cn[nH]c(=O)n1 98bb22c60940b133f2f99fad596d0807 [0,1,0,0,0,1|2,0,0]=4 2089 B12R1.226 CC(C)CNc1cncc(c1)Br e1d37862732b58ed0d46ad2b442fe3ba [0,1,0,0,0,1|0,0,0]=2 2090 B12R1.226 CC(C)CNc1cncc(c1)Cl a05988a39f568b9d29f394a1d8d672cd [0,1,0,0,0,1|0,0,0]=2 2091 B12R1.226 CC(C)CNc1cncc(c1)F de5f8ad0fa30543c8eba1d330606506b [0,1,0,0,0,1|0,0,0]=2 2092 B12R1.226 CC(C)CNc1cncc(c1)I 794da77beffd2e94bc5b6bbef9ad3be2 [0,1,0,0,0,1|0,0,0]=2 2093 B12R1.226 CC(C)CNc1cncc(n1)Br b439d0926326d065e6e829a2f20bca9a [0,1,0,0,0,1|1,0,0]=3 2094 B12R1.226 CC(C)CNc1cncc(n1)Cl 76a9fed4d7e9f700a8e1b926b4728d7b [0,1,0,0,0,1|1,0,0]=3 2095 B12R1.226 CC(C)CNc1cncc(n1)F 008f5dc7da91d67bc715a7c979acc322 [0,1,0,0,0,1|1,0,0]=3 2096 B12R1.226 CC(C)CNc1cnnc(c1)Cl 772c84a05b1b0420e3b1c0a64d606c77 [0,1,0,0,0,1|1,0,0]=3 2097 B12R1.226 CC(C)CNc1cnnc(c1)F 4d7079b7881de412d95f71f5b0f8e388 [0,1,0,0,0,1|1,0,0]=3 2098 B12R1.226 CC(C)CNc1cnnc(n1)Cl 3869c6a235d9c185f051b24b745f5cf7 [0,1,0,0,0,1|2,0,0]=4 2099 B12R1.226 CC(C)COc1cc(ccn1)Br f34d9e1ee8531a4e480a1dab2ae0a766 [0,1,0,0,0,1|2,0,0]=4 2100 B12R1.226 CC(C)COc1cc(ccn1)Cl 876f25ea2e7c43d383155eac009ff9ac [0,1,0,0,0,1|2,0,0]=4 2101 B12R1.226 CC(C)COc1cc(ccn1)F f833658a0f7dc9066d84a60638d4b26c [0,1,0,0,0,1|2,0,0]=4 2102 B12R1.226 CC(C)COc1ccc[n+](c1)[O-] 7bd89c5d1cf67818819101f40977c4c5 [0,1,0,0,0,1|0,0,1]=3 2103 B12R1.226 CC(C)COc1cccc(=O)[nH]1 ad01ea304d19906638e478d39a2e0124 [0,1,0,0,0,1|2,0,0]=4 2104 B12R1.226 CC(C)COc1cccc(c1)Br 78b9893bdd66fbb7fd676a9f9d9a6b5c [0,1,0,0,0,1|1,0,0]=3 2105 B12R1.226 CC(C)COc1cccc(c1)Cl 17fc81f1248afd3345d318121f9a6be5 [0,1,0,0,0,1|1,0,0]=3 2106 B12R1.226 CC(C)COc1cccc(c1)F 952f6b6f6d9d7e5903334a6085f9ca2b [0,1,0,0,0,1|1,0,0]=3 2107 B12R1.226 CC(C)COc1cccc(c1)I 825de32ad6ba816c4a9b0b15d9f5b09d [0,1,0,0,0,1|1,0,0]=3 2108 B12R1.226 CC(C)COc1cccc(c1)S 1e2cf6d2ce302e2dbeb13d96800a69ca [0,1,0,0,0,1|1,0,0]=3 2109 B12R1.226 CC(C)COc1cccc(n1)Br b034d8c99d6faa3c6865be3de5d1442b [0,1,0,0,0,1|2,0,0]=4 2110 B12R1.226 CC(C)COc1cccc(n1)F 62d939db865eee29d08bcd45e7a528d8 [0,1,0,0,0,1|2,0,0]=4 2111 B12R1.226 CC(C)COc1ccnc(c1)Br ee849173a5a5c4349d085cdc486c9b3d [0,1,0,0,0,1|2,0,0]=4 2112 B12R1.226 CC(C)COc1ccnc(c1)Cl 679d6a5727deb8c64975da6c5556c5ff [0,1,0,0,0,1|2,0,0]=4 2113 B12R1.226 CC(C)COc1ccnc(c1)F 4a5d6ec80c2f156124d7c2b22754a005 [0,1,0,0,0,1|2,0,0]=4 2114 B12R1.226 CC(C)COc1cncc(c1)Br 4dedea8b7dbd937fa79e1f0cc22c2bb9 [0,1,0,0,0,1|0,0,0]=2 2115 B12R1.226 CC(C)COc1cncc(c1)Cl 59840de6f9ae77e1a87386e35ac7e867 [0,1,0,0,0,1|0,0,0]=2 2116 B12R1.226 CC(C)COc1cncc(c1)F 639ce80f70067fb9c55b302b07f69de6 [0,1,0,0,0,1|0,0,0]=2 2117 B12R1.226 CC(C)COc1cncc(c1)I f4bb8d8afe699062abc94a3155f1deaa [0,1,0,0,0,1|0,0,0]=2 2118 B12R1.226 CC(C)COc1cncc(n1)Br 5e492240ee1a09ca358095322a7f0c27 [0,1,0,0,0,1|1,0,0]=3 2119 B12R1.226 CC(C)COc1cncc(n1)Cl 38184b24b7b8d51c406bdb92fb50d31d [0,1,0,0,0,1|1,0,0]=3 2120 B12R1.226 CC(C)COc1cnnc(c1)Cl bd7df266e86b983673465e007a46eb1d [0,1,0,0,0,1|1,0,0]=3 2121 B12R1.226 CC(C)NCc1cc(ccn1)Br 8e80878aa33f629cad82435a04ceb908 [0,1,0,0,0,1|2,0,0]=4 2122 B12R1.226 CC(C)NCc1cc(ccn1)Cl 32e06332ef624538e73eda4739130df1 [0,1,0,0,0,1|2,0,0]=4 2123 B12R1.226 CC(C)NCc1cc[nH]c(=O)c1 a9d3b7042d066144e705a5aefd7af7a3 [0,1,0,0,0,1|2,0,0]=4 2124 B12R1.226 CC(C)NCc1ccc[n+](c1)[O-] 9ce22988e76f5dc081315f40c755b50e [0,1,0,0,0,1|0,0,1]=3 2125 B12R1.226 CC(C)NCc1cccc(c1)Br 1c3c944c566959e7eef7efc9a8c8251c [0,1,0,0,0,1|1,0,0]=3 2126 B12R1.226 CC(C)NCc1cccc(c1)Cl 9dbc94fad7d16f41b15b3aebc8ca545b [0,1,0,0,0,1|1,0,0]=3 2127 B12R1.226 CC(C)NCc1cccc(c1)F 3787b7b4f5a6fda7587bfa332950191c [0,1,0,0,0,1|1,0,0]=3 2128 B12R1.226 CC(C)NCc1cccc(c1)I d4cf7394a008619606fd5e038404d76e [0,1,0,0,0,1|1,0,0]=3 2129 B12R1.226 CC(C)NCc1cccc(n1)Br 92981f813a24d8d775368435b84eaa2a [0,1,0,0,0,1|2,0,0]=4 2130 B12R1.226 CC(C)NCc1cccc(n1)Cl aa1ee281695a9ad7738f13543541b870 [0,1,0,0,0,1|2,0,0]=4 2131 B12R1.226 CC(C)NCc1cccc(n1)F d5092e57e9a868be90528ab937b42467 [0,1,0,0,0,1|2,0,0]=4 2132 B12R1.226 CC(C)NCc1ccnc(c1)Br 4e955cd75cbd32217324fe06a5f62d16 [0,1,0,0,0,1|2,0,0]=4 2133 B12R1.226 CC(C)NCc1ccnc(c1)Cl c3a0e82e1c5d8e071306a6e2c2031c2a [0,1,0,0,0,1|2,0,0]=4 2134 B12R1.226 CC(C)NCc1ccnc(c1)F 855389c627a9d2d3a26eb81ea5120d6e [0,1,0,0,0,1|2,0,0]=4 2135 B12R1.226 CC(C)NCc1cncc(c1)Cl 1beac4c811c386bd882c5994a0320252 [0,1,0,0,0,1|0,0,0]=2 2136 B12R1.226 CC(C)NCc1cncc(c1)F e2080bbe71ccb9f6d9cbbca121cbe88f [0,1,0,0,0,1|0,0,0]=2 2137 B12R1.226 CC(C)NCc1cncc(n1)Cl beb266a97cc9b37847c137031bb8f85a [0,1,0,0,0,1|1,0,0]=3 2138 B12R1.226 CC(C)OCc1cc(ccn1)Br 9932eefd1b7919be677ec4d9584bc46e [0,1,0,0,0,1|2,0,0]=4 2139 B12R1.226 CC(C)OCc1cc(ccn1)Cl 6dc5ed2046731d52a661701cd5d846d3 [0,1,0,0,0,1|2,0,0]=4 2140 B12R1.226 CC(C)OCc1cc(ccn1)F f1226fa30365aecf5c0399c4c40863a8 [0,1,0,0,0,1|2,0,0]=4 2141 B12R1.226 CC(C)OCc1cc(ccn1)I e74abf2de8912acb35da5a89ba1deed6 [0,1,0,0,0,1|2,0,0]=4 2142 B12R1.226 CC(C)OCc1cc[nH]c(=O)c1 85d906cbf41d5a15f8bc6c1395069ebe [0,1,0,0,0,1|2,0,0]=4 2143 B12R1.226 CC(C)OCc1ccc[n+](c1)[O-] d38acb4354d307073691091144cd615b [0,1,0,0,0,1|0,0,1]=3 2144 B12R1.226 CC(C)OCc1cccc(c1)Br 879562350b15275860c09e604131f21c [0,1,0,0,0,1|1,0,0]=3 2145 B12R1.226 CC(C)OCc1cccc(c1)Cl c3629f30972b60636a5bcff8690532c9 [0,1,0,0,0,1|1,0,0]=3 2146 B12R1.226 CC(C)OCc1cccc(c1)F 9a739aed0fdfe4226f0a5132088c54a0 [0,1,0,0,0,1|1,0,0]=3 2147 B12R1.226 CC(C)OCc1cccc(c1)I bf4c5f71e0f6d55a1580b32357b1183d [0,1,0,0,0,1|1,0,0]=3 2148 B12R1.226 CC(C)OCc1cccc(n1)Br 35fa467c36dfbeeeb465ccad65fa5030 [0,1,0,0,0,1|2,0,0]=4 2149 B12R1.226 CC(C)OCc1cccc(n1)Cl 9428a85a94900d1b57fec614b8d404d0 [0,1,0,0,0,1|2,0,0]=4 2150 B12R1.226 CC(C)OCc1cccc(n1)F 97b1015e3c5a2a7f62c00be27b547db2 [0,1,0,0,0,1|2,0,0]=4 2151 B12R1.226 CC(C)OCc1cccc(n1)I bb69f335dbd7852f08b40a535b49fbee [0,1,0,0,0,1|2,0,0]=4 2152 B12R1.226 CC(C)OCc1ccnc(c1)Br a129fd8f23288caa4054dfc29ac5eb88 [0,1,0,0,0,1|2,0,0]=4 2153 B12R1.226 CC(C)OCc1ccnc(c1)Cl 1cde8935647c5b7477594cd8497eb539 [0,1,0,0,0,1|2,0,0]=4 2154 B12R1.226 CC(C)OCc1ccnc(c1)F 6b057a32826a40ca519dab472d51b7eb [0,1,0,0,0,1|2,0,0]=4 2155 B12R1.226 CC(C)OCc1cncc(c1)Br ae9940374847da64ff378c9e72639058 [0,1,0,0,0,1|0,0,0]=2 2156 B12R1.226 CC(C)OCc1cncc(c1)Cl a8d8ad9bc31d1803aaf9b8722356b9ab [0,1,0,0,0,1|0,0,0]=2 2157 B12R1.226 CC(C)OCc1cncc(c1)F 9f506b2078438f04c43df9245dc018b1 [0,1,0,0,0,1|0,0,0]=2 2158 B12R1.226 CC(C)OCc1cncc(c1)I 4b26f759d15ef95a86ae863dc2ee2fb0 [0,1,0,0,0,1|0,0,0]=2 2159 B12R1.226 CC(C)OCc1cncc(n1)Cl 36cff3a82d9a9b0ddcd089b4c4011a1e [0,1,0,0,0,1|1,0,0]=3 2160 B12R1.226 CC(O)CNc1cc(cnn1)Br 888f26521393825b95116a696d653f84 [0,1,0,0,0,1|2,0,0]=4 2161 B12R1.226 CC(O)CNc1cc(cnn1)Cl 0e9319fab4d929dbf651d2cdc938f329 [0,1,0,0,0,1|2,0,0]=4 2162 B12R1.226 CC(O)CNc1cccc(c1)Br 1313cc150d07e3249eb16f742927aba5 [0,1,0,0,0,1|2,0,0]=4 2163 B12R1.226 CC(O)CNc1cccc(c1)Cl b0b36293e53ebea3215e5b365b1c91a1 [0,1,0,0,0,1|2,0,0]=4 2164 B12R1.226 CC(O)CNc1cccc(c1)F 7b51f8f85220316ed6f71fbb6c6e04a1 [0,1,0,0,0,1|2,0,0]=4 2165 B12R1.226 CC(O)CNc1cccc(c1)I e3b39e215b46b137d14817575c01ba24 [0,1,0,0,0,1|2,0,0]=4 2166 B12R1.226 CC(O)CNc1cccc(c1)S 78e49f113d0630c078debe2e470f3646 [0,1,0,0,0,1|2,0,0]=4 2167 B12R1.226 CC(O)CNc1cn[nH]c(=O)c1 dc036fbeb4787da84278288aee236deb [0,1,0,0,0,1|2,0,0]=4 2168 B12R1.226 CC(O)CNc1cncc(c1)Br fc8eb3052bf1ddf413f1b8865c1db6e3 [0,1,0,0,0,1|1,0,0]=3 2169 B12R1.226 CC(O)CNc1cncc(c1)Cl 4a8053a285dce96c427cf3e32cf583b6 [0,1,0,0,0,1|1,0,0]=3 2170 B12R1.226 CC(O)CNc1cncc(c1)F cb6b848bcd5792e0288b2cef34b25331 [0,1,0,0,0,1|1,0,0]=3 2171 B12R1.226 CC(O)CNc1cncc(c1)I a60ccf3153cdfd1a71cfabf6e4af740c [0,1,0,0,0,1|1,0,0]=3 2172 B12R1.226 CC(O)CNc1cncc(n1)Br 33f1a478d8cc5ce347621abfd2874687 [0,1,0,0,0,1|2,0,0]=4 2173 B12R1.226 CC(O)CNc1cncc(n1)Cl 8cab8eccaa3e550304b77b1cb5af6a07 [0,1,0,0,0,1|2,0,0]=4 2174 B12R1.226 CC(O)CNc1cncc(n1)F 47d55a68f70eb49a4c542cd72f36a420 [0,1,0,0,0,1|2,0,0]=4 2175 B12R1.226 CC(O)CNc1cnnc(c1)Cl 5b994ced50021bfd5fb0958e74d483f9 [0,1,0,0,0,1|2,0,0]=4 2176 B12R1.226 CC(O)CNc1cnnc(c1)F 1f0b46055c69425c40d12a443bdc9bb1 [0,1,0,0,0,1|2,0,0]=4 2177 B12R1.226 CN(C)CNc1cc(cnn1)Br 1b5a6e683e398ff991b82279d3d4cacd [0,1,0,0,0,1|2,0,0]=4 2178 B12R1.226 CN(C)CNc1cc(cnn1)Cl 32f199a647d7d5d97062eaf14e6cdff9 [0,1,0,0,0,1|2,0,0]=4 2179 B12R1.226 CN(C)CNc1cccc(c1)Br a9db52ec4d18e43fd5f8052a16d9b2f5 [0,1,0,0,0,1|2,0,0]=4 2180 B12R1.226 CN(C)CNc1cccc(c1)Cl b91ebc3860602b7d435fbc25bba120c0 [0,1,0,0,0,1|2,0,0]=4 2181 B12R1.226 CN(C)CNc1cccc(c1)F fabc161cc8935ed63e4bf8f7340eeb1b [0,1,0,0,0,1|2,0,0]=4 2182 B12R1.226 CN(C)CNc1cccc(c1)I 73b573d1bee26bd55249f0d50a8760e1 [0,1,0,0,0,1|2,0,0]=4 2183 B12R1.226 CN(C)CNc1cccc(c1)S 8b408beb2995a69d831e59e74ceea8c7 [0,1,0,0,0,1|2,0,0]=4 2184 B12R1.226 CN(C)CNc1cn[nH]c(=O)c1 1b3c1dc0cc47746cbfaef06a0e4b6636 [0,1,0,0,0,1|2,0,0]=4 2185 B12R1.226 CN(C)CNc1cncc(c1)Cl 2ea2821428cb668b0b0c770cf0e176dd [0,1,0,0,0,1|1,0,0]=3 2186 B12R1.226 CN(C)CNc1cncc(c1)F 00377ff2f0ca52f475b11c57baa19003 [0,1,0,0,0,1|1,0,0]=3 2187 B12R1.226 CN(C)CNc1cncc(c1)I cb0814bcb0ec33a7cce2317b7c3c6e72 [0,1,0,0,0,1|1,0,0]=3 2188 B12R1.226 CN(C)CNc1cncc(n1)F 7ccd42952384b12c904d65b6872faaef [0,1,0,0,0,1|2,0,0]=4 2189 B12R1.226 CN(C)CNc1cnnc(c1)Cl 31018b1c9002032cba9c4019c54ddceb [0,1,0,0,0,1|2,0,0]=4 2190 B12R1.226 CN(C)CNc1cnnc(c1)F 967a4cf74c78f6a7212c217d595ab9e2 [0,1,0,0,0,1|2,0,0]=4 2191 B12R1.226 CN(C)COc1ccc[n+](c1)[O-] d6d76cffa6be61c810a96498f0d1efc6 [0,1,0,0,0,1|1,0,1]=4 2192 B12R1.226 CN(C)COc1cccc(c1)Br 58f441b0ca3290c7f2d4537ec22a4d7a [0,1,0,0,0,1|2,0,0]=4 2193 B12R1.226 CN(C)COc1cccc(c1)Cl a81bc88b54f5005184b834642d9d3f86 [0,1,0,0,0,1|2,0,0]=4 2194 B12R1.226 CN(C)COc1cccc(c1)F 58b8398ab333a20e468588e9a1f2ba62 [0,1,0,0,0,1|2,0,0]=4 2195 B12R1.226 CN(C)COc1cccc(c1)I d82dc4d136e4cc08f2e0c8e654992b65 [0,1,0,0,0,1|2,0,0]=4 2196 B12R1.226 CN(C)COc1cccc(c1)S bcd4099b9a40b45e56f4b34dede1ec79 [0,1,0,0,0,1|2,0,0]=4 2197 B12R1.226 CN(C)COc1cncc(c1)Cl cc960cc7897840deac40f96de627932f [0,1,0,0,0,1|1,0,0]=3 2198 B12R1.226 CN(C)COc1cncc(c1)F aaf27a44e2849b1c951ce7408692fe8e [0,1,0,0,0,1|1,0,0]=3 2199 B12R1.226 CN(C)COc1cncc(c1)I 4fd4491cbaf6683178fc58b683520e17 [0,1,0,0,0,1|1,0,0]=3 2200 B12R1.226 CN(C)COc1cncc(n1)Br 036be35f0096b34973b0f51fdd832fe6 [0,1,0,0,0,1|2,0,0]=4 2201 B12R1.226 CN(C)COc1cncc(n1)Cl dae375659f60ec04eba5ca711815ddc0 [0,1,0,0,0,1|2,0,0]=4 2202 B12R1.226 CN(C)COc1cnnc(c1)Cl 00a1775f8319cbd73bf61321c76741a1 [0,1,0,0,0,1|2,0,0]=4 2203 B12R1.226 C[C@@H](O)CNc1cc(cnn1)Br a8d5808180712bb8015528e2f65aee73 [0,1,0,0,0,1|2,0,0]=4 2204 B12R1.226 C[C@@H](O)CNc1cccc(c1)Br 7f47c7e325073bbe1ddb7b38bff8b932 [0,1,0,0,0,1|2,0,0]=4 2205 B12R1.226 C[C@@H](O)CNc1cccc(c1)Cl 8246dcd52dcd9ed0dbef7338a7f127b3 [0,1,0,0,0,1|2,0,0]=4 2206 B12R1.226 C[C@@H](O)CNc1cccc(c1)F e736be531156c2b7166ca634fb8a70ce [0,1,0,0,0,1|2,0,0]=4 2207 B12R1.226 C[C@@H](O)CNc1cccc(c1)I 4db71a0fd089913b0233a85b00396803 [0,1,0,0,0,1|2,0,0]=4 2208 B12R1.226 C[C@@H](O)CNc1cn[nH]c(=O)c1 f1e9db9731d9abce6708f56a79118d98 [0,1,0,0,0,1|2,0,0]=4 2209 B12R1.226 C[C@@H](O)CNc1cncc(c1)Cl 9c2d006a345a336b57e335fe828be629 [0,1,0,0,0,1|1,0,0]=3 2210 B12R1.226 C[C@@H](O)CNc1cncc(c1)F 3b97406ad533c2c660aa09de33e1cbfa [0,1,0,0,0,1|1,0,0]=3 2211 B12R1.226 C[C@@H](O)CNc1cncc(c1)I 6ee4ec67faef77ee55359e9b44f7ed3d [0,1,0,0,0,1|1,0,0]=3 2212 B12R1.226 C[C@@H](O)CNc1cnnc(c1)Cl 7d0d78e979642ef7808e5eb98c98ba7c [0,1,0,0,0,1|2,0,0]=4 2213 B12R1.226 C[C@H](O)CNc1cc(cnn1)Br 848d96a1dfb974b900cecfc96ea87be5 [0,1,0,0,0,1|2,0,0]=4 2214 B12R1.226 C[C@H](O)CNc1cc(cnn1)Cl 30a5143cb5621ada39e53c34dc8d9d67 [0,1,0,0,0,1|2,0,0]=4 2215 B12R1.226 C[C@H](O)CNc1cccc(c1)Br a49c8030ae048c6affea28034df1531a [0,1,0,0,0,1|2,0,0]=4 2216 B12R1.226 C[C@H](O)CNc1cccc(c1)Cl 2370f8fa6414cdc9dd596258b1f50ab7 [0,1,0,0,0,1|2,0,0]=4 2217 B12R1.226 C[C@H](O)CNc1cccc(c1)F 81dcc6ac1cc4da1e70d103a206dd18af [0,1,0,0,0,1|2,0,0]=4 2218 B12R1.226 C[C@H](O)CNc1cccc(c1)I f90f80969bfd6ec1423e67f3dd3ecafa [0,1,0,0,0,1|2,0,0]=4 2219 B12R1.226 C[C@H](O)CNc1cccc(c1)S 0421b4bf0fcc630d12159982ed02f691 [0,1,0,0,0,1|2,0,0]=4 2220 B12R1.226 C[C@H](O)CNc1cn[nH]c(=O)c1 a8f326cd21bfc0bb0d23141a12064c1f [0,1,0,0,0,1|2,0,0]=4 2221 B12R1.226 C[C@H](O)CNc1cncc(c1)Br 695ae5760ac9c2c44e85378edfdae2ba [0,1,0,0,0,1|1,0,0]=3 2222 B12R1.226 C[C@H](O)CNc1cncc(c1)Cl 76e576e540f9c330176b3eb0b27ae183 [0,1,0,0,0,1|1,0,0]=3 2223 B12R1.226 C[C@H](O)CNc1cncc(c1)F 380df7038475fed73e414ddfc49473f4 [0,1,0,0,0,1|1,0,0]=3 2224 B12R1.226 C[C@H](O)CNc1cncc(c1)I 9097c77693e818acf3b1d0abefbd3802 [0,1,0,0,0,1|1,0,0]=3 2225 B12R1.226 C[C@H](O)CNc1cncc(n1)Br 451fc0834473310156486ed98936b921 [0,1,0,0,0,1|2,0,0]=4 2226 B12R1.226 C[C@H](O)CNc1cncc(n1)Cl a712814fae992b30c8e05cace850ffab [0,1,0,0,0,1|2,0,0]=4 2227 B12R1.226 C[C@H](O)CNc1cncc(n1)F 2ab95e41d5f8560d00da915943925824 [0,1,0,0,0,1|2,0,0]=4 2228 B12R1.226 C[C@H](O)CNc1cnnc(c1)Cl 499ccadceae1e51df3178d44d33090db [0,1,0,0,0,1|2,0,0]=4 2229 B12R1.226 C[C@H](O)CNc1cnnc(c1)F 21c7e930ba0fff532d3f0e45c0845a2d [0,1,0,0,0,1|2,0,0]=4 2230 B12R1.226 Cc1cc(ccn1)CNC(C)C 85e45bfc3c207c3638bd5e2c8259642e [0,1,0,0,0,1|2,0,0]=4 2231 B12R1.226 Cc1cc(ccn1)COC(C)C 01df0a32ec3b2c2a15bb77b36a0acd44 [0,1,0,0,0,1|2,0,0]=4 2232 B12R1.226 Cc1cc(ccn1)NCC(C)C 3fdba0792b03b1655ba47f333666e4eb [0,1,0,0,0,1|2,0,0]=4 2233 B12R1.226 Cc1cc(ccn1)OCC(C)C b5eb16a2ea6a09b6bd3df3b0ea4e9788 [0,1,0,0,0,1|2,0,0]=4 2234 B12R1.226 Cc1cccc(c1)CNC(C)C 409614b24510f7aec784aa24e2d29ef2 [0,1,0,0,0,1|1,0,0]=3 2235 B12R1.226 Cc1cccc(c1)COC(C)C ac14bed03bb08492372420f353b99c52 [0,1,0,0,0,1|1,0,0]=3 2236 B12R1.226 Cc1cccc(c1)NCC(C)C 4d0c9075dc953be03bb974637f4ee812 [0,1,0,0,0,1|1,0,0]=3 2237 B12R1.226 Cc1cccc(c1)NCC(C)O 6ec20ee81cd6564f027fad7c9046635a [0,1,0,0,0,1|2,0,0]=4 2238 B12R1.226 Cc1cccc(c1)NCN(C)C f60eeb0a22d178d4adde33f0517fefb6 [0,1,0,0,0,1|2,0,0]=4 2239 B12R1.226 Cc1cccc(c1)NC[C@@H](C)O b7ae52517241209d5ba2933489a9a337 [0,1,0,0,0,1|2,0,0]=4 2240 B12R1.226 Cc1cccc(c1)NC[C@H](C)O 1a909dc0c3197c842cec2d227814451e [0,1,0,0,0,1|2,0,0]=4 2241 B12R1.226 Cc1cccc(c1)OCC(C)C a573d64150ab49ed03c4bef1c7ab030b [0,1,0,0,0,1|1,0,0]=3 2242 B12R1.226 Cc1cccc(c1)OCN(C)C c8f371c842f7e29ba772757895b8b2d4 [0,1,0,0,0,1|2,0,0]=4 2243 B12R1.226 Cc1cccc(n1)CNC(C)C 193c586811e8cd7a5541b12d9c26503c [0,1,0,0,0,1|2,0,0]=4 2244 B12R1.226 Cc1cccc(n1)COC(C)C a8c2bc277290339bbc2222ef578b71a7 [0,1,0,0,0,1|2,0,0]=4 2245 B12R1.226 Cc1cccc(n1)NCC(C)C 690c1bd26f6de02ab0577df7d32212ca [0,1,0,0,0,1|2,0,0]=4 2246 B12R1.226 Cc1cccc(n1)OCC(C)C af20de35cd01146532ced994d2c6db13 [0,1,0,0,0,1|2,0,0]=4 2247 B12R1.226 Cc1ccnc(c1)CNC(C)C 99e05fe61e0126c3de92bf40ba9c20cd [0,1,0,0,0,1|2,0,0]=4 2248 B12R1.226 Cc1ccnc(c1)COC(C)C 9cf6c87bb1aeb8968300667a319e43b5 [0,1,0,0,0,1|2,0,0]=4 2249 B12R1.226 Cc1ccnc(c1)NCC(C)C 30516c36b70bbf57d4d6b22c37df495e [0,1,0,0,0,1|2,0,0]=4 2250 B12R1.226 Cc1ccnc(c1)OCC(C)C 321f3a5a160bdb50bed95c845440f7c6 [0,1,0,0,0,1|2,0,0]=4 2251 B12R1.226 Cc1cncc(c1)COC(C)C e26c34959a591f33a0f083cd95d6cc72 [0,1,0,0,0,1|0,0,0]=2 2252 B12R1.226 Cc1cncc(c1)NCC(C)C b2696ec0572661c2397dd77e1bb90c39 [0,1,0,0,0,1|0,0,0]=2 2253 B12R1.226 Cc1cncc(c1)NCC(C)O b294a425e1b2496a5059b3d30e4ae850 [0,1,0,0,0,1|1,0,0]=3 2254 B12R1.226 Cc1cncc(c1)NCC(F)F 77f00422d4b5e14c60c8be4f8515353c [0,1,0,0,0,1|2,0,0]=4 2255 B12R1.226 Cc1cncc(c1)NCN(C)C 3441068943eb9f43ef0500a090b76e62 [0,1,0,0,0,1|1,0,0]=3 2256 B12R1.226 Cc1cncc(c1)NC[C@@H](C)O 826a5a2883e032112179a32ef6422c41 [0,1,0,0,0,1|1,0,0]=3 2257 B12R1.226 Cc1cncc(c1)NC[C@H](C)O 4d98f7f58f71e7537b2412a834bb3b7c [0,1,0,0,0,1|1,0,0]=3 2258 B12R1.226 Cc1cncc(c1)OCC(C)C 6bdf0e37100da7cddffb0edcd615d3ff [0,1,0,0,0,1|0,0,0]=2 2259 B12R1.226 Cc1cncc(c1)OCC(F)F 9ff8d92b986ac07910dd2329ede7153d [0,1,0,0,0,1|2,0,0]=4 2260 B12R1.226 Cc1cncc(c1)OCN(C)C 09a74511ed57dfd7f4dca15208e83b97 [0,1,0,0,0,1|1,0,0]=3 2261 B12R1.226 Cc1cncc(n1)NCC(C)C 4e1a065365e254649cad424ac884ed47 [0,1,0,0,0,1|1,0,0]=3 2262 B12R1.226 Cc1cncc(n1)NCC(C)O cd24f6840b8446c24787af5d1aaecade [0,1,0,0,0,1|2,0,0]=4 2263 B12R1.226 Cc1cncc(n1)NC[C@H](C)O 14132f2e8cd1418960960db1ab71ff3f [0,1,0,0,0,1|2,0,0]=4 2264 B12R1.226 Cc1cncc(n1)OCC(C)C 6832eb67fb1de99f6796800735dca3ad [0,1,0,0,0,1|1,0,0]=3 2265 B12R1.226 Cc1cnnc(c1)COC(C)C 6123149d868b56ef7c72eedc79084244 [0,1,0,0,0,1|1,0,0]=3 2266 B12R1.226 Cc1cnnc(c1)NCC(C)C d4688ab50b4fb5800b8d979acdf2cca8 [0,1,0,0,0,1|1,0,0]=3 2267 B12R1.226 Cc1cnnc(c1)NCC(C)O 11d1ab13f2d12113f91cacfb046c6082 [0,1,0,0,0,1|2,0,0]=4 2268 B12R1.226 Cc1cnnc(c1)NCN(C)C 6f2d9758b5da114e57fd0ac981c3e4c1 [0,1,0,0,0,1|2,0,0]=4 2269 B12R1.226 Cc1cnnc(c1)NC[C@H](C)O b9ad09a01d53c99345768ca1f4990b3b [0,1,0,0,0,1|2,0,0]=4 2270 B12R1.226 Cc1nncc(n1)NCC(C)C 05b35377c21cb815519a5aae497ac0eb [0,1,0,0,0,1|2,0,0]=4 2271 B12R1.226 FC(F)CNc1cncc(c1)Br 017f47d29cee814cacf5f35063947866 [0,1,0,0,0,1|2,0,0]=4 2272 B12R1.226 FC(F)CNc1cncc(c1)Cl 43c7f49b867043d36cf14621d0c937a7 [0,1,0,0,0,1|2,0,0]=4 2273 B12R1.226 FC(F)CNc1cncc(c1)I ec43cb0dcf7c5483e6c155489d465a61 [0,1,0,0,0,1|2,0,0]=4 2274 B12R1.226 FC(F)COc1cncc(c1)Br 3ef6ebf1ff2be17cf32823e6ef27df76 [0,1,0,0,0,1|2,0,0]=4 2275 B12R1.226 FC(F)COc1cncc(c1)Cl 5731417ed23f3f46bb7acffda7495883 [0,1,0,0,0,1|2,0,0]=4 2276 B12R1.226 FC(F)COc1cncc(c1)I 6fe2dda2156cabb7660a9c2a6c85beb2 [0,1,0,0,0,1|2,0,0]=4 2277 B12R1.226 Fc1cncc(c1)NCC(F)F 505fb277f106a66f08cd64faf4219134 [0,1,0,0,0,1|2,0,0]=4 2278 B12R1.226 Fc1cncc(c1)OCC(F)F 56be1c21eec5834250d3ce386113287c [0,1,0,0,0,1|2,0,0]=4 2279 B12R1.891 CC(C)(C)CNc1ccccc1 866f0c000f012585c56b315997251133 [0,1,0,0,0,1|1,0,0]=3 2280 B12R1.891 CC(C)(C)CNc1ccccn1 825c8dcede6c8cbf2339b0b7c7d45e1b [0,1,0,0,0,1|2,0,0]=4 2281 B12R1.891 CC(C)(C)CNc1cccnc1 908c5da89c2bdb3f315cf4e834504505 [0,1,0,0,0,1|0,0,0]=2 2282 B12R1.891 CC(C)(C)CNc1cccnn1 feb033c8c3e79e2ccffefb9616065223 [0,1,0,0,0,1|1,0,0]=3 2283 B12R1.891 CC(C)(C)CNc1ccncc1 c7826f86c82660c7ba287f44da463481 [0,1,0,0,0,1|2,0,0]=4 2284 B12R1.891 CC(C)(C)CNc1ccnnc1 b806e676355462255756ee2817a8901d [0,1,0,0,0,1|1,0,0]=3 2285 B12R1.891 CC(C)(C)CNc1cnccn1 d79b42fd5d409d232fed1ad9655760a1 [0,1,0,0,0,1|1,0,0]=3 2286 B12R1.891 CC(C)(C)CNc1cncnc1 ec793bc28bf976789204a5d6e15dc4b2 [0,1,0,0,0,1|1,0,0]=3 2287 B12R1.891 CC(C)(C)CNc1cnncn1 ea925180f6e5fc0f9f59926573ca74ee [0,1,0,0,0,1|2,0,0]=4 2288 B12R1.891 CC(C)(C)CNc1nccnn1 bcf0bf08a34b40ec99e1558273276113 [0,1,0,0,0,1|2,0,0]=4 2289 B12R1.891 CC(C)(C)COc1ccccn1 421375595ba5ea063d0532b9ff9e5f28 [0,1,0,0,0,1|2,0,0]=4 2290 B12R1.891 CC(C)(C)COc1cccnc1 2989d2b8310518a29f31f2404a03d6a4 [0,1,0,0,0,1|0,0,0]=2 2291 B12R1.891 CC(C)(C)COc1ccncc1 5e962ee509d4432d5bb927399ceaf559 [0,1,0,0,0,1|2,0,0]=4 2292 B12R1.891 CC(C)(C)COc1ccnnc1 4dfb000c4e6d04cb74d3f090fb78e149 [0,1,0,0,0,1|1,0,0]=3 2293 B12R1.891 CC(C)(C)COc1cnccn1 08c3e3ac224502668d660c16b5cf7815 [0,1,0,0,0,1|1,0,0]=3 2294 B12R1.891 CC(C)(C)COc1cncnc1 c30c70eadfb26b529e35152c85acf017 [0,1,0,0,0,1|1,0,0]=3 2295 B12R1.891 CC(C)(C)COc1cncnn1 b8dab4fdc17f1152dbb3986d9028bd37 [0,1,0,0,0,1|2,0,0]=4 2296 B12R1.891 CC(C)(C)NCc1ccccc1 7201c1c22c9fa04427965e3124c0e1d6 [0,1,0,0,0,1|1,0,0]=3 2297 B12R1.891 CC(C)(C)NCc1ccccn1 0f37804617340fc0b75b0242b29a7097 [0,1,0,0,0,1|2,0,0]=4 2298 B12R1.891 CC(C)(C)NCc1cccnc1 e3606661dec28ebc372974ee9287b956 [0,1,0,0,0,1|0,0,0]=2 2299 B12R1.891 CC(C)(C)NCc1cccnn1 4586f5f0dfa64f2a19896d23b637ba0f [0,1,0,0,0,1|1,0,0]=3 2300 B12R1.891 CC(C)(C)NCc1cncnc1 cf8fe6ef34afdfdba6d604fa8d67bcd1 [0,1,0,0,0,1|1,0,0]=3 2301 B12R1.891 CC(C)(F)CNc1ccccc1 b0242d6e7e1a9c8e30a280dd6d0dab3d [0,1,0,0,0,1|1,0,0]=3 2302 B12R1.891 CC(C)(F)CNc1ccccn1 fe8adf03c8a78edde4b29e3da49427a0 [0,1,0,0,0,1|2,0,0]=4 2303 B12R1.891 CC(C)(F)CNc1cccnc1 84d6970d460bb9620346fcd71e6d6cff [0,1,0,0,0,1|0,0,0]=2 2304 B12R1.891 CC(C)(F)CNc1cccnn1 3e0a6384fbde010f2c142de5a2e1ad58 [0,1,0,0,0,1|1,0,0]=3 2305 B12R1.891 CC(C)(F)CNc1ccncc1 f43d2174ce529b3faed4f33e7967e657 [0,1,0,0,0,1|2,0,0]=4 2306 B12R1.891 CC(C)(F)CNc1ccnnc1 706f17ed385638f34c2def55b507ff5e [0,1,0,0,0,1|1,0,0]=3 2307 B12R1.891 CC(C)(F)CNc1cnccn1 975f522ef2cbaf36230db0523b152f94 [0,1,0,0,0,1|1,0,0]=3 2308 B12R1.891 CC(C)(F)CNc1cncnc1 13bf89fd11884fe1f567b2722965e40c [0,1,0,0,0,1|1,0,0]=3 2309 B12R1.891 CC(C)(F)CNc1cnncn1 3cb168fb31427891fdc10c109f856522 [0,1,0,0,0,1|2,0,0]=4 2310 B12R1.891 CC(C)(F)CNc1nccnn1 bc26d2f35464a6ac38a45058d91a97c3 [0,1,0,0,0,1|2,0,0]=4 2311 B12R1.891 CC(C)(F)COc1ccccn1 d504348a9adfc7199e45e6e9e59837a8 [0,1,0,0,0,1|2,0,0]=4 2312 B12R1.891 CC(C)(F)COc1cccnc1 850aad1ca43014e96566b0a1863b780e [0,1,0,0,0,1|0,0,0]=2 2313 B12R1.891 CC(C)(F)COc1ccncc1 7a538294d43fe85e5079e51e34b00043 [0,1,0,0,0,1|2,0,0]=4 2314 B12R1.891 CC(C)(F)COc1ccnnc1 070f4bcf6892cd081423348332d014da [0,1,0,0,0,1|1,0,0]=3 2315 B12R1.891 CC(C)(F)COc1cnccn1 124380c90a563e6a2b783065ba164017 [0,1,0,0,0,1|1,0,0]=3 2316 B12R1.891 CC(C)(F)COc1cncnc1 ed4018c6c438db4a4c9212f46826dad5 [0,1,0,0,0,1|1,0,0]=3 2317 B12R1.891 CC(C)(F)COc1cncnn1 7e4ebb1b48581973629b80c1b65be86a [0,1,0,0,0,1|2,0,0]=4 2318 B12R1.891 CC(C)(O)CNc1ccccc1 f100447f9f947bdcf8b3cb6f09283ae4 [0,1,0,0,0,1|1,0,0]=3 2319 B12R1.891 CC(C)(O)CNc1ccccn1 cf6912f661b3c01ae5b5537abe66db21 [0,1,0,0,0,1|2,0,0]=4 2320 B12R1.891 CC(C)(O)CNc1cccnc1 71ecef7e440c1fa3a1e1bd94fd82e500 [0,1,0,0,0,1|0,0,0]=2 2321 B12R1.891 CC(C)(O)CNc1cccnn1 7c8c2786f98a35d7b59489f754fe08a7 [0,1,0,0,0,1|1,0,0]=3 2322 B12R1.891 CC(C)(O)CNc1ccncc1 1bed3845b568ed539a76759be48529f6 [0,1,0,0,0,1|2,0,0]=4 2323 B12R1.891 CC(C)(O)CNc1ccnnc1 c673cd24cf2155bc33ecc2cfb1c64002 [0,1,0,0,0,1|1,0,0]=3 2324 B12R1.891 CC(C)(O)CNc1cnccn1 5f6fad78c4f9acccca78e396e21f481c [0,1,0,0,0,1|1,0,0]=3 2325 B12R1.891 CC(C)(O)CNc1cncnc1 6105284bcf8941061efe79403378a974 [0,1,0,0,0,1|1,0,0]=3 2326 B12R1.891 CC(C)(O)CNc1cnncn1 4c45f76348088c14ac37645cb8587a6d [0,1,0,0,0,1|2,0,0]=4 2327 B12R1.891 CC(C)(O)CNc1nccnn1 42fec05b674fb73aea579fc3dc565cf0 [0,1,0,0,0,1|2,0,0]=4 2328 B12R1.891 CC(C)(O)COc1ccccn1 fa2c8c78bdb754150fd86ac274e44221 [0,1,0,0,0,1|2,0,0]=4 2329 B12R1.891 CC(C)(O)COc1cccnc1 a9de8f0e83ed901e6844ff45d51f92a8 [0,1,0,0,0,1|0,0,0]=2 2330 B12R1.891 CC(C)(O)COc1ccncc1 c2673769e1a688b3690e43a7ffdece7f [0,1,0,0,0,1|2,0,0]=4 2331 B12R1.891 CC(C)(O)COc1ccnnc1 0629f6eef12880d2a18a2ec4473c1bb7 [0,1,0,0,0,1|1,0,0]=3 2332 B12R1.891 CC(C)(O)COc1cnccn1 6a16fcde8baf31ebc1dc609c106714f0 [0,1,0,0,0,1|1,0,0]=3 2333 B12R1.891 CC(C)(O)COc1cncnc1 412cfc0b8e7990190e94339b73870f77 [0,1,0,0,0,1|1,0,0]=3 2334 B12R1.891 CC(C)(O)COc1cncnn1 129d91eb8942e1f8c7c54539c7710995 [0,1,0,0,0,1|2,0,0]=4 2335 B12R1.891 CC(F)(F)CNc1ccccc1 082b0f20fce6d46920eb2d5531e00578 [0,1,0,0,0,1|2,0,0]=4 2336 B12R1.891 CC(F)(F)CNc1cccnc1 f5d103f74c34330848ce191a2459d5f0 [0,1,0,0,0,1|1,0,0]=3 2337 B12R1.891 CC(F)(F)CNc1cccnn1 656dad4b753ae36fc9d2879f61cae3cd [0,1,0,0,0,1|2,0,0]=4 2338 B12R1.891 CC(F)(F)CNc1ccnnc1 003455254988db493e6aaade7685c1dd [0,1,0,0,0,1|2,0,0]=4 2339 B12R1.891 CC(F)(F)CNc1cnccn1 00ed338d25ca4692018feaa9b332486f [0,1,0,0,0,1|2,0,0]=4 2340 B12R1.891 CC(F)(F)CNc1cncnc1 6e12c6a95fb72b8949b0eb894c6293fe [0,1,0,0,0,1|2,0,0]=4 2341 B12R1.891 CC(F)(F)COc1cccnc1 f30e2cb5ef51ad469935b8d6f12eba8a [0,1,0,0,0,1|1,0,0]=3 2342 B12R1.891 CC(F)(F)COc1ccnnc1 716897128c9346ce2146fb5a87a97b4b [0,1,0,0,0,1|2,0,0]=4 2343 B12R1.891 CC(F)(F)COc1cnccn1 ad138fa1cfd16f5e87e1363f79397397 [0,1,0,0,0,1|2,0,0]=4 2344 B12R1.891 CS(=O)(=O)CNc1cccnc1 bc1205c27fa00ddb029bdb628a8f9293 [0,1,0,0,0,1|2,0,0]=4 2345 B12R1.891 CS(=O)(=O)COc1cccnc1 55869bade54bf74458b38eccb71ab700 [0,1,0,0,0,1|2,0,0]=4 2346 B12R1.891 FC(F)(F)CNc1cccnc1 73af68222434fe648e48bee6a1d61324 [0,1,0,0,0,1|2,0,0]=4 2347 B12R1.891 FC(F)(F)COc1cccnc1 6d3e37ab90768c85dff03e0c64e7762a [0,1,0,0,0,1|2,0,0]=4 2348 B12R1.210 CC(C)Nc1cccccc1=O 2921b4ab837361cc235f2007222e8069 [0,1,0,0,0,1|2,0,0]=4 2349 B12R1.210 CC(C)Oc1cccccc1=O 497fe3f268ff186afcab35cafaea5e0a [0,1,0,0,0,1|2,0,0]=4 2350 B12R1.4 C#Cc1ccc(cc1)NC(C)C faa63853dbda923b2c126c30ff9bfa23 [0,2,0,0,0,0|2,0,0]=4 2351 B12R1.4 C#Cc1ccc(cc1)OC(C)C e3463961332c304b58817ff8d4b0b05b [0,2,0,0,0,0|2,0,0]=4 2352 B12R1.4 C#Cc1ccc(cn1)NC(C)C 3f67e8459058a51b0306a19bed99fa5a [0,2,0,0,0,0|1,0,0]=3 2353 B12R1.4 C#Cc1cnc(cn1)NC(C)C 8b2b5daea3cd56cd22f587d6ca5e26a0 [0,2,0,0,0,0|2,0,0]=4 2354 B12R1.4 C=Cc1ccc(cc1)NC(C)C 21a2df0a267e794d3f3240b8e563ad23 [0,2,0,0,0,0|2,0,0]=4 2355 B12R1.4 C=Cc1ccc(cc1)OC(C)C c83cc47632832c79bb2fdd3080632eb6 [0,2,0,0,0,0|2,0,0]=4 2356 B12R1.4 CC(C)Nc1ccc(cc1)C#N 34a536a6643fc1e460a58fed59492391 [0,2,0,0,0,0|2,0,0]=4 2357 B12R1.4 CC(C)Nc1ccc(cc1)C=O 62ba5962698d35c68b71a115e0b568ab [0,2,0,0,0,0|2,0,0]=4 2358 B12R1.4 CC(C)Nc1ccc(cc1)CO 2893829c5855e3498ec30daf5a92b3f9 [0,2,0,0,0,0|2,0,0]=4 2359 B12R1.4 CC(C)Nc1ccc(nc1)C#N 298612b442c05517bd6a207f441476a7 [0,2,0,0,0,0|1,0,0]=3 2360 B12R1.4 CC(C)Nc1ccc(nc1)C=O 0ea93230a92b171687c3dbcbb8c869fc [0,2,0,0,0,0|1,0,0]=3 2361 B12R1.4 CC(C)Nc1ccc(nc1)CO 366f9bf961ca1d27001fd1a89b57f52d [0,2,0,0,0,0|1,0,0]=3 2362 B12R1.4 CC(C)Nc1ccc(nn1)C#N 7703d3adcc544ae2577f170c4262fbf2 [0,2,0,0,0,0|2,0,0]=4 2363 B12R1.4 CC(C)Nc1cnc(cn1)C#N 09756a482a67c0022a3567f9b095064a [0,2,0,0,0,0|2,0,0]=4 2364 B12R1.4 CC(C)Nc1cnc(cn1)C=O 2a326d38420b9bd6be4f89bdc6f8148e [0,2,0,0,0,0|2,0,0]=4 2365 B12R1.4 CC(C)Nc1cnc(cn1)CO fd995c51d350f87f1b4e05af4545004c [0,2,0,0,0,0|2,0,0]=4 2366 B12R1.4 CC(C)Nc1cnc(nc1)C#N f5b6a34a9f8eb87120daaa0e4cf7244d [0,2,0,0,0,0|2,0,0]=4 2367 B12R1.4 CC(C)Nc1cnc(nc1)CO 106c8548907674f86cc2e5ad43d81ef4 [0,2,0,0,0,0|2,0,0]=4 2368 B12R1.4 CC(C)Oc1ccc(cc1)C#N 847015a9d4bd458f57d946e8956cc9c1 [0,2,0,0,0,0|2,0,0]=4 2369 B12R1.4 CC(C)Oc1ccc(cc1)C=O 2397d983c0762938a0582225e128d3b0 [0,2,0,0,0,0|2,0,0]=4 2370 B12R1.4 CC(C)Oc1ccc(cc1)N=O e461c6ac1751e2be8c322e20efd1c111 [0,2,0,0,0,0|2,0,0]=4 2371 B12R1.4 CC(C)Oc1ccc(nc1)C#N a9a35fb8783ffcac2965b83de803b107 [0,2,0,0,0,0|1,0,0]=3 2372 B12R1.4 CC(C)Oc1ccc(nc1)C=O 6bb7bf8fb082dfb640d3f4945d00337a [0,2,0,0,0,0|1,0,0]=3 2373 B12R1.4 CC(C)Oc1ccc(nn1)C=O 74eb9c0dc7df37a018257696f9c22d2c [0,2,0,0,0,0|2,0,0]=4 2374 B12R1.4 CC(C)Oc1cnc(nc1)C#N 9fd95ac6ad42b5aba8983e4ddae5d39b [0,2,0,0,0,0|2,0,0]=4 2375 B12R1.4 CC(C)Oc1cnc(nc1)CF 4f7c715457f980165ab44e0569cb3cb7 [0,2,0,0,0,0|2,0,0]=4 2376 B12R1.4 CCc1ccc(cc1)NC(C)C 3ed99f3debb7261e07191e58d03b9e98 [0,2,0,0,0,0|2,0,0]=4 2377 B12R1.4 CCc1ccc(cc1)OC(C)C c47fe5ab2b90199662fd8ab843de2974 [0,2,0,0,0,0|2,0,0]=4 2378 B12R1.4 CCc1ccc(cn1)NC(C)C 4bdaf5322c1240dc87cfbd7d6c48b9fc [0,2,0,0,0,0|1,0,0]=3 2379 B12R1.4 CCc1ccc(nn1)NC(C)C 7fc27cc5bac5fe9a3e6d76c2ed8f2f6d [0,2,0,0,0,0|2,0,0]=4 2380 B12R1.4 CCc1cnc(cn1)NC(C)C 750596f2a0e7379325055f3929385f78 [0,2,0,0,0,0|2,0,0]=4 2381 B12R1.4 CCc1cnc(cn1)OC(C)C 20caacddf763bec918fd143942402fa7 [0,2,0,0,0,0|2,0,0]=4 2382 B12R1.4 CCc1ncc(cn1)NC(C)C 910ea41aa748fae66fd0c259ad3ca5c5 [0,2,0,0,0,0|2,0,0]=4 2383 B12R1.4 COc1ccc(cc1)NC(C)C ad2f50ef0d3f01d7a0822fd855d76ce7 [0,2,0,0,0,0|2,0,0]=4 2384 B12R1.4 COc1ccc(cc1)OC(C)C 8ab9bf357f184746ac612b947f092324 [0,2,0,0,0,0|2,0,0]=4 2385 B12R1.4 COc1ccc(cn1)NC(C)C c3362d4fb4f2d791ad1ef8955849e43c [0,2,0,0,0,0|1,0,0]=3 2386 B12R1.4 COc1ccc(cn1)OC(C)C 9ef739a38a83780f0b70a82f0fce73c0 [0,2,0,0,0,0|1,0,0]=3 2387 B12R1.4 COc1ccc(nn1)NC(C)C af381bd1c32e87b563d69c2476b744cb [0,2,0,0,0,0|2,0,0]=4 2388 B12R1.4 COc1cnc(cn1)NC(C)C 286d2081fda8d783edf2f49819ab1d2a [0,2,0,0,0,0|2,0,0]=4 2389 B12R1.4 COc1ncc(cn1)NC(C)C 799ba10c41a5fc82385f90cda9760da8 [0,2,0,0,0,0|2,0,0]=4 2390 B12R1.4 COc1ncc(cn1)OC(C)C cbb3141a37c2b5b0af4c0f8b64710f06 [0,2,0,0,0,0|2,0,0]=4 2391 B12R1.4 CSc1ccc(cc1)NC(C)C 8046d202268d2a850a12d3ac6096b479 [0,2,0,0,0,0|2,0,0]=4 2392 B12R1.4 CSc1ccc(cc1)OC(C)C e0501229b5d29bc5e4bd3d8921e409c4 [0,2,0,0,0,0|2,0,0]=4 2393 B12R1.4 CSc1ccc(cn1)NC(C)C 4c994a6cca553e3e701cafacf129c7cd [0,2,0,0,0,0|1,0,0]=3 2394 B12R1.4 CSc1ccc(cn1)OC(C)C c8b09d15930bea4a2429fe6592a6bb58 [0,2,0,0,0,0|1,0,0]=3 2395 B12R1.4 CSc1cnc(cn1)NC(C)C 004fff7f017e787e4d42e63e0002be92 [0,2,0,0,0,0|2,0,0]=4 2396 B12R1.4 CSc1ncc(cn1)NC(C)C c83b76a206e83303e80898f23625efe1 [0,2,0,0,0,0|2,0,0]=4 2397 B12R1.4 CSc1ncc(cn1)OC(C)C e02418f6ef6b24f8317a14ef23f89ed5 [0,2,0,0,0,0|2,0,0]=4 2398 B12R1.19 CC(C)Nc1ccc(=O)n(c1)C 9c0221292f57b5c0d4de08a264d1423b [0,2,0,0,0,0|1,0,1]=4 2399 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)Br b369ed5242326319de549041b448327c [0,2,0,0,0,0|2,0,0]=4 2400 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)Cl 22d4ee5821101ae8df64d2c85dd7a714 [0,2,0,0,0,0|2,0,0]=4 2401 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)F d77fb612ec04987b4a2d7a4d8bae5ccd [0,2,0,0,0,0|2,0,0]=4 2402 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)I 77046461f5cf13e1ba1521b50cacaf97 [0,2,0,0,0,0|2,0,0]=4 2403 B12R1.19 CC(C)Nc1ccc(c(c1)F)F 5c5b02bedc482e4b3497b329f1f671fb [0,2,0,0,0,0|2,0,0]=4 2404 B12R1.19 CC(C)Nc1ccc(c(c1)I)Cl f96253bb05b12ab575df7a5ee9153550 [0,2,0,0,0,0|2,0,0]=4 2405 B12R1.19 CC(C)Nc1ccc(c(c1)I)F 611912689dfdfb6725c6a13ccb26d19a [0,2,0,0,0,0|2,0,0]=4 2406 B12R1.19 CC(C)Nc1cnc(c(c1)Br)Br cb4949364bc031d9a64c8ed2da592ead [0,2,0,0,0,0|1,0,0]=3 2407 B12R1.19 CC(C)Nc1cnc(c(c1)Br)Cl 9458d81df88449649a227b381d4e9ff2 [0,2,0,0,0,0|1,0,0]=3 2408 B12R1.19 CC(C)Nc1cnc(c(c1)Br)F f3104108adfcd04035f77be18f800a3f [0,2,0,0,0,0|1,0,0]=3 2409 B12R1.19 CC(C)Nc1cnc(c(c1)Br)I e29dfc0b42b2a0a2242abd8a6c20c671 [0,2,0,0,0,0|1,0,0]=3 2410 B12R1.19 CC(C)Nc1cnc(c(c1)Cl)Br 0946ad5d9c43bf860929a015f949eea0 [0,2,0,0,0,0|1,0,0]=3 2411 B12R1.19 CC(C)Nc1cnc(c(c1)Cl)Cl f49542f45ea554629ca9a41a987ac7d4 [0,2,0,0,0,0|1,0,0]=3 2412 B12R1.19 CC(C)Nc1cnc(c(c1)Cl)F 15ea368feac934d36686de1220784852 [0,2,0,0,0,0|1,0,0]=3 2413 B12R1.19 CC(C)Nc1cnc(c(c1)Cl)I f7732779bb6d9cb2f3b98b7be2cfca30 [0,2,0,0,0,0|1,0,0]=3 2414 B12R1.19 CC(C)Nc1cnc(c(c1)F)Br fedeb2d4f0599f036ef7a3fde7d48960 [0,2,0,0,0,0|1,0,0]=3 2415 B12R1.19 CC(C)Nc1cnc(c(c1)F)Cl 8d392cef7d69fa807a1838d34ae12cfa [0,2,0,0,0,0|1,0,0]=3 2416 B12R1.19 CC(C)Nc1cnc(c(c1)F)F 409f9260813bdd8e89dbeed8746ec0ad [0,2,0,0,0,0|1,0,0]=3 2417 B12R1.19 CC(C)Nc1cnc(c(c1)F)I 58405bea59f7e22bd3dbed223fa9d483 [0,2,0,0,0,0|1,0,0]=3 2418 B12R1.19 CC(C)Nc1cnc(c(c1)I)Br c780268e27864aaf885bc7e01dec4c02 [0,2,0,0,0,0|1,0,0]=3 2419 B12R1.19 CC(C)Nc1cnc(c(c1)I)Cl 3232cb5fc7a3b1e0d2a86aab8553ea6f [0,2,0,0,0,0|1,0,0]=3 2420 B12R1.19 CC(C)Nc1cnc(c(n1)Br)Br cae667325664b9cb8ad166c9d6522749 [0,2,0,0,0,0|2,0,0]=4 2421 B12R1.19 CC(C)Nc1cnc(c(n1)Br)Cl bb44a92477674261548d190939520bcd [0,2,0,0,0,0|2,0,0]=4 2422 B12R1.19 CC(C)Nc1cnc(c(n1)Cl)Cl bfb8c656df0c6ceb6376ad7039ea5d65 [0,2,0,0,0,0|2,0,0]=4 2423 B12R1.19 CC(C)Nc1cnc(c(n1)Cl)I 11d5356054d645cff23b455e07370fb5 [0,2,0,0,0,0|2,0,0]=4 2424 B12R1.19 CC(C)Nc1cnn(c(=O)c1)C 69b2be6cb3f39a3dcecea90ff35311d9 [0,2,0,0,0,0|2,0,0]=4 2425 B12R1.19 CC(C)Oc1ccc(=O)n(c1)C 43ad4dd539cf1054dddc6d32ba53d7fd [0,2,0,0,0,0|1,0,1]=4 2426 B12R1.19 CC(C)Oc1ccc(c(c1)Br)F 12eb2f9753091ba98626f62906e34e37 [0,2,0,0,0,0|2,0,0]=4 2427 B12R1.19 CC(C)Oc1ccc(c(c1)Br)I aeae001b4f2b70e76888779d1cf0575d [0,2,0,0,0,0|2,0,0]=4 2428 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Br 41796fe73b9344a6304772b13f64377f [0,2,0,0,0,0|2,0,0]=4 2429 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Cl 3ece42e9595a4a4ef84158ba453f7259 [0,2,0,0,0,0|2,0,0]=4 2430 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)F 2cdd96dcb84bb1e444173482c2bd231a [0,2,0,0,0,0|2,0,0]=4 2431 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)I 363ed77c7fe91ebfc1bf1ff0db68fd49 [0,2,0,0,0,0|2,0,0]=4 2432 B12R1.19 CC(C)Oc1ccc(c(c1)F)Br c57e1d6b89e6f99f48625b01da44367c [0,2,0,0,0,0|2,0,0]=4 2433 B12R1.19 CC(C)Oc1ccc(c(c1)F)Cl d2b161123989ec1c2d9ff6fd03edc77e [0,2,0,0,0,0|2,0,0]=4 2434 B12R1.19 CC(C)Oc1ccc(c(c1)F)F 53b94052b09010f9ba67debc97cf50e5 [0,2,0,0,0,0|2,0,0]=4 2435 B12R1.19 CC(C)Oc1ccc(c(c1)F)I cad1e4d0d62c4b58333033a0e064f714 [0,2,0,0,0,0|2,0,0]=4 2436 B12R1.19 CC(C)Oc1ccc(c(c1)I)Cl cf373709cdc6a1f28422bf10509ded55 [0,2,0,0,0,0|2,0,0]=4 2437 B12R1.19 CC(C)Oc1ccc(c(c1)I)F a92da1970aa6d34f8a8cd19988bbabc6 [0,2,0,0,0,0|2,0,0]=4 2438 B12R1.19 CC(C)Oc1cnc(c(c1)Br)Cl b902a3a9e0035d1736bc45f76f62cb0b [0,2,0,0,0,0|1,0,0]=3 2439 B12R1.19 CC(C)Oc1cnc(c(c1)Br)F 50bd474868e5a5e70e961e3899ff334f [0,2,0,0,0,0|1,0,0]=3 2440 B12R1.19 CC(C)Oc1cnc(c(c1)Cl)Br 6172f19c913be55702263f07d609a685 [0,2,0,0,0,0|1,0,0]=3 2441 B12R1.19 CC(C)Oc1cnc(c(c1)Cl)Cl 7adab5a8bc5c1e7ca9585cb0c1d47d3e [0,2,0,0,0,0|1,0,0]=3 2442 B12R1.19 CC(C)Oc1cnc(c(c1)Cl)F a82006ae5330e7bc4cc18a8eb628d181 [0,2,0,0,0,0|1,0,0]=3 2443 B12R1.19 CC(C)Oc1cnc(c(c1)F)Br 8068452202c6de7139ffb4bf113423c2 [0,2,0,0,0,0|1,0,0]=3 2444 B12R1.19 CC(C)Oc1cnc(c(c1)F)Cl 4c49c0256110a25fd7faccda354ded50 [0,2,0,0,0,0|1,0,0]=3 2445 B12R1.19 CC(C)Oc1cnc(c(c1)F)F d584ebc2331298db141e7c6ef4bd3317 [0,2,0,0,0,0|1,0,0]=3 2446 B12R1.19 CC(C)Oc1cnc(c(c1)I)Br 63d0b4554702a2933fa7928a04cf5c40 [0,2,0,0,0,0|1,0,0]=3 2447 B12R1.19 CC(C)Oc1cnc(c(n1)Cl)Br c0ba58f1a628e19965291ac7ddd49f4c [0,2,0,0,0,0|2,0,0]=4 2448 B12R1.19 CC(C)Oc1cnn(c(=O)c1)C c540815f66076cfdd09c7d1a2ea13274 [0,2,0,0,0,0|2,0,0]=4 2449 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 16e3a4f814a1abbf691b1a554461c211 [0,2,0,0,0,0|2,0,0]=4 2450 B12R1.19 Cc1cc(ccc1Cl)OC(C)C 3878fd89bcf660e16550571c18963284 [0,2,0,0,0,0|2,0,0]=4 2451 B12R1.19 Cc1cc(ccc1F)NC(C)C 499842be1c12b1135dfacd69895a2cca [0,2,0,0,0,0|2,0,0]=4 2452 B12R1.19 Cc1cc(ccc1F)OC(C)C 8ba02ff0b11eb0633f2e0f390e0abf0a [0,2,0,0,0,0|2,0,0]=4 2453 B12R1.19 Cc1cc(ccc1I)NC(C)C 62d71e4810c8d4fbbc6d3a26c7c79821 [0,2,0,0,0,0|2,0,0]=4 2454 B12R1.19 Cc1cc(ccc1I)OC(C)C 14f20e8650ff7b5db04ec1861653ab89 [0,2,0,0,0,0|2,0,0]=4 2455 B12R1.19 Cc1cc(cnc1Br)NC(C)C c513358dbf60f680bbd01cad5f5e106c [0,2,0,0,0,0|1,0,0]=3 2456 B12R1.19 Cc1cc(cnc1Br)OC(C)C 4dddeff5bcc03b75ce8514e1e6ee7835 [0,2,0,0,0,0|1,0,0]=3 2457 B12R1.19 Cc1cc(cnc1C)NC(C)C 63bdf45b9a33f3edb08f22777582bf15 [0,2,0,0,0,0|1,0,0]=3 2458 B12R1.19 Cc1cc(cnc1C)OC(C)C 3cab686dd4743b3e4ecbea50fedada80 [0,2,0,0,0,0|1,0,0]=3 2459 B12R1.19 Cc1cc(cnc1Cl)NC(C)C 85fda13dbe6aeac5b40e6485adb1f31e [0,2,0,0,0,0|1,0,0]=3 2460 B12R1.19 Cc1cc(cnc1Cl)OC(C)C 1f9e90070be151b68c60b40790d17ee4 [0,2,0,0,0,0|1,0,0]=3 2461 B12R1.19 Cc1cc(cnc1F)NC(C)C 4f43ed127655e298c63c02b812c7d775 [0,2,0,0,0,0|1,0,0]=3 2462 B12R1.19 Cc1cc(cnc1F)OC(C)C 055a8fb98b7d7837c55f0fd2fe3beb83 [0,2,0,0,0,0|1,0,0]=3 2463 B12R1.19 Cc1cc(nnc1Cl)NC(C)C 68bd6b673dbbf6c128a7009794e8ea7f [0,2,0,0,0,0|2,0,0]=4 2464 B12R1.19 Cc1ccc(cc1Br)OC(C)C 48e2c36b3f8a3e1510a45e4801cd7635 [0,2,0,0,0,0|2,0,0]=4 2465 B12R1.19 Cc1ccc(cc1C)NC(C)C e4751a96d9568eaa5a2dcd25f8d61305 [0,2,0,0,0,0|2,0,0]=4 2466 B12R1.19 Cc1ccc(cc1C)OC(C)C f234b68a68ae452039f940a2d00ccb8a [0,2,0,0,0,0|2,0,0]=4 2467 B12R1.19 Cc1ccc(cc1Cl)NC(C)C fd633490d2ff2f9221f61ce9791df4d9 [0,2,0,0,0,0|2,0,0]=4 2468 B12R1.19 Cc1ccc(cc1Cl)OC(C)C fe675a90fb8bba04b727e29add6472ea [0,2,0,0,0,0|2,0,0]=4 2469 B12R1.19 Cc1ccc(cc1F)NC(C)C 33608cba90c31a0a726e2554d574bab3 [0,2,0,0,0,0|2,0,0]=4 2470 B12R1.19 Cc1ccc(cc1F)OC(C)C 8a4dc41dac23453bb24010bb9a1a9523 [0,2,0,0,0,0|2,0,0]=4 2471 B12R1.19 Cc1ccc(cc1I)NC(C)C 8890cefeca6b8dbb795bd737a74a1e6d [0,2,0,0,0,0|2,0,0]=4 2472 B12R1.19 Cc1ccc(cc1I)OC(C)C 3b8932395a5e9b211ec6d650a41e634f [0,2,0,0,0,0|2,0,0]=4 2473 B12R1.19 Cc1nc(cnc1Br)NC(C)C a0dd7f3d9162e0be08f038850e2dc8c4 [0,2,0,0,0,0|2,0,0]=4 2474 B12R1.19 Cc1nc(cnc1Br)OC(C)C 9c64ffdbc6fbba803ba2711495249218 [0,2,0,0,0,0|2,0,0]=4 2475 B12R1.19 Cc1nc(cnc1Cl)NC(C)C fc8604b8f4c51d60a287b53865f2a4f2 [0,2,0,0,0,0|2,0,0]=4 2476 B12R1.19 Cc1ncc([nH]c1=O)NC(C)C 75a0fe939870ba8d1454c49f6051b190 [0,2,0,0,0,0|2,0,0]=4 2477 B12R1.19 Cc1ncc(cc1Br)NC(C)C 4601a0e21c93652086901e50a424c845 [0,2,0,0,0,0|1,0,0]=3 2478 B12R1.19 Cc1ncc(cc1Br)OC(C)C 3e39962e2d545e50291660f4874cbdd3 [0,2,0,0,0,0|1,0,0]=3 2479 B12R1.19 Cc1ncc(cc1Cl)NC(C)C 5996be7958c428e271127108418ab33f [0,2,0,0,0,0|1,0,0]=3 2480 B12R1.19 Cc1ncc(cc1Cl)OC(C)C 54dab09bd74b95b9d36620b9bd34e1be [0,2,0,0,0,0|1,0,0]=3 2481 B12R1.19 Cc1ncc(cc1F)NC(C)C 453d5070b2f76c44e574aa1db1188a55 [0,2,0,0,0,0|1,0,0]=3 2482 B12R1.19 Cc1ncc(nc1Br)NC(C)C b3884f868ff0e785792625451f157e3d [0,2,0,0,0,0|2,0,0]=4 2483 B12R1.19 Cc1ncc(nc1C)NC(C)C 69d01ac449ecfb40d633fcedbfe9199d [0,2,0,0,0,0|2,0,0]=4 2484 B12R1.19 Cc1ncc(nc1C)OC(C)C 2e9e1be34f1f6c175cb38a35edc181e7 [0,2,0,0,0,0|2,0,0]=4 2485 B12R1.20 CC(C)N(C)c1ccc(cc1)S 724cc7d86a6eca1c3614ec86435eba77 [0,2,0,0,0,0|2,0,0]=4 2486 B12R1.20 CC(C)N(C)c1ccc(nc1)Cl 34676ff0c86a75e6603d759a5e62c59d [0,2,0,0,0,0|1,0,0]=3 2487 B12R1.20 CC(C)N(C)c1ccc(nc1)F 7421528276f87b8dd07154e0a3d0db2a [0,2,0,0,0,0|1,0,0]=3 2488 B12R1.49 C#CC(C)Oc1ccc(nc1)F ec8efedb033039c578e7b58d9041f84c [0,2,0,0,0,0|1,0,1]=4 2489 B12R1.49 C=CC(C)Nc1ccc(nc1)Br 62cf182eedc1f6db2e88927c1b25f48f [0,2,0,0,0,0|1,0,1]=4 2490 B12R1.49 C=CC(C)Nc1ccc(nc1)C 79cb0cb5e49f2877698170b7a48fe5a0 [0,2,0,0,0,0|1,0,1]=4 2491 B12R1.49 C=CC(C)Nc1ccc(nc1)Cl 3eedcf09d004f4c9e4e92d41ee4529d4 [0,2,0,0,0,0|1,0,1]=4 2492 B12R1.49 C=CC(C)Nc1ccc(nc1)F 3ebac604e44599e71d26828e9fc16efd [0,2,0,0,0,0|1,0,1]=4 2493 B12R1.49 C=CC(C)Nc1ccc(nc1)I e455a856fe53178ebe91990576e8f21e [0,2,0,0,0,0|1,0,1]=4 2494 B12R1.49 C=CC(C)Nc1ccc(nc1)S b53ad2f3ef8f48dd989efba60f31975a [0,2,0,0,0,0|1,0,1]=4 2495 B12R1.49 C=CC(C)Oc1ccc(nc1)Br 5ea5d47905c75ad53b53f223071083f1 [0,2,0,0,0,0|1,0,1]=4 2496 B12R1.49 C=CC(C)Oc1ccc(nc1)C 44a93f0dd5f29feccf64f547b3866395 [0,2,0,0,0,0|1,0,1]=4 2497 B12R1.49 C=CC(C)Oc1ccc(nc1)Cl b7c309c053ff89fafa2d58706e7dcd3e [0,2,0,0,0,0|1,0,1]=4 2498 B12R1.49 C=CC(C)Oc1ccc(nc1)F 2cd7bc7c0b4dc555faf56a00269ea986 [0,2,0,0,0,0|1,0,1]=4 2499 B12R1.49 C=CC(C)Oc1ccc(nc1)I 56c0cec42699369bb7ee53555fe6350f [0,2,0,0,0,0|1,0,1]=4 2500 B12R1.49 CC(C#N)Oc1ccc(nc1)F e24a7158d7d7f19f9c5aecaa2151c65a [0,2,0,0,0,0|1,0,1]=4 2501 B12R1.49 CC(C=O)Nc1ccc(nc1)Br f186dfda5f1271c9bcf7df72beb704ac [0,2,0,0,0,0|1,0,1]=4 2502 B12R1.49 CC(C=O)Nc1ccc(nc1)Cl 34857a9173afa74a675eca29153b5078 [0,2,0,0,0,0|1,0,1]=4 2503 B12R1.49 CC(C=O)Nc1ccc(nc1)F 211a738bce9d7e16ebd963fae07e698c [0,2,0,0,0,0|1,0,1]=4 2504 B12R1.49 CC(C=O)Nc1ccc(nc1)I bcfae411b3030970f6d5606ae9e9c77d [0,2,0,0,0,0|1,0,1]=4 2505 B12R1.49 CC(C=O)Oc1ccc(nc1)Br 7a3fb6aab9b581d6024032b70db2f411 [0,2,0,0,0,0|1,0,1]=4 2506 B12R1.49 CC(C=O)Oc1ccc(nc1)Cl 104734ddbf05995d2180bce252af109d [0,2,0,0,0,0|1,0,1]=4 2507 B12R1.49 CC(C=O)Oc1ccc(nc1)F 364516d18f86696b44430e9ea6a8cc9b [0,2,0,0,0,0|1,0,1]=4 2508 B12R1.49 CC(C=O)Oc1ccc(nc1)I 4a40395b49e9fa111cdc777373f88c73 [0,2,0,0,0,0|1,0,1]=4 2509 B12R1.49 CC(CO)Nc1ccc(=O)[nH]c1 ac371798df64003805918789f0e6bec8 [0,2,0,0,0,0|1,0,1]=4 2510 B12R1.49 CC(CO)Nc1ccc(cc1)Br 592ef5953e06db03ec99416b117263ef [0,2,0,0,0,0|2,0,0]=4 2511 B12R1.49 CC(CO)Nc1ccc(cc1)Cl 6e245977f2eddb60c0247b5c843b676d [0,2,0,0,0,0|2,0,0]=4 2512 B12R1.49 CC(CO)Nc1ccc(cc1)F 4b0578096f484cca12cad3c022131099 [0,2,0,0,0,0|2,0,0]=4 2513 B12R1.49 CC(CO)Nc1ccc(cc1)I 774ceb747df2f9a4ee3d7a744cbb4ea7 [0,2,0,0,0,0|2,0,0]=4 2514 B12R1.49 CC(CO)Nc1ccc(cc1)S 6476a5e0718364a34b1792ef13298738 [0,2,0,0,0,0|2,0,0]=4 2515 B12R1.49 CC(CO)Nc1ccc(nc1)Br bd6e16e1b752fd73e2d385bb2f7b3038 [0,2,0,0,0,0|1,0,0]=3 2516 B12R1.49 CC(CO)Nc1ccc(nc1)Cl 46ed51a7bc0497c3b455e7dba1811d7f [0,2,0,0,0,0|1,0,0]=3 2517 B12R1.49 CC(CO)Nc1ccc(nc1)F 2417f7f246cf00a750eee1b638f68700 [0,2,0,0,0,0|1,0,0]=3 2518 B12R1.49 CC(CO)Nc1ccc(nn1)Br 2f32c86d8b4558f8d840685bb4e42c85 [0,2,0,0,0,0|2,0,0]=4 2519 B12R1.49 CC(CO)Nc1ccc(nn1)Cl dd485c91931d54406c04387ffffc5260 [0,2,0,0,0,0|2,0,0]=4 2520 B12R1.49 CC(CO)Nc1ccc(nn1)F 9b3f3ed5e12234d30bb543cd9f580851 [0,2,0,0,0,0|2,0,0]=4 2521 B12R1.49 CC(CO)Nc1cnc(cn1)Cl f467f73d603a786732dd2488fda8df14 [0,2,0,0,0,0|2,0,0]=4 2522 B12R1.49 CC(CO)Nc1cnc(nc1)Br fd275ce6138c5fc68b38e65809280954 [0,2,0,0,0,0|2,0,0]=4 2523 B12R1.49 CC(CO)Nc1cnc(nc1)Cl d554be76f6abc7a82b7409abd87487a8 [0,2,0,0,0,0|2,0,0]=4 2524 B12R1.49 CCC(C)Nc1ccc(=O)[nH]c1 9c3a051318b69b42c506acf71baaab78 [0,2,0,0,0,0|1,0,1]=4 2525 B12R1.49 CCC(C)Nc1ccc(cc1)Br 4d1c483cf4afbfba9a2f8d3db94bec3f [0,2,0,0,0,0|2,0,0]=4 2526 B12R1.49 CCC(C)Nc1ccc(cc1)C 3b1fa0514d720f4b3db404292b778124 [0,2,0,0,0,0|2,0,0]=4 2527 B12R1.49 CCC(C)Nc1ccc(cc1)Cl 76d63efd5fc59378ea17379a47e7b19f [0,2,0,0,0,0|2,0,0]=4 2528 B12R1.49 CCC(C)Nc1ccc(cc1)F e00a92636e95efc27604581ea177b931 [0,2,0,0,0,0|2,0,0]=4 2529 B12R1.49 CCC(C)Nc1ccc(cc1)I 442f4ce893379ae3f70afc3980567446 [0,2,0,0,0,0|2,0,0]=4 2530 B12R1.49 CCC(C)Nc1ccc(cc1)S d4e426a89d91db8144c9fb2dff511b9d [0,2,0,0,0,0|2,0,0]=4 2531 B12R1.49 CCC(C)Nc1ccc(nc1)Br d54c0572efadfb4c8f4847bf437a2c7d [0,2,0,0,0,0|1,0,0]=3 2532 B12R1.49 CCC(C)Nc1ccc(nc1)C d6ad82578c876ee968feac0cec45d888 [0,2,0,0,0,0|1,0,0]=3 2533 B12R1.49 CCC(C)Nc1ccc(nc1)Cl 518238fe62da44e7f2bfc38c3bdbfb29 [0,2,0,0,0,0|1,0,0]=3 2534 B12R1.49 CCC(C)Nc1ccc(nc1)F d59e4f4e8b2b0114fd8798e34fba4a26 [0,2,0,0,0,0|1,0,0]=3 2535 B12R1.49 CCC(C)Nc1ccc(nc1)I 766aa3865a62312e75c4abba9187c088 [0,2,0,0,0,0|1,0,0]=3 2536 B12R1.49 CCC(C)Nc1ccc(nn1)Br d4849dab0565c56749255e59e2f9a5c2 [0,2,0,0,0,0|2,0,0]=4 2537 B12R1.49 CCC(C)Nc1ccc(nn1)C 68f9c5eb09de5962714edb1736327137 [0,2,0,0,0,0|2,0,0]=4 2538 B12R1.49 CCC(C)Nc1ccc(nn1)Cl 7a86200804c93450ea71ecff4d8fb9f7 [0,2,0,0,0,0|2,0,0]=4 2539 B12R1.49 CCC(C)Nc1ccc(nn1)F 7b2c147a436d5c14a7e4a3cac45c47e8 [0,2,0,0,0,0|2,0,0]=4 2540 B12R1.49 CCC(C)Nc1ccc(nn1)I 9353c1fcc60e5adffa339651f74ce429 [0,2,0,0,0,0|2,0,0]=4 2541 B12R1.49 CCC(C)Nc1cnc(cn1)Br 9b393e0f3faee9a00b417a269a86bca3 [0,2,0,0,0,0|2,0,0]=4 2542 B12R1.49 CCC(C)Nc1cnc(cn1)C 661f7def9a19dba6a7bdd5cc2ba39930 [0,2,0,0,0,0|2,0,0]=4 2543 B12R1.49 CCC(C)Nc1cnc(cn1)Cl 696eac7e7c757ae43c9aaaba9631eb85 [0,2,0,0,0,0|2,0,0]=4 2544 B12R1.49 CCC(C)Nc1cnc(nc1)Br 35ed107b4418046032a271c52580149d [0,2,0,0,0,0|2,0,0]=4 2545 B12R1.49 CCC(C)Nc1cnc(nc1)C c0d82f41fd26f577f6a44a2fb4f5c582 [0,2,0,0,0,0|2,0,0]=4 2546 B12R1.49 CCC(C)Nc1cnc(nc1)Cl bd3cd2c33c5772a1dc6e72007ddc12c8 [0,2,0,0,0,0|2,0,0]=4 2547 B12R1.49 CCC(C)Nc1cnc(nc1)I 28c75c0e9f7ab9f9910d760b93d4afa2 [0,2,0,0,0,0|2,0,0]=4 2548 B12R1.49 CCC(C)Oc1ccc(cc1)Br e9ac760eb966c46626ad8cc78ce8ab95 [0,2,0,0,0,0|2,0,0]=4 2549 B12R1.49 CCC(C)Oc1ccc(cc1)C 7e96b7f640ec60a64eac66e0769be3a7 [0,2,0,0,0,0|2,0,0]=4 2550 B12R1.49 CCC(C)Oc1ccc(cc1)Cl e4591e0baef7f8d77d4837bf4d9fdb37 [0,2,0,0,0,0|2,0,0]=4 2551 B12R1.49 CCC(C)Oc1ccc(cc1)F c16cd2d17d48a9601c3d676d21db62eb [0,2,0,0,0,0|2,0,0]=4 2552 B12R1.49 CCC(C)Oc1ccc(cc1)I 1f03b3dddba16cff63099651f2c3fd3b [0,2,0,0,0,0|2,0,0]=4 2553 B12R1.49 CCC(C)Oc1ccc(cc1)S d9f5a2f73690dbd57408915a8a39b443 [0,2,0,0,0,0|2,0,0]=4 2554 B12R1.49 CCC(C)Oc1ccc(nc1)Br 516eff06c3a3a1ff8c5f0f3c5810da98 [0,2,0,0,0,0|1,0,0]=3 2555 B12R1.49 CCC(C)Oc1ccc(nc1)C 1854083619ec73eee9198b834003b342 [0,2,0,0,0,0|1,0,0]=3 2556 B12R1.49 CCC(C)Oc1ccc(nc1)Cl e1bf6ecb1ecdae647567f976542296a9 [0,2,0,0,0,0|1,0,0]=3 2557 B12R1.49 CCC(C)Oc1ccc(nc1)F 89b79d90d644d22250fbc4a007feb1fb [0,2,0,0,0,0|1,0,0]=3 2558 B12R1.49 CCC(C)Oc1ccc(nc1)I 8b1b0ad039b58415fb42dcc3a01e22b2 [0,2,0,0,0,0|1,0,0]=3 2559 B12R1.49 CCC(C)Oc1ccc(nn1)Br c7c75d6f10a3752a93dd5b447bfd8783 [0,2,0,0,0,0|2,0,0]=4 2560 B12R1.49 CCC(C)Oc1ccc(nn1)C 00329babc6e99a877eeedb9cb1e04e1a [0,2,0,0,0,0|2,0,0]=4 2561 B12R1.49 CCC(C)Oc1ccc(nn1)Cl 5cd4ec893f56cf8b5f893c91e3edbb5f [0,2,0,0,0,0|2,0,0]=4 2562 B12R1.49 CCC(C)Oc1cnc(cn1)Br 202a1b01c38ba0381ac4fdac1f07c0a2 [0,2,0,0,0,0|2,0,0]=4 2563 B12R1.49 CCC(C)Oc1cnc(cn1)C 6531528ec949b8c9ed6d2a8d83525ec6 [0,2,0,0,0,0|2,0,0]=4 2564 B12R1.49 CCC(C)Oc1cnc(cn1)Cl 55770d8e45cc91dcd011f50832d7233b [0,2,0,0,0,0|2,0,0]=4 2565 B12R1.49 CCC(C)Oc1cnc(cn1)I a48d2e908f80a65c88c1eccf293bc5a5 [0,2,0,0,0,0|2,0,0]=4 2566 B12R1.49 CCC(C)Oc1cnc(nc1)Br c2cded798b4e9a03e1e3c025b2d6eb8f [0,2,0,0,0,0|2,0,0]=4 2567 B12R1.49 CCC(C)Oc1cnc(nc1)C 6b6f5034972dad51b2b87e668deb0e06 [0,2,0,0,0,0|2,0,0]=4 2568 B12R1.49 CCC(C)Oc1cnc(nc1)Cl fe1d0640db66670d00ea95915f7fdb78 [0,2,0,0,0,0|2,0,0]=4 2569 B12R1.49 CCN(C)Cc1ccc(cc1)Br 1cd45e4ca45fae9e98f9fb1c46e39cc6 [0,2,0,0,0,0|2,0,0]=4 2570 B12R1.49 CCN(C)Cc1ccc(cc1)C 055291017524f626e0726902d4240145 [0,2,0,0,0,0|2,0,0]=4 2571 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 44a860069a7f680293c76e814fd41a95 [0,2,0,0,0,0|2,0,0]=4 2572 B12R1.49 CCN(C)Cc1ccc(cc1)F 54dace8f30df290c27637058b77ffe21 [0,2,0,0,0,0|2,0,0]=4 2573 B12R1.49 CCN(C)Cc1ccc(cc1)I 5d72761060d288ad1c94906cd08bd152 [0,2,0,0,0,0|2,0,0]=4 2574 B12R1.49 CCN(C)Cc1ccc(nc1)Br 429bb50456540cef0ac893a17b12aab5 [0,2,0,0,0,0|1,0,0]=3 2575 B12R1.49 CCN(C)Cc1ccc(nc1)C ed15ab962ec12799e0a9820bfe7255b0 [0,2,0,0,0,0|1,0,0]=3 2576 B12R1.49 CCN(C)Cc1ccc(nc1)Cl d7495fc4327a85c0d3bd1be8f857d273 [0,2,0,0,0,0|1,0,0]=3 2577 B12R1.49 CCN(C)Cc1ccc(nc1)F 0ced1b4df386c95be60bc935cee5025e [0,2,0,0,0,0|1,0,0]=3 2578 B12R1.49 CCN(C)Cc1cnc(nc1)C c24594c1f0fc35b2b34ebdc01025cb8e [0,2,0,0,0,0|2,0,0]=4 2579 B12R1.49 CCN(C)Cc1cnc(nc1)Cl 45454d56d20803bb8a5e6b65847bfa73 [0,2,0,0,0,0|2,0,0]=4 2580 B12R1.49 CC[C@@H](C)Nc1ccc(cc1)S cbd8e9c1c5acf2775569733e10999d98 [0,2,0,0,0,0|2,0,0]=4 2581 B12R1.49 CC[C@H](C)Nc1ccc(cc1)S fffd6af76aaef88a5e0ba51aece02cfc [0,2,0,0,0,0|2,0,0]=4 2582 B12R1.49 CN(C=O)Cc1ccc(nc1)Br 2a77ba6498c41f9b41121d98c87b7f71 [0,2,0,0,0,0|1,0,1]=4 2583 B12R1.49 CN(C=O)Cc1ccc(nc1)Cl 2cace184b35fe1526ebc4b3e72d63152 [0,2,0,0,0,0|1,0,1]=4 2584 B12R1.49 CN(CF)Cc1ccc(cc1)Br 1c98aaf588285d3dd9f73536ec902634 [0,2,0,0,0,0|2,0,0]=4 2585 B12R1.49 CN(CF)Cc1ccc(cc1)Cl 1a19e37accbfa35c145aa7afd68f1e35 [0,2,0,0,0,0|2,0,0]=4 2586 B12R1.49 CN(CF)Cc1ccc(cc1)F cb4a8bfaf28fb4375125182c6f95b1a1 [0,2,0,0,0,0|2,0,0]=4 2587 B12R1.49 CN(CF)Cc1ccc(cc1)I a40135575e4a37cd9b5d74c27cd08e30 [0,2,0,0,0,0|2,0,0]=4 2588 B12R1.49 CN(CF)Cc1ccc(nc1)Br eaf2c5ea932117578ba3e02a235cb558 [0,2,0,0,0,0|1,0,0]=3 2589 B12R1.49 CN(CF)Cc1ccc(nc1)Cl 0f4501e33b7d30ec602104f23fb2a602 [0,2,0,0,0,0|1,0,0]=3 2590 B12R1.49 CN(CO)Cc1ccc(cc1)Br 5e55a925cd3dce7e6241436ae8c54919 [0,2,0,0,0,0|2,0,0]=4 2591 B12R1.49 CN(CO)Cc1ccc(cc1)Cl dab1af0d42fcee1a60d38378d8e8efce [0,2,0,0,0,0|2,0,0]=4 2592 B12R1.49 CN(CO)Cc1ccc(cc1)F 7fd3b80fbdb09310d5fe39719fff8ba6 [0,2,0,0,0,0|2,0,0]=4 2593 B12R1.49 CN(CO)Cc1ccc(cc1)I 586b1a870616a315f891e0fa55e04ab9 [0,2,0,0,0,0|2,0,0]=4 2594 B12R1.49 CN(CO)Cc1ccc(nc1)Br acbd7be1713c7851b73810c27f715e93 [0,2,0,0,0,0|1,0,0]=3 2595 B12R1.49 CN(CO)Cc1ccc(nc1)Cl a4d8534fd0a4a393a809ed2df00a5077 [0,2,0,0,0,0|1,0,0]=3 2596 B12R1.49 C[C@@H](CO)Nc1ccc(=O)[nH]c1 2663dcff7243bbde6f1002066411c077 [0,2,0,0,0,0|1,0,1]=4 2597 B12R1.49 C[C@@H](CO)Nc1ccc(cc1)Br 81ff9fcc021a132282f1894c27228443 [0,2,0,0,0,0|2,0,0]=4 2598 B12R1.49 C[C@@H](CO)Nc1ccc(cc1)Cl 895f70fe0dbe38715df711db55f41f0c [0,2,0,0,0,0|2,0,0]=4 2599 B12R1.49 C[C@@H](CO)Nc1ccc(cc1)F 9b79cc3b0525c5fa5f4e86071dc6a6d4 [0,2,0,0,0,0|2,0,0]=4 2600 B12R1.49 C[C@@H](CO)Nc1ccc(cc1)I f030c452e948f44d3d2e91d60b707da3 [0,2,0,0,0,0|2,0,0]=4 2601 B12R1.49 C[C@@H](CO)Nc1ccc(cc1)S 43c8b001202cbd567805dbe271a67550 [0,2,0,0,0,0|2,0,0]=4 2602 B12R1.49 C[C@@H](CO)Nc1ccc(nc1)Br 1d611bd564105e97cbd0259527821676 [0,2,0,0,0,0|1,0,0]=3 2603 B12R1.49 C[C@@H](CO)Nc1ccc(nc1)Cl b77dff8cd1b17c732de7b206cd349050 [0,2,0,0,0,0|1,0,0]=3 2604 B12R1.49 C[C@@H](CO)Nc1ccc(nc1)F 262d9176e479e4661b0a3722c72670d9 [0,2,0,0,0,0|1,0,0]=3 2605 B12R1.49 C[C@@H](CO)Nc1ccc(nn1)Br fa0762a595ead73fcfc3698da0b42014 [0,2,0,0,0,0|2,0,0]=4 2606 B12R1.49 C[C@@H](CO)Nc1ccc(nn1)Cl 81f8057ee0b0622198a1194fb1dce053 [0,2,0,0,0,0|2,0,0]=4 2607 B12R1.49 C[C@@H](CO)Nc1ccc(nn1)F 07fd3e51189a2efd9a83388a34981213 [0,2,0,0,0,0|2,0,0]=4 2608 B12R1.49 C[C@@H](CO)Nc1cnc(cn1)Cl 74b42a1e34ded74d58daa8553d55afbb [0,2,0,0,0,0|2,0,0]=4 2609 B12R1.49 C[C@@H](CO)Nc1cnc(nc1)Br a8e467b001dd64aa3cb478bbf9cab867 [0,2,0,0,0,0|2,0,0]=4 2610 B12R1.49 C[C@@H](CO)Nc1cnc(nc1)Cl 3b5a177f1f4e113620d633e4aa011028 [0,2,0,0,0,0|2,0,0]=4 2611 B12R1.49 C[C@H](C=O)Nc1ccc(nc1)Br 7207f9b5b452b8c1546630b6f6c6adb2 [0,2,0,0,0,0|1,0,1]=4 2612 B12R1.49 C[C@H](C=O)Nc1ccc(nc1)Cl a3a1f439377bc6c63567b92f4e4983ac [0,2,0,0,0,0|1,0,1]=4 2613 B12R1.49 C[C@H](C=O)Nc1ccc(nc1)F 3d5be8a4f9b45ea29f918808b85d19e0 [0,2,0,0,0,0|1,0,1]=4 2614 B12R1.49 C[C@H](C=O)Nc1ccc(nc1)I be74f563b881fde29185809abcc96de3 [0,2,0,0,0,0|1,0,1]=4 2615 B12R1.49 C[C@H](C=O)Oc1ccc(nc1)Br d90e009b43a00e2d8e10ea0419bfe0b7 [0,2,0,0,0,0|1,0,1]=4 2616 B12R1.49 C[C@H](C=O)Oc1ccc(nc1)Cl 3a7ca50f7870cd532189c6644eeee3dc [0,2,0,0,0,0|1,0,1]=4 2617 B12R1.49 C[C@H](C=O)Oc1ccc(nc1)F 66eba9f6ce98632319a5acef7ecba5ee [0,2,0,0,0,0|1,0,1]=4 2618 B12R1.49 C[C@H](C=O)Oc1ccc(nc1)I c07cb6364b62f18d8ac78d18867e2daa [0,2,0,0,0,0|1,0,1]=4 2619 B12R1.49 C[C@H](CO)Nc1ccc(=O)[nH]c1 a8690a44285a7a47632cbd2aa0dce9ce [0,2,0,0,0,0|1,0,1]=4 2620 B12R1.49 C[C@H](CO)Nc1ccc(cc1)Br af8120a15198da801643963289e3f0b4 [0,2,0,0,0,0|2,0,0]=4 2621 B12R1.49 C[C@H](CO)Nc1ccc(cc1)Cl 356f51342fc5e10d8fb2b3371a2ed97a [0,2,0,0,0,0|2,0,0]=4 2622 B12R1.49 C[C@H](CO)Nc1ccc(cc1)F 1f77c87bbae95423a93fe876d033eefc [0,2,0,0,0,0|2,0,0]=4 2623 B12R1.49 C[C@H](CO)Nc1ccc(cc1)I a3869a49772cee44011ad8dc480d5c9d [0,2,0,0,0,0|2,0,0]=4 2624 B12R1.49 C[C@H](CO)Nc1ccc(cc1)S 85732fce8faa73b572919e248911292a [0,2,0,0,0,0|2,0,0]=4 2625 B12R1.49 C[C@H](CO)Nc1ccc(nc1)Br 6d5dc0fe5b65d516b515946ef3b064d3 [0,2,0,0,0,0|1,0,0]=3 2626 B12R1.49 C[C@H](CO)Nc1ccc(nc1)Cl f149fed0c54e3e712d60892921e0ca81 [0,2,0,0,0,0|1,0,0]=3 2627 B12R1.49 C[C@H](CO)Nc1ccc(nc1)F ee221ccdcacb36804e1f2682ae351155 [0,2,0,0,0,0|1,0,0]=3 2628 B12R1.49 C[C@H](CO)Nc1ccc(nn1)Br 8bfda4f44875319285117b535d38adf6 [0,2,0,0,0,0|2,0,0]=4 2629 B12R1.49 C[C@H](CO)Nc1ccc(nn1)Cl 856000918303584de02cf5ef679b86ce [0,2,0,0,0,0|2,0,0]=4 2630 B12R1.49 C[C@H](CO)Nc1ccc(nn1)F 96eb2d21ce3d18b3e91c5a938d62a50e [0,2,0,0,0,0|2,0,0]=4 2631 B12R1.49 C[C@H](CO)Nc1cnc(cn1)Cl a0c8d659ff688c329c23bbca243a57aa [0,2,0,0,0,0|2,0,0]=4 2632 B12R1.49 C[C@H](CO)Nc1cnc(nc1)Br 8a4d7ffb4e266a5271da0ba7f60e8e8c [0,2,0,0,0,0|2,0,0]=4 2633 B12R1.49 C[C@H](CO)Nc1cnc(nc1)Cl c9c38c378fd9c614bd2374902dec5af5 [0,2,0,0,0,0|2,0,0]=4 2634 B12R1.49 Cc1ccc(cc1)CN(C)CF c0df0a0174bffac791963bd2047037d3 [0,2,0,0,0,0|2,0,0]=4 2635 B12R1.49 Cc1ccc(cc1)CN(C)CO ed474c07bd59a560c88e17955d9c9bb2 [0,2,0,0,0,0|2,0,0]=4 2636 B12R1.49 Cc1ccc(cc1)NC(C)CO 3a65f703743c7582d59d27c4b911a046 [0,2,0,0,0,0|2,0,0]=4 2637 B12R1.49 Cc1ccc(cc1)N[C@@H](C)CO 2d26d3567e3cf630da5665d889609cd2 [0,2,0,0,0,0|2,0,0]=4 2638 B12R1.49 Cc1ccc(cc1)N[C@H](C)CO ef5026ef31ef684c9c9940edc6a6ea55 [0,2,0,0,0,0|2,0,0]=4 2639 B12R1.49 Cc1ccc(cn1)CN(C)C=O a43e4a9a2cc5e91d249d3896121306c8 [0,2,0,0,0,0|1,0,1]=4 2640 B12R1.49 Cc1ccc(cn1)CN(C)CF edf7d8919bb240fe2e4e763f3809578c [0,2,0,0,0,0|1,0,0]=3 2641 B12R1.49 Cc1ccc(cn1)CN(C)CO ece34abcbf16b2b1a2f352abcba7f926 [0,2,0,0,0,0|1,0,0]=3 2642 B12R1.49 Cc1ccc(cn1)NC(C)C=O eaa5322fb607707191a67604549cea57 [0,2,0,0,0,0|1,0,1]=4 2643 B12R1.49 Cc1ccc(cn1)NC(C)CO fe8736593649ae0fdf850768d2fd4a83 [0,2,0,0,0,0|1,0,0]=3 2644 B12R1.49 Cc1ccc(cn1)N[C@@H](C)CO e06793396685fbfa84e56a22fcc772f6 [0,2,0,0,0,0|1,0,0]=3 2645 B12R1.49 Cc1ccc(cn1)N[C@H](C)C=O b2d1254bfba4535b7411865d13d6c9be [0,2,0,0,0,0|1,0,1]=4 2646 B12R1.49 Cc1ccc(cn1)N[C@H](C)CO b235f37c2a175e982f955356bf8fcc48 [0,2,0,0,0,0|1,0,0]=3 2647 B12R1.49 Cc1ccc(cn1)OC(C)C=O 27f5d603ee876dc4b99c58e5f464c3af [0,2,0,0,0,0|1,0,1]=4 2648 B12R1.49 Cc1ccc(cn1)O[C@H](C)C=O e252f38a5b05a93e7fd0b0a696bfebc3 [0,2,0,0,0,0|1,0,1]=4 2649 B12R1.49 Cc1ccc(nn1)NC(C)CO 2030a6ce10a03a28a75c2b4362a33461 [0,2,0,0,0,0|2,0,0]=4 2650 B12R1.49 Cc1ccc(nn1)N[C@@H](C)CO ec349fa438a3b4e9fffb89d182813ea4 [0,2,0,0,0,0|2,0,0]=4 2651 B12R1.49 Cc1ccc(nn1)N[C@H](C)CO 81ced8c4dbbacacdc3a1832fa80ad5b1 [0,2,0,0,0,0|2,0,0]=4 2652 B12R1.49 Cc1cnc(cn1)NC(C)CO 6572a77442fdb83bc4f066d34208a9e3 [0,2,0,0,0,0|2,0,0]=4 2653 B12R1.49 Cc1ncc(cn1)CN(C)CF 91f520e73e1e2a4b5c92d90f84758698 [0,2,0,0,0,0|2,0,0]=4 2654 B12R1.49 Cc1ncc(cn1)CN(C)CO de0991e0d085f3ba580252f4e4c1a5dc [0,2,0,0,0,0|2,0,0]=4 2655 B12R1.49 Cc1ncc(cn1)NC(C)CO 79c7d3a222331ae067982c341800bebd [0,2,0,0,0,0|2,0,0]=4 2656 B12R1.106 CC(C)(C)Nc1ccc(cc1)S 2ec5ab3e6affd22e7ed5789e1b8162ec [0,2,0,0,0,0|2,0,0]=4 2657 B12R1.233 CC(C)Nc1ccc(=O)[nH]c1Cl 13b85bd85b4362851a02cf6816ba0e26 [0,2,0,0,0,0|1,0,1]=4 2658 B12R1.233 CC(C)Nc1ccc([nH]c1=S)Cl 91d8184056c542cd35acfbebc42feb8e [0,2,0,0,0,0|1,0,1]=4 2659 B12R1.233 CC(C)Nc1ccc(cc1Cl)Br ff919c0ad3056af10ba9c99b4ea82055 [0,2,0,0,0,0|2,0,0]=4 2660 B12R1.233 CC(C)Nc1ccc(cc1Cl)Cl d1517c0fce56f81cf78148b7de51776d [0,2,0,0,0,0|2,0,0]=4 2661 B12R1.233 CC(C)Nc1ccc(cc1Cl)F d8ef3677f35c72a8f6f5dca9199fc2c3 [0,2,0,0,0,0|2,0,0]=4 2662 B12R1.233 CC(C)Nc1ccc(cc1Cl)I 4361f4661b5f0cba4785f8e2ca782c19 [0,2,0,0,0,0|2,0,0]=4 2663 B12R1.233 CC(C)Nc1ccc(cc1F)Cl 82efef7ff26d46a5b0e0798eba56802c [0,2,0,0,0,0|2,0,0]=4 2664 B12R1.233 CC(C)Nc1ccc(cc1F)F a4394b8df0fae769ea9c11bd31860873 [0,2,0,0,0,0|2,0,0]=4 2665 B12R1.233 CC(C)Nc1ccc(cc1F)I 9abcdcc568918d4aa07a418528ab4ca2 [0,2,0,0,0,0|2,0,0]=4 2666 B12R1.233 CC(C)Nc1ccc(cc1I)Br a4509cab73cd82154d898797d431222c [0,2,0,0,0,0|2,0,0]=4 2667 B12R1.233 CC(C)Nc1ccc(cc1I)Cl 87f4f12fd7c8970dcece6a6b382d1d38 [0,2,0,0,0,0|2,0,0]=4 2668 B12R1.233 CC(C)Nc1ccc(cc1I)F 4a7066161200e173e0f2cc0591cf397e [0,2,0,0,0,0|2,0,0]=4 2669 B12R1.233 CC(C)Nc1ccc(cc1I)I e27c541bbd98b68e1b7105942d7745b8 [0,2,0,0,0,0|2,0,0]=4 2670 B12R1.233 CC(C)Nc1ccc(cc1S)Br 6426ef744c7ab58c8b1c163224372bc0 [0,2,0,0,0,0|2,0,0]=4 2671 B12R1.233 CC(C)Nc1ccc(cc1S)F f8bdf9d452f73effcd585217d28e02b6 [0,2,0,0,0,0|2,0,0]=4 2672 B12R1.233 CC(C)Nc1ccc(nc1Br)Br 9210fc55b498803a423ccf391f7ae1bf [0,2,0,0,0,0|1,0,0]=3 2673 B12R1.233 CC(C)Nc1ccc(nc1Cl)Br 99211d84a647cc16948a3a407b726f4a [0,2,0,0,0,0|1,0,0]=3 2674 B12R1.233 CC(C)Nc1ccc(nc1Cl)F 9371ad775d75a06f448e63e6f572a6dd [0,2,0,0,0,0|1,0,0]=3 2675 B12R1.233 CC(C)Nc1ccc(nc1Cl)I aaa79e4fbc8ddb9bf1c7ed49ce667196 [0,2,0,0,0,0|1,0,0]=3 2676 B12R1.233 CC(C)Nc1ccc(nc1F)Br c433acb1f63fc5c113017528f68acd42 [0,2,0,0,0,0|1,0,0]=3 2677 B12R1.233 CC(C)Nc1ccc(nc1F)F 627fa06678ad30567bc7a76cb6a44517 [0,2,0,0,0,0|1,0,0]=3 2678 B12R1.233 CC(C)Nc1ccc(nc1I)Br 8c7cdddfc7e989e1e7a986e2ca4bf111 [0,2,0,0,0,0|1,0,0]=3 2679 B12R1.233 CC(C)Nc1ccc(nc1I)F 429d433a870b26810e16db7fb6252656 [0,2,0,0,0,0|1,0,0]=3 2680 B12R1.233 CC(C)Nc1ccc(nc1I)I 69eb53d0d9cbe0c7392c463fbe58a625 [0,2,0,0,0,0|1,0,0]=3 2681 B12R1.233 CC(C)Nc1cnc(cc1Br)Br d31990ea8d55c781d882a01f13443df8 [0,2,0,0,0,0|1,0,0]=3 2682 B12R1.233 CC(C)Nc1cnc(cc1Cl)Br f1f0a89d1c6b040e0cc703a3bdcb22cb [0,2,0,0,0,0|1,0,0]=3 2683 B12R1.233 CC(C)Nc1cnc(cc1Cl)Cl d25be7ded79a184b2593491d05f4c73b [0,2,0,0,0,0|1,0,0]=3 2684 B12R1.233 CC(C)Nc1cnc(cc1F)Cl bf23339b78c2c7dbd50665fef2a9924a [0,2,0,0,0,0|1,0,0]=3 2685 B12R1.233 CC(C)Nc1cnc(cc1F)F 22a4575f630b54e31a5a4c667a92762c [0,2,0,0,0,0|1,0,0]=3 2686 B12R1.233 CC(C)Nc1cnc(cc1I)Br 09f9e50b810de0f5d68f6a0408c16b0d [0,2,0,0,0,0|1,0,0]=3 2687 B12R1.233 CC(C)Nc1cnc(cc1I)Cl 8ab0e223fe18aec0e6aaadf9bc0a5da6 [0,2,0,0,0,0|1,0,0]=3 2688 B12R1.233 CC(C)Nc1cnc(nc1Cl)Cl 16f8f78b5abbd6e52a387b1e6678483f [0,2,0,0,0,0|2,0,0]=4 2689 B12R1.233 CC(C)Nc1cnc(nc1I)Cl 0bd328a2dd81cfeecc51c442a2af71b5 [0,2,0,0,0,0|2,0,0]=4 2690 B12R1.233 CC(C)Nc1ncc(nc1Br)Br 18607e3d62c9f45a9e93ee2914435c9c [0,2,0,0,0,0|2,0,0]=4 2691 B12R1.233 CC(C)Nc1ncc(nc1Br)Cl 8458ca5e15e5fc69319c113e78d98f8e [0,2,0,0,0,0|2,0,0]=4 2692 B12R1.233 CC(C)Nc1ncc(nc1Br)I 9a563640b62b7fa1bcb2f3d9c6cc4afd [0,2,0,0,0,0|2,0,0]=4 2693 B12R1.233 CC(C)Nc1ncc(nc1Cl)Br ee064a15dc0446f0c027e41fe3f7af59 [0,2,0,0,0,0|2,0,0]=4 2694 B12R1.233 CC(C)Nc1ncc(nc1Cl)Cl d22e8182716f590394c236ad271c62c0 [0,2,0,0,0,0|2,0,0]=4 2695 B12R1.233 CC(C)Nc1ncc(nc1Cl)I 140a355de3e9448d8169b7b97dc11ce2 [0,2,0,0,0,0|2,0,0]=4 2696 B12R1.233 CC(C)Nc1ncc(nc1I)Br 338f7f0907c048c4c65d8b77c50fddc4 [0,2,0,0,0,0|2,0,0]=4 2697 B12R1.233 CC(C)Nc1nnc(cc1Br)Cl a30bb2d752fad8b5ddc448d983503538 [0,2,0,0,0,0|2,0,0]=4 2698 B12R1.233 CC(C)Nc1nnc(cc1Cl)Cl d95dafe088336b3077f4c717cb936740 [0,2,0,0,0,0|2,0,0]=4 2699 B12R1.233 CC(C)Oc1ccc([nH]c1=O)Cl b9a4f0f9a3640d0810ae66328fe0105f [0,2,0,0,0,0|1,0,1]=4 2700 B12R1.233 CC(C)Oc1ccc(cc1Br)Br 098bdda5ed3fd6c93ff98ab52d458091 [0,2,0,0,0,0|2,0,0]=4 2701 B12R1.233 CC(C)Oc1ccc(cc1Br)Cl ca4eb5111a12aed13c28e8bb97fcf48d [0,2,0,0,0,0|2,0,0]=4 2702 B12R1.233 CC(C)Oc1ccc(cc1Br)F 97e1736e74f240ac55b376c57b45193d [0,2,0,0,0,0|2,0,0]=4 2703 B12R1.233 CC(C)Oc1ccc(cc1Br)I 725d987224c564d02fd2a7586c357d08 [0,2,0,0,0,0|2,0,0]=4 2704 B12R1.233 CC(C)Oc1ccc(cc1Cl)Br dc4ef45e98f1b68c8cb850430304e943 [0,2,0,0,0,0|2,0,0]=4 2705 B12R1.233 CC(C)Oc1ccc(cc1Cl)Cl 94c7c3e065e890b54c4447cc73815b18 [0,2,0,0,0,0|2,0,0]=4 2706 B12R1.233 CC(C)Oc1ccc(cc1Cl)F 61e88ade12a0d475f74ef71c60bf1904 [0,2,0,0,0,0|2,0,0]=4 2707 B12R1.233 CC(C)Oc1ccc(cc1Cl)I aa67498d8bf030decc175fbbc918deb8 [0,2,0,0,0,0|2,0,0]=4 2708 B12R1.233 CC(C)Oc1ccc(cc1F)Br c19a64299d57df40c2c8843fac24aea1 [0,2,0,0,0,0|2,0,0]=4 2709 B12R1.233 CC(C)Oc1ccc(cc1F)Cl ebaeec894da229891250f137b6a763c0 [0,2,0,0,0,0|2,0,0]=4 2710 B12R1.233 CC(C)Oc1ccc(cc1F)F a0d488c173b8c6c0fb4f73c5a7d54376 [0,2,0,0,0,0|2,0,0]=4 2711 B12R1.233 CC(C)Oc1ccc(cc1F)I ec63e069bd6f7821c8a1c0bec4ef0722 [0,2,0,0,0,0|2,0,0]=4 2712 B12R1.233 CC(C)Oc1ccc(cc1I)Br 317f84f710da89a2e7084bf20f32752a [0,2,0,0,0,0|2,0,0]=4 2713 B12R1.233 CC(C)Oc1ccc(cc1I)Cl 8bc4c9a0ef318d0787cdaa02aa022c33 [0,2,0,0,0,0|2,0,0]=4 2714 B12R1.233 CC(C)Oc1ccc(cc1I)F b77dba761b711162cdd09284c1d5f664 [0,2,0,0,0,0|2,0,0]=4 2715 B12R1.233 CC(C)Oc1ccc(cc1I)I 4135bae58d5760016b284b3625a3d0cc [0,2,0,0,0,0|2,0,0]=4 2716 B12R1.233 CC(C)Oc1ccc(nc1Br)Br 95110b38f3e88af59530febbd40c5c2e [0,2,0,0,0,0|1,0,0]=3 2717 B12R1.233 CC(C)Oc1ccc(nc1Br)Cl 30bb47fea3430023b025859d22ccc77e [0,2,0,0,0,0|1,0,0]=3 2718 B12R1.233 CC(C)Oc1ccc(nc1Br)F ee28bc9877732c290827ba9afb7628e8 [0,2,0,0,0,0|1,0,0]=3 2719 B12R1.233 CC(C)Oc1ccc(nc1Br)I d68d21cd9741e82373a2e4b4bdcf5a4a [0,2,0,0,0,0|1,0,0]=3 2720 B12R1.233 CC(C)Oc1ccc(nc1Cl)Br ce8be380ed59ce99bd4079fccd666633 [0,2,0,0,0,0|1,0,0]=3 2721 B12R1.233 CC(C)Oc1ccc(nc1Cl)Cl 5491826176cb15baec5058adb9646fde [0,2,0,0,0,0|1,0,0]=3 2722 B12R1.233 CC(C)Oc1ccc(nc1Cl)I d7023109aafba276163b9a9d0cc98668 [0,2,0,0,0,0|1,0,0]=3 2723 B12R1.233 CC(C)Oc1ccc(nc1F)Br ec3a276b98eab01348e1b28459edd3ab [0,2,0,0,0,0|1,0,0]=3 2724 B12R1.233 CC(C)Oc1ccc(nc1F)Cl 9d07c67ef4fe9c45114b9869010dd224 [0,2,0,0,0,0|1,0,0]=3 2725 B12R1.233 CC(C)Oc1ccc(nc1F)F 711ee7de9637a04816b3d347690c8bb7 [0,2,0,0,0,0|1,0,0]=3 2726 B12R1.233 CC(C)Oc1ccc(nc1F)I a9608abfd9c5cf7fcd2b2e3c5c25d23f [0,2,0,0,0,0|1,0,0]=3 2727 B12R1.233 CC(C)Oc1ccc(nc1I)Br 2fa5b9575031f646370dfc05ec793f6f [0,2,0,0,0,0|1,0,0]=3 2728 B12R1.233 CC(C)Oc1ccc(nc1I)Cl 6a1b65344a9d4929a58e32049e3fd16d [0,2,0,0,0,0|1,0,0]=3 2729 B12R1.233 CC(C)Oc1ccc(nc1I)F 66491bb065c6789609923420f8ac82b6 [0,2,0,0,0,0|1,0,0]=3 2730 B12R1.233 CC(C)Oc1ccc(nc1I)I e70ae0bfbea19f2b301f5eaad4e51ffa [0,2,0,0,0,0|1,0,0]=3 2731 B12R1.233 CC(C)Oc1cnc(cc1Br)Cl 7999d4f9eeae99f8ad176952c3402214 [0,2,0,0,0,0|1,0,0]=3 2732 B12R1.233 CC(C)Oc1cnc(cc1Br)F 4a8be214599de7b84fe4b42da73bbe79 [0,2,0,0,0,0|1,0,0]=3 2733 B12R1.233 CC(C)Oc1cnc(cc1Cl)Br bfb48b8325ab69b4a2aca4c15308bd05 [0,2,0,0,0,0|1,0,0]=3 2734 B12R1.233 CC(C)Oc1cnc(cc1Cl)Cl 958c39f36ad5bd7076456daabfaabaf0 [0,2,0,0,0,0|1,0,0]=3 2735 B12R1.233 CC(C)Oc1cnc(cc1F)Br 04d66a3ed41fdaeecf18c582f42cd1dd [0,2,0,0,0,0|1,0,0]=3 2736 B12R1.233 CC(C)Oc1cnc(cc1F)Cl c5e3316c1a14d2a85ceb6901d0275d03 [0,2,0,0,0,0|1,0,0]=3 2737 B12R1.233 CC(C)Oc1cnc(cc1F)F 70d92e745b86ba8b04e62b26b3674b03 [0,2,0,0,0,0|1,0,0]=3 2738 B12R1.233 CC(C)Oc1cnc(cc1I)Cl f223705b3162f998b91e685828392a4f [0,2,0,0,0,0|1,0,0]=3 2739 B12R1.233 CC(C)Oc1cnc(cc1I)F 5ef013344ab003b89018ef801db7a1a0 [0,2,0,0,0,0|1,0,0]=3 2740 B12R1.233 CC(C)Oc1cnc(nc1Cl)Cl cf6bb83d5046371fe3f8610d81170f37 [0,2,0,0,0,0|2,0,0]=4 2741 B12R1.233 CC(C)Oc1ncc(nc1Br)Br 308b9ae9de35549583c1b3b7dcbfa8fe [0,2,0,0,0,0|2,0,0]=4 2742 B12R1.233 Cc1cc(=O)c(co1)OC(C)C 3b96a8f03171deb38d1de8288f6b9bed [0,2,0,0,0,0|2,0,0]=4 2743 B12R1.233 Cc1cc(c(cn1)OC(C)C)Br a452dcfb90d5b0814f46dd1aa3c6b535 [0,2,0,0,0,0|1,0,0]=3 2744 B12R1.233 Cc1cc(c(cn1)OC(C)C)C 2c4cd4c57e028cec78f85457e5218eb2 [0,2,0,0,0,0|1,0,0]=3 2745 B12R1.233 Cc1cc(c(nn1)NC(C)C)Br 10e073411c15607233380582e356bae7 [0,2,0,0,0,0|2,0,0]=4 2746 B12R1.233 Cc1cc(c(nn1)NC(C)C)C 3cf78f2a0ce756b6aadcb16acf292d43 [0,2,0,0,0,0|2,0,0]=4 2747 B12R1.233 Cc1cc(c(nn1)NC(C)C)Cl b1c055a97c2550d3b42350bc29fccd71 [0,2,0,0,0,0|2,0,0]=4 2748 B12R1.233 Cc1cc(ccc1NC(C)C)Cl 1eedc78e616cc8ffded0524dc00b358a [0,2,0,0,0,0|2,0,0]=4 2749 B12R1.233 Cc1cc(ccc1NC(C)C)F d6986148e6ff374f2a3effaaddcffc37 [0,2,0,0,0,0|2,0,0]=4 2750 B12R1.233 Cc1cc(ccc1OC(C)C)Br c6d764738edf5fc36a9cf8a028e41de0 [0,2,0,0,0,0|2,0,0]=4 2751 B12R1.233 Cc1cc(ccc1OC(C)C)Cl 97be465d047359724cf67eaae0b2c906 [0,2,0,0,0,0|2,0,0]=4 2752 B12R1.233 Cc1cc(ccc1OC(C)C)F 653f6e353a8cd508674520d2b66f5895 [0,2,0,0,0,0|2,0,0]=4 2753 B12R1.233 Cc1cc(ccc1OC(C)C)I 53cb0000d54633c155e04ec97c3ba650 [0,2,0,0,0,0|2,0,0]=4 2754 B12R1.233 Cc1cc(ccc1OC(C)C)S 7f319052b88783c96afd5300f75fe918 [0,2,0,0,0,0|2,0,0]=4 2755 B12R1.233 Cc1cc(ncc1NC(C)C)Br a3b7b7a19a19949242252b258ce85ba4 [0,2,0,0,0,0|1,0,0]=3 2756 B12R1.233 Cc1cc(ncc1NC(C)C)Cl ca5e9cf20e1c5e3ad0ffdd7dcd3f16a2 [0,2,0,0,0,0|1,0,0]=3 2757 B12R1.233 Cc1cc(ncc1NC(C)C)F 77c1bd240ecf2cf7442e8d1bac883a2b [0,2,0,0,0,0|1,0,0]=3 2758 B12R1.233 Cc1cc(ncc1OC(C)C)Br c788a0f0aad64aed6984df0c676a3f94 [0,2,0,0,0,0|1,0,0]=3 2759 B12R1.233 Cc1cc(ncc1OC(C)C)Cl cac26aa425bd2ffaa9b05212543a2ad8 [0,2,0,0,0,0|1,0,0]=3 2760 B12R1.233 Cc1cc(ncc1OC(C)C)F fcc3c1f84e3d340f3bfca0023b93f5b9 [0,2,0,0,0,0|1,0,0]=3 2761 B12R1.233 Cc1cc(nnc1NC(C)C)Cl 80f1de91961bf80ad36a2367f5b205ee [0,2,0,0,0,0|2,0,0]=4 2762 B12R1.233 Cc1ccc(c(c1)Br)OC(C)C a6acb72565c1996c7186d52ef233977e [0,2,0,0,0,0|2,0,0]=4 2763 B12R1.233 Cc1ccc(c(c1)C)OC(C)C e8a1dd9cf22f9f189889c6759f3d2597 [0,2,0,0,0,0|2,0,0]=4 2764 B12R1.233 Cc1ccc(c(c1)Cl)NC(C)C f5ebe6c3a2cb7d1f602e21c7615eb132 [0,2,0,0,0,0|2,0,0]=4 2765 B12R1.233 Cc1ccc(c(c1)Cl)OC(C)C 00259539b9ee20d1eed7c19321176a91 [0,2,0,0,0,0|2,0,0]=4 2766 B12R1.233 Cc1ccc(c(c1)F)OC(C)C 238a88c0f3172d14bfc80d688936a5ee [0,2,0,0,0,0|2,0,0]=4 2767 B12R1.233 Cc1ccc(c(c1)I)OC(C)C 1d1600ad5412c16151912850934cf2ae [0,2,0,0,0,0|2,0,0]=4 2768 B12R1.233 Cc1ccc(c(n1)Br)NC(C)C b6a65a149eefaac6f069200e281608da [0,2,0,0,0,0|1,0,0]=3 2769 B12R1.233 Cc1ccc(c(n1)Br)OC(C)C aafe7b09169826616ce41c7f894d6a18 [0,2,0,0,0,0|1,0,0]=3 2770 B12R1.233 Cc1ccc(c(n1)C)NC(C)C fd3fdfd0d533a46a7b626fdc8c8eddbc [0,2,0,0,0,0|1,0,0]=3 2771 B12R1.233 Cc1ccc(c(n1)C)OC(C)C 4ea440743688e2ecc8f353c9facb6639 [0,2,0,0,0,0|1,0,0]=3 2772 B12R1.233 Cc1ccc(c(n1)Cl)NC(C)C 5e68d7ea94e7fe9898632b92833ef672 [0,2,0,0,0,0|1,0,0]=3 2773 B12R1.233 Cc1ccc(c(n1)Cl)OC(C)C eff2bcdf18d5664d95e9938b6786c2c9 [0,2,0,0,0,0|1,0,0]=3 2774 B12R1.233 Cc1ccc(c(n1)F)NC(C)C d3fa497cc19461163a10702080a24984 [0,2,0,0,0,0|1,0,0]=3 2775 B12R1.233 Cc1ccc(c(n1)F)OC(C)C 2d4b9b5a138d0d5cb5d95d787ebb3732 [0,2,0,0,0,0|1,0,0]=3 2776 B12R1.233 Cc1ccc(c(n1)I)NC(C)C e1fdb2ee3f73a530721486b74c01b205 [0,2,0,0,0,0|1,0,0]=3 2777 B12R1.233 Cc1ccc(c(n1)I)OC(C)C e1c0c1aabab24e35d80f44049ecd963d [0,2,0,0,0,0|1,0,0]=3 2778 B12R1.233 Cc1cnc(c(n1)Br)NC(C)C f57706b22f76404b76ca477229f4e0e1 [0,2,0,0,0,0|2,0,0]=4 2779 B12R1.233 Cc1cnc(c(n1)C)NC(C)C a0bc0e50fc2c1361755bda3ace36f10f [0,2,0,0,0,0|2,0,0]=4 2780 B12R1.233 Cc1cnc(c(n1)C)OC(C)C a68788cc0e7db020c13bd07671b423e5 [0,2,0,0,0,0|2,0,0]=4 2781 B12R1.233 Cc1cnc(c(n1)Cl)NC(C)C 7e700f7c690e87a5c5f9a80935b8299c [0,2,0,0,0,0|2,0,0]=4 2782 B12R1.233 Cc1nc(=O)c(c[nH]1)NC(C)C 05eca1c65d52c384b132d1034d3d3193 [0,2,0,0,0,0|2,0,0]=4 2783 B12R1.233 Cc1nc(ccc1NC(C)C)Br b05ba6b5d032c06eb6c658516254ae86 [0,2,0,0,0,0|1,0,0]=3 2784 B12R1.233 Cc1nc(ccc1NC(C)C)Cl c3368cd4bd25371d0faf07f460b061fc [0,2,0,0,0,0|1,0,0]=3 2785 B12R1.233 Cc1nc(ccc1NC(C)C)F 907d90cafe7c90c3c3cdddcd01e3768f [0,2,0,0,0,0|1,0,0]=3 2786 B12R1.233 Cc1nc(ccc1OC(C)C)Br dae2b652b42491cad9c6615e99fcb0aa [0,2,0,0,0,0|1,0,0]=3 2787 B12R1.233 Cc1nc(ccc1OC(C)C)Cl 49661f582225df167ad21740a862eb4b [0,2,0,0,0,0|1,0,0]=3 2788 B12R1.233 Cc1nc(ccc1OC(C)C)F 69890108424d5f9d9be4f7a102b0e990 [0,2,0,0,0,0|1,0,0]=3 2789 B12R1.233 Cc1nc(ccc1OC(C)C)I 597f075a11f311cbe25fe48753fb3043 [0,2,0,0,0,0|1,0,0]=3 2790 B12R1.233 Cc1nc(cnc1NC(C)C)Br 357d206a663c91528294b2c23dc04167 [0,2,0,0,0,0|2,0,0]=4 2791 B12R1.233 Cc1nc(cnc1NC(C)C)Cl 7890bbabf0183862cb878a8f83d09f04 [0,2,0,0,0,0|2,0,0]=4 2792 B12R1.233 Cc1nc(cnc1NC(C)C)I 258e9a3d5980861e6b57a5f5ef42aef6 [0,2,0,0,0,0|2,0,0]=4 2793 B12R1.233 Cc1nc(cnc1OC(C)C)Br 1321bc26b6524119ce0f26bf33655b0d [0,2,0,0,0,0|2,0,0]=4 2794 B12R1.233 Cc1nc(ncc1NC(C)C)Cl 12e0b59f1af33e011637f09f9ed94332 [0,2,0,0,0,0|2,0,0]=4 2795 B12R1.233 Cc1nc(ncc1OC(C)C)Cl e797779bab5dd27a543019c0ca0ae8b2 [0,2,0,0,0,0|2,0,0]=4 2796 B12R1.233 Cc1ncc(c(n1)C)NC(C)C 680d13299b14bead276a0fed15ad403c [0,2,0,0,0,0|2,0,0]=4 2797 B12R1.233 Cc1ncc(c(n1)C)OC(C)C 5ef873fbd7c4dad89a38c6b91607ee18 [0,2,0,0,0,0|2,0,0]=4 2798 B12R1.233 Cc1ncc(c(n1)Cl)NC(C)C fbde00b9994ec3a5e902f359854ae1bc [0,2,0,0,0,0|2,0,0]=4 2799 B12R1.34 C=CC(C)N(C)c1cccnc1 52fd66aacdd7f6bd420808c7c311eabd [0,2,0,0,0,0|1,0,1]=4 2800 B12R1.34 CC(C=O)N(C)c1cccnc1 8f97a9535f3d550a528ccaaac34200ab [0,2,0,0,0,0|1,0,1]=4 2801 B12R1.34 CC(CO)N(C)c1ccccc1 a7ee7abf471efad76d65ff005aacf1dd [0,2,0,0,0,0|2,0,0]=4 2802 B12R1.34 CC(CO)N(C)c1cccnc1 7fab529fa88240be5b7c65c3182910e1 [0,2,0,0,0,0|1,0,0]=3 2803 B12R1.34 CC(CO)N(C)c1ccnnc1 785d345490c27d62bf0219eb2777fd55 [0,2,0,0,0,0|2,0,0]=4 2804 B12R1.34 CC(CO)N(C)c1cnccn1 f2d36f16f61fbc1fd3a32a721e16011d [0,2,0,0,0,0|2,0,0]=4 2805 B12R1.34 CC(c1cccnc1)N(C)C=O eadc4fc932bb9b230f442460a264564b [0,2,0,0,0,0|1,0,1]=4 2806 B12R1.34 CCC(C)N(C)c1cccnc1 707e066f5f77e29216e51fa77aa6ca79 [0,2,0,0,0,0|1,0,0]=3 2807 B12R1.34 CCC(C)N(C)c1ccnnc1 d119b68a4584d6b6ff9daac1f84a0c4b [0,2,0,0,0,0|2,0,0]=4 2808 B12R1.34 CCC(C)N(C)c1cnccn1 59b4a069b8f13d00562d6394d339bfc9 [0,2,0,0,0,0|2,0,0]=4 2809 B12R1.34 CCN(C)C(=O)c1cccnc1 1e75e6fc9c1cd715800d0391de49d208 [0,2,0,0,0,0|1,0,1]=4 2810 B12R1.34 C[C@@H](CO)N(C)c1ccccc1 96b24e6691fa0d3459c276c6ca2c2615 [0,2,0,0,0,0|2,0,0]=4 2811 B12R1.34 C[C@@H](CO)N(C)c1cccnc1 b1c6c5f782ac21b7f9a8a54582e4c438 [0,2,0,0,0,0|1,0,0]=3 2812 B12R1.34 C[C@@H](CO)N(C)c1ccnnc1 60d01f63d4133fe9d0f1443a8348cb81 [0,2,0,0,0,0|2,0,0]=4 2813 B12R1.34 C[C@@H](CO)N(C)c1cnccn1 c76578656b36ba09be62a69d95a4aa3f [0,2,0,0,0,0|2,0,0]=4 2814 B12R1.34 C[C@H](C=O)N(C)c1cccnc1 73d8ce1afe6a737c5dbd75d19aaccd90 [0,2,0,0,0,0|1,0,1]=4 2815 B12R1.34 C[C@H](CO)N(C)c1ccccc1 a37c707a1c025793f08fdf6588fbc88b [0,2,0,0,0,0|2,0,0]=4 2816 B12R1.34 C[C@H](CO)N(C)c1cccnc1 0aa06d0f54ef124a8bab95122479b46c [0,2,0,0,0,0|1,0,0]=3 2817 B12R1.34 C[C@H](CO)N(C)c1ccnnc1 c4a8140c9462f765d06d8f3d9445560b [0,2,0,0,0,0|2,0,0]=4 2818 B12R1.34 C[C@H](CO)N(C)c1cnccn1 1ee016cba17582560a5d5a18edd07a6e [0,2,0,0,0,0|2,0,0]=4 2819 B12R1.124 CC(C)N(C)c1cccnc1Cl 76c5741aeeeed61ff94e47da78452c45 [0,2,0,0,0,0|1,0,0]=3 2820 B12R1.124 CC(C)N(C)c1cccnc1F 637166212718623c3861aacf72f9d90f [0,2,0,0,0,0|1,0,0]=3 2821 B12R1.124 CC(C)N(C)c1cnccc1F e244d0e3caf293b31ac2e3eb4c7c1cc9 [0,2,0,0,0,0|1,0,0]=3 2822 B12R1.124 CC(C)N(C)c1nccnc1Cl 79195fba27c39d8d341e87c8d767a0bb [0,2,0,0,0,0|2,0,0]=4 2823 B12R1.124 Cc1ncccc1N(C)C(C)C a0392e1b87f3896fd506bc56203f9674 [0,2,0,0,0,0|1,0,0]=3 2824 B12R1.124 Cc1nccnc1N(C)C(C)C abc1b3eae9adeab92a992595a4a066e3 [0,2,0,0,0,0|2,0,0]=4 2825 B12R1.225 CC(C)N(C)c1cccc(c1)Br 404c236cddda68afae2a72dcb1e91c48 [0,2,0,0,0,0|2,0,0]=4 2826 B12R1.225 CC(C)N(C)c1cccc(c1)I 4d85a7a31cabd784005d5d22697530e3 [0,2,0,0,0,0|2,0,0]=4 2827 B12R1.478 CC(C)N(C#N)c1ccccc1 791504caa838a69af0259636516d458c [0,2,0,0,0,0|2,0,0]=4 2828 B12R1.478 CC(C)N(C=O)c1cccnn1 d52a5cfcc9e384168fc8e6a2e7894347 [0,2,0,0,0,0|2,0,0]=4 2829 B12R1.478 CC(C)N(CO)c1cccnn1 30ec963eef42ab94a3686c4cb5a172b3 [0,2,0,0,0,0|2,0,0]=4 2830 B12R1.478 CCN(c1ccnnc1)C(C)C 8123e81fd9d26d4685acff21a76c8ab2 [0,2,0,0,0,0|2,0,0]=4 2831 B12R1.564 CN(c1ccccc1)C(C)(C)C e80532fb4161df898c2fab27c7c13676 [0,2,0,0,0,0|2,0,0]=4 2832 B12R1.564 CN(c1cccnc1)C(C)(C)C 8266fc1594ae94dee97608b435f6c2eb [0,2,0,0,0,0|1,0,0]=3 2833 B12R1.32 C#CCN(C)Cc1ccccc1 e56580931f8cdab6398e6e077f7d4a03 [0,2,0,0,0,0|2,0,0]=4 2834 B12R1.32 C#CCN(C)Cc1cccnc1 6a0e8980e1db38379d45f813996daa18 [0,2,0,0,0,0|1,0,0]=3 2835 B12R1.32 C#CCN(C)Cc1cccnn1 d21a028e18ff26853281160ae7c85df0 [0,2,0,0,0,0|2,0,0]=4 2836 B12R1.32 C#CCN(C)Cc1ccnnc1 56f8a81cf383169d53ab6ec3e9d1afd2 [0,2,0,0,0,0|2,0,0]=4 2837 B12R1.32 C#CCN(C)Cc1cnccn1 a3371f0a3abc18f3f65b437dc25e146e [0,2,0,0,0,0|2,0,0]=4 2838 B12R1.32 C#CCN(C)Cc1cncnc1 9b47b436f8d36182242fa6ae8b32ad3c [0,2,0,0,0,0|2,0,0]=4 2839 B12R1.32 C=CCN(C)Cc1ccccc1 f858c6ed41b995ef747d3394b7bc7ac3 [0,2,0,0,0,0|2,0,0]=4 2840 B12R1.32 C=CCN(C)Cc1cccnc1 5d2dc25e8f2b6d22904aa527ad25ef22 [0,2,0,0,0,0|1,0,0]=3 2841 B12R1.32 C=CCN(C)Cc1cccnn1 56be708c5c7546cf352124755e2fae59 [0,2,0,0,0,0|2,0,0]=4 2842 B12R1.32 C=CCN(C)Cc1ccnnc1 cf345f56e17efcaea1a1fd1eebe87d0e [0,2,0,0,0,0|2,0,0]=4 2843 B12R1.32 C=CCN(C)Cc1cnccn1 54aa520209b7a3d593d00acdd5735177 [0,2,0,0,0,0|2,0,0]=4 2844 B12R1.32 C=CCN(C)Cc1cncnc1 91a2bc573feb03a49ccf7dd4fbf263a3 [0,2,0,0,0,0|2,0,0]=4 2845 B12R1.32 CC(CC#N)Nc1ccccc1 9d497ef86eee6b3cf19732b73151dfc5 [0,2,0,0,0,0|2,0,0]=4 2846 B12R1.32 CC(CC#N)Nc1cccnc1 85e1a1944bb090848679d4a1ae0ed26c [0,2,0,0,0,0|1,0,0]=3 2847 B12R1.32 CC(CC#N)Nc1cccnn1 99062f4824efd5b073499e8324a4fcaf [0,2,0,0,0,0|2,0,0]=4 2848 B12R1.32 CC(CC#N)Nc1ccnnc1 ac02d31a0ec5b51d15d36c8f76b96db6 [0,2,0,0,0,0|2,0,0]=4 2849 B12R1.32 CC(CC#N)Nc1cnccn1 aaff2e85ff8d52b96492f9c56167b29e [0,2,0,0,0,0|2,0,0]=4 2850 B12R1.32 CC(CC#N)Nc1cncnc1 1188243a4f4229332ae88427d331352e [0,2,0,0,0,0|2,0,0]=4 2851 B12R1.32 CC(CC#N)Oc1cccnc1 a300d4d03a3b3651e671d8cc577bbfa0 [0,2,0,0,0,0|1,0,0]=3 2852 B12R1.32 CC(CC#N)Oc1ccnnc1 aa0ac1320aab57fd9a4fde9bdcb0abb0 [0,2,0,0,0,0|2,0,0]=4 2853 B12R1.32 CC(CC#N)Oc1cnccn1 ddccc8d6712f9d823d620c0e8a8bfcaf [0,2,0,0,0,0|2,0,0]=4 2854 B12R1.32 CC(CC#N)Oc1cncnc1 a7a3d5c710782e3fc8a9695f8d01a8df [0,2,0,0,0,0|2,0,0]=4 2855 B12R1.32 CC(CCO)Nc1ccccc1 9bf70c52b6fbdda0acbad0fbf8bda5d0 [0,2,0,0,0,0|2,0,0]=4 2856 B12R1.32 CC(CCO)Nc1cccnc1 c7b8a995c73abbf3a7b86a5a39f02f1b [0,2,0,0,0,0|1,0,0]=3 2857 B12R1.32 CC(CCO)Nc1cccnn1 ce8006e1e3ad3601ec2d3176ae8a0baa [0,2,0,0,0,0|2,0,0]=4 2858 B12R1.32 CC(CCO)Nc1ccnnc1 5d5d32300aed06ea339ab8f9750ede23 [0,2,0,0,0,0|2,0,0]=4 2859 B12R1.32 CC(CCO)Nc1cnccn1 fbe36d708c6f04f3ad9b566890739f82 [0,2,0,0,0,0|2,0,0]=4 2860 B12R1.32 CC(Cc1ccccn1)NCF d5fdd6b98c347b6317b5d0d8cf3c28b6 [0,2,0,0,0,0|2,0,0]=4 2861 B12R1.32 CC(Cc1ccccn1)NCO eb641c414d0b15108bf9321647b7890c [0,2,0,0,0,0|2,0,0]=4 2862 B12R1.32 CC(Cc1ccccn1)OCF d6c424851ea201f763a1418247a6eb34 [0,2,0,0,0,0|2,0,0]=4 2863 B12R1.32 CC(Cc1cccnc1)NC=O e18776756d7d00508626c4e693f182de [0,2,0,0,0,0|0,0,1]=3 2864 B12R1.32 CC(Cc1cccnc1)NCF 0a8331e6b65f8d98e5c22c4682170fe6 [0,2,0,0,0,0|0,0,0]=2 2865 B12R1.32 CC(Cc1cccnc1)NCO 2d1e9d214ab4e58b5282fe30111314e4 [0,2,0,0,0,0|0,0,0]=2 2866 B12R1.32 CC(Cc1ccncc1)NCF 552d22a85f958469339986039ae7dce3 [0,2,0,0,0,0|2,0,0]=4 2867 B12R1.32 CC(Cc1ccncc1)NCO def23991f96c3f6436149b61afb90490 [0,2,0,0,0,0|2,0,0]=4 2868 B12R1.32 CC(Cc1cnccn1)NC=O dcd5f2baed34d8ef11366ea1e9d2d9eb [0,2,0,0,0,0|1,0,1]=4 2869 B12R1.32 CC(Cc1cnccn1)NCF 162ba9574e5d80553a18bb0728d80865 [0,2,0,0,0,0|1,0,0]=3 2870 B12R1.32 CC(Cc1cnccn1)NCO f86cc27b8a2719a3865d7f92ea5b3f87 [0,2,0,0,0,0|1,0,0]=3 2871 B12R1.32 CC(Cc1cnccn1)OCF 19c4f4c9a50c77974aa8cdac147d1ec7 [0,2,0,0,0,0|1,0,0]=3 2872 B12R1.32 CCCC(C)Nc1ccccc1 0980d123cfa1556625b2cd315916fb5f [0,2,0,0,0,0|2,0,0]=4 2873 B12R1.32 CCCC(C)Nc1cccnc1 af2a7472e895c61981327f4b8de00ee9 [0,2,0,0,0,0|1,0,0]=3 2874 B12R1.32 CCCC(C)Nc1cccnn1 4a3b3a4f6b8f10fdeb3fd5d91ccf093d [0,2,0,0,0,0|2,0,0]=4 2875 B12R1.32 CCCC(C)Nc1ccnnc1 0a73d94558a158feeb6314da9d411617 [0,2,0,0,0,0|2,0,0]=4 2876 B12R1.32 CCCC(C)Nc1cnccn1 5e0ac452f66c3352f66df0a830175170 [0,2,0,0,0,0|2,0,0]=4 2877 B12R1.32 CCCC(C)Oc1cccnc1 16283b7b4266224a92efdc8338a94776 [0,2,0,0,0,0|1,0,0]=3 2878 B12R1.32 CCCC(C)Oc1ccnnc1 82bf61db74834980473205bc8f3cde17 [0,2,0,0,0,0|2,0,0]=4 2879 B12R1.32 CCCC(C)Oc1cnccn1 1992d4e0d8a70e195f806a9236813dfa [0,2,0,0,0,0|2,0,0]=4 2880 B12R1.32 CCCN(C)Cc1ccccc1 4eed5f3692a34dc05deac3e14f757f4f [0,2,0,0,0,0|2,0,0]=4 2881 B12R1.32 CCCN(C)Cc1cccnc1 60746a1075dd28e04eb10086fae0b820 [0,2,0,0,0,0|1,0,0]=3 2882 B12R1.32 CCCN(C)Cc1cccnn1 de5c0eb74cd9abbe9449532ba3643c60 [0,2,0,0,0,0|2,0,0]=4 2883 B12R1.32 CCCN(C)Cc1ccnnc1 bd3ef679eb9bfc9be21641239f03e101 [0,2,0,0,0,0|2,0,0]=4 2884 B12R1.32 CCCN(C)Cc1cnccn1 3b47eeecf77069f5bfd14dcb1d5a3e6b [0,2,0,0,0,0|2,0,0]=4 2885 B12R1.32 CCCN(C)Cc1cncnc1 83502c51e40c879c6415a10a35356dd2 [0,2,0,0,0,0|2,0,0]=4 2886 B12R1.32 CCC[C@H](C)Nc1ccccc1 14114dc7aca9a95d33818d8f8cfafa73 [0,2,0,0,0,0|2,0,0]=4 2887 B12R1.32 CCNC(C)Cc1ccccn1 3f739570fdaf944ffb41444c69149a83 [0,2,0,0,0,0|2,0,0]=4 2888 B12R1.32 CCNC(C)Cc1cccnc1 1c73ce06501092b14624237b8eaa830e [0,2,0,0,0,0|0,0,0]=2 2889 B12R1.32 CCNC(C)Cc1ccncc1 1ac39eab33f6c8633237d01993a17382 [0,2,0,0,0,0|2,0,0]=4 2890 B12R1.32 CCNC(C)Cc1cnccn1 bda15725b23b5e321786fab09c3daddb [0,2,0,0,0,0|1,0,0]=3 2891 B12R1.32 CCOC(C)Cc1ccccc1 37a2c2b5ef50b1a7cf2088b7456e4451 [0,2,0,0,0,0|1,0,0]=3 2892 B12R1.32 CCOC(C)Cc1ccccn1 144eae020541eabb52d7b3534ceef0a4 [0,2,0,0,0,0|2,0,0]=4 2893 B12R1.32 CCOC(C)Cc1cnccn1 3ecdf3d8e361b30d87e2f6f581391495 [0,2,0,0,0,0|1,0,0]=3 2894 B12R1.32 CCO[C@@H](C)Cc1ccccc1 19276107fa4d022850aeee4089dafd0c [0,2,0,0,0,0|1,0,0]=3 2895 B12R1.32 CCO[C@H](C)Cc1ccccc1 2f8e91d1dc9d2f9667dcff63e87e082c [0,2,0,0,0,0|1,0,0]=3 2896 B12R1.32 CN(CC#N)Cc1ccccc1 5c32846a8b8f40e8ba55bc3d3a77884c [0,2,0,0,0,0|2,0,0]=4 2897 B12R1.32 CN(CC#N)Cc1cccnc1 89cd4ba63d950224c9ceb46d82514161 [0,2,0,0,0,0|1,0,0]=3 2898 B12R1.32 CN(CC#N)Cc1cccnn1 cdaa769c6dabf858adf75fb970de54c4 [0,2,0,0,0,0|2,0,0]=4 2899 B12R1.32 CN(CC#N)Cc1ccnnc1 2ff7701c053717f0a4cc9326347c68ad [0,2,0,0,0,0|2,0,0]=4 2900 B12R1.32 CN(CC#N)Cc1cnccn1 8c45329f6a5a83507e7b15ce254e7233 [0,2,0,0,0,0|2,0,0]=4 2901 B12R1.32 CN(CC#N)Cc1cncnc1 cdc0874002d132a8404e2196d521bba5 [0,2,0,0,0,0|2,0,0]=4 2902 B12R1.32 CN(CC=O)Cc1ccccc1 7580b9a13b83ef7e7f2ffe8dfb9a649a [0,2,0,0,0,0|2,0,0]=4 2903 B12R1.32 CN(CC=O)Cc1cccnc1 97dd855d07a3a070d0c9cf1a88947407 [0,2,0,0,0,0|1,0,0]=3 2904 B12R1.32 CN(CC=O)Cc1ccnnc1 abce0fa4294b5e330d5ef2e47249f8f8 [0,2,0,0,0,0|2,0,0]=4 2905 B12R1.32 CN(CC=O)Cc1cnccn1 198cef1b66f6af3b2e4f7d26f003610c [0,2,0,0,0,0|2,0,0]=4 2906 B12R1.32 CN(CC=O)Cc1cncnc1 8f580727cdee753a90f2ec90522cecd9 [0,2,0,0,0,0|2,0,0]=4 2907 B12R1.32 CN(CCF)Cc1ccccc1 c2bce3f6897fd6361961da43db186c6c [0,2,0,0,0,0|2,0,0]=4 2908 B12R1.32 CN(CCF)Cc1cccnc1 e34d8abf0a253f9394e6fbf169fba993 [0,2,0,0,0,0|1,0,0]=3 2909 B12R1.32 CN(CCF)Cc1cccnn1 01cafd5e183c78f25edc0f5b45769d27 [0,2,0,0,0,0|2,0,0]=4 2910 B12R1.32 CN(CCF)Cc1ccnnc1 efe360359d0d3cc4e392e1201d03da12 [0,2,0,0,0,0|2,0,0]=4 2911 B12R1.32 CN(CCF)Cc1cnccn1 fbfce4e42f774aa0592e2d34ac42fa5f [0,2,0,0,0,0|2,0,0]=4 2912 B12R1.32 CN(CCF)Cc1cncnc1 c1e4e029033e83f97bf70c37cf6ec29b [0,2,0,0,0,0|2,0,0]=4 2913 B12R1.32 CN(CCO)Cc1ccccc1 757bf36fdf4b02517da3241e86467be6 [0,2,0,0,0,0|2,0,0]=4 2914 B12R1.32 CN(CCO)Cc1cccnc1 503535e0b68231fb7ab3eaa25b27a0c2 [0,2,0,0,0,0|1,0,0]=3 2915 B12R1.32 CN(CCO)Cc1cccnn1 7ec1319ca1cdee0b7fbbec8ca65b84b4 [0,2,0,0,0,0|2,0,0]=4 2916 B12R1.32 CN(CCO)Cc1ccnnc1 7fc7fcbee72be264220244f91b00d7c1 [0,2,0,0,0,0|2,0,0]=4 2917 B12R1.32 CN(CCO)Cc1cnccn1 975c82527d963422732ef53161de26e5 [0,2,0,0,0,0|2,0,0]=4 2918 B12R1.32 CN(CCO)Cc1cncnc1 802d1b29d753c7ec9690052af9290969 [0,2,0,0,0,0|2,0,0]=4 2919 B12R1.32 CN(CCS)Cc1ccccc1 8e8f744accb260bbf35bc2715f513a4e [0,2,0,0,0,0|2,0,0]=4 2920 B12R1.32 CN(CCS)Cc1cccnc1 80820448b1394091ff698d8bcfea58e2 [0,2,0,0,0,0|1,0,0]=3 2921 B12R1.32 CN(CCS)Cc1ccnnc1 e4cd430e4e52e6c8f718e8f5340e7ee0 [0,2,0,0,0,0|2,0,0]=4 2922 B12R1.32 CN(CCS)Cc1cnccn1 71023342df27587d4aedac6471fae373 [0,2,0,0,0,0|2,0,0]=4 2923 B12R1.32 CN(CCS)Cc1cncnc1 9cf9a0b4a115e8e517f15a8e07d9ab1c [0,2,0,0,0,0|2,0,0]=4 2924 B12R1.32 COCC(C)Nc1ccccc1 918c3e9faef698920f78ca93350fda53 [0,2,0,0,0,0|2,0,0]=4 2925 B12R1.32 COCC(C)Nc1cccnc1 b812752e64d8737319fd6f3db07b6bc1 [0,2,0,0,0,0|1,0,0]=3 2926 B12R1.32 COCC(C)Nc1cccnn1 706a02eb6ddc599c7da65191d8bff4aa [0,2,0,0,0,0|2,0,0]=4 2927 B12R1.32 COCC(C)Nc1ccnnc1 8cd64052623ef14215699acb7ecbce80 [0,2,0,0,0,0|2,0,0]=4 2928 B12R1.32 COCC(C)Nc1cnccn1 889b7cc55a844b93564b89b38cf0517e [0,2,0,0,0,0|2,0,0]=4 2929 B12R1.32 COCC(C)Nc1cncnc1 0e508ec3dccdbcdc81634e93e9db5a2e [0,2,0,0,0,0|2,0,0]=4 2930 B12R1.32 COCC(C)Oc1cccnc1 e8657e7fea231a3cbb0976e5d4a5b3d8 [0,2,0,0,0,0|1,0,0]=3 2931 B12R1.32 COCC(C)Oc1ccnnc1 044ee401f3d10fc4489e5c6c82b7044b [0,2,0,0,0,0|2,0,0]=4 2932 B12R1.32 COCC(C)Oc1cnccn1 0c9552f56f369faf7edd37c2f274a26c [0,2,0,0,0,0|2,0,0]=4 2933 B12R1.32 COCC(C)Oc1cncnc1 6b24792dd03db001bc69444a60c77567 [0,2,0,0,0,0|2,0,0]=4 2934 B12R1.32 COCN(C)Cc1ccccc1 4d05c3d6ddf3ecec9a6b681c1068023b [0,2,0,0,0,0|2,0,0]=4 2935 B12R1.32 COCN(C)Cc1cccnc1 f50236404b504213455088d1b436a4c1 [0,2,0,0,0,0|1,0,0]=3 2936 B12R1.32 COCN(C)Cc1ccnnc1 625af7867fd8d52f59eb88db81d25159 [0,2,0,0,0,0|2,0,0]=4 2937 B12R1.32 COCN(C)Cc1cnccn1 b71aa0573c49daf69cc2f163b159c115 [0,2,0,0,0,0|2,0,0]=4 2938 B12R1.32 COCN(C)Cc1cncnc1 f34e02720a027720579645a3f3146454 [0,2,0,0,0,0|2,0,0]=4 2939 B12R1.32 COC[C@@H](C)Nc1ccccc1 b6337fbd6f770477a80a235354ba550b [0,2,0,0,0,0|2,0,0]=4 2940 B12R1.32 COC[C@@H](C)Nc1cccnc1 516207c81acf2dd1d4472d7b45572390 [0,2,0,0,0,0|1,0,0]=3 2941 B12R1.32 COC[C@@H](C)Nc1cccnn1 ccee5bf26bb2372a5999a0b0af733626 [0,2,0,0,0,0|2,0,0]=4 2942 B12R1.32 COC[C@H](C)Nc1ccccc1 6b0bb5bdf147fc56918f57a798a463a2 [0,2,0,0,0,0|2,0,0]=4 2943 B12R1.32 COC[C@H](C)Nc1cccnc1 0cec544e296a1ace9f6fb9794ec8ae21 [0,2,0,0,0,0|1,0,0]=3 2944 B12R1.32 COC[C@H](C)Nc1cccnn1 9fd5102cd92dfa039072b660fc3d61c4 [0,2,0,0,0,0|2,0,0]=4 2945 B12R1.32 CSCN(C)Cc1ccccc1 d9791fc92d257d5436d9d59fe9a2c04e [0,2,0,0,0,0|2,0,0]=4 2946 B12R1.32 CSCN(C)Cc1cccnc1 477b2a8c97766858e2c1454088c6776f [0,2,0,0,0,0|1,0,0]=3 2947 B12R1.32 CSCN(C)Cc1ccnnc1 b9fb6633617e88933489b39ca2522e9e [0,2,0,0,0,0|2,0,0]=4 2948 B12R1.32 CSCN(C)Cc1cnccn1 22c787cc661e446c84cc5d566a7816b6 [0,2,0,0,0,0|2,0,0]=4 2949 B12R1.32 CSCN(C)Cc1cncnc1 d570597db3600f7aa201e4aa6a0dd80e [0,2,0,0,0,0|2,0,0]=4 2950 B12R1.32 C[C@@H](CCO)Nc1ccccc1 fc83b26b05d5bb1e6a4de978429a6aa3 [0,2,0,0,0,0|2,0,0]=4 2951 B12R1.32 C[C@@H](CCO)Nc1cccnc1 c87bea4e8a4cfebb37b775d259b404cc [0,2,0,0,0,0|1,0,0]=3 2952 B12R1.32 C[C@H](CCO)Nc1ccccc1 83604672ebfdf7df8b733c8cb4f2aa8a [0,2,0,0,0,0|2,0,0]=4 2953 B12R1.32 C[C@H](CCO)Nc1cccnc1 ea70f12899bf83773b62a2d4a165c5b7 [0,2,0,0,0,0|1,0,0]=3 2954 B12R1.50 C#CC(C)Nc1cncc(c1)I ee9c982ec76649d6de874a8403b828d9 [0,2,0,0,0,0|1,0,1]=4 2955 B12R1.50 C#CC(C)Oc1cncc(c1)I 48fa6f931ef503103581ca52338dc929 [0,2,0,0,0,0|1,0,1]=4 2956 B12R1.50 C=CC(C)Nc1cncc(c1)Br dcd786a5cc792df29999b0fc7b546459 [0,2,0,0,0,0|1,0,1]=4 2957 B12R1.50 C=CC(C)Nc1cncc(c1)C e1706cdd7ca8f0e1d564c5e1b71136d2 [0,2,0,0,0,0|1,0,1]=4 2958 B12R1.50 C=CC(C)Nc1cncc(c1)Cl f8659f4a56f4ff8854ea1c79f491cc95 [0,2,0,0,0,0|1,0,1]=4 2959 B12R1.50 C=CC(C)Nc1cncc(c1)F 00cf567bc0d99804eae156a242a9fdd9 [0,2,0,0,0,0|1,0,1]=4 2960 B12R1.50 C=CC(C)Nc1cncc(c1)I e010d915889979386ce0f8a96d23d1c5 [0,2,0,0,0,0|1,0,1]=4 2961 B12R1.50 C=CC(C)Nc1cncc(c1)O 3f7c2bb45685133b872e23c48ef8274b [0,2,0,0,0,0|1,0,1]=4 2962 B12R1.50 C=CC(C)Oc1cncc(c1)Br cb0caf07b9a05128e6ac05c15402b82d [0,2,0,0,0,0|1,0,1]=4 2963 B12R1.50 C=CC(C)Oc1cncc(c1)C 7149a67fa70fe020456f9cf112009455 [0,2,0,0,0,0|1,0,1]=4 2964 B12R1.50 C=CC(C)Oc1cncc(c1)Cl f162ac2b23252a660336249c1669f4f8 [0,2,0,0,0,0|1,0,1]=4 2965 B12R1.50 C=CC(C)Oc1cncc(c1)F df5d632b51326eae4548be1288ce27b8 [0,2,0,0,0,0|1,0,1]=4 2966 B12R1.50 C=CC(C)Oc1cncc(c1)I 4fc941d296a0cc3230befaf8c739d0ad [0,2,0,0,0,0|1,0,1]=4 2967 B12R1.50 CC(C#N)Nc1cncc(c1)F 40163db445875efe01b388a0da59f5e1 [0,2,0,0,0,0|1,0,1]=4 2968 B12R1.50 CC(C=O)Nc1cncc(c1)Br 9355d0edc7be0ad251e7238ec54898e7 [0,2,0,0,0,0|1,0,1]=4 2969 B12R1.50 CC(C=O)Nc1cncc(c1)Cl 2a5594a2e0fcd9506ee2a01957b4d38f [0,2,0,0,0,0|1,0,1]=4 2970 B12R1.50 CC(C=O)Nc1cncc(c1)F 826ed0cf1f410af5b71c81ff2ed8662c [0,2,0,0,0,0|1,0,1]=4 2971 B12R1.50 CC(C=O)Nc1cncc(c1)I fc2093da60bdab97c85a3a371f299423 [0,2,0,0,0,0|1,0,1]=4 2972 B12R1.50 CC(C=O)Oc1cncc(c1)Br 377e437c1775ba59ce0e700b5f009f44 [0,2,0,0,0,0|1,0,1]=4 2973 B12R1.50 CC(C=O)Oc1cncc(c1)Cl 71965245c870a9d7b1aa8b2676780437 [0,2,0,0,0,0|1,0,1]=4 2974 B12R1.50 CC(C=O)Oc1cncc(c1)F b0767d481477628524e2ca7813cda7e9 [0,2,0,0,0,0|1,0,1]=4 2975 B12R1.50 CC(C=O)Oc1cncc(c1)I 9e8ec00c8ff82a2745efc404ae5230bf [0,2,0,0,0,0|1,0,1]=4 2976 B12R1.50 CC(CO)Nc1cc(cnn1)Br 0799bb81f69fbf9deebcbe53dc24f327 [0,2,0,0,0,0|2,0,0]=4 2977 B12R1.50 CC(CO)Nc1cc(cnn1)Cl b8f01f30da8a1d51993b3f3fa461b2ce [0,2,0,0,0,0|2,0,0]=4 2978 B12R1.50 CC(CO)Nc1cccc(c1)Br 576ec4f6677be1f0394edeaf258b38fe [0,2,0,0,0,0|2,0,0]=4 2979 B12R1.50 CC(CO)Nc1cccc(c1)Cl bd22220cbe1e26dbecd73c43bc0875f8 [0,2,0,0,0,0|2,0,0]=4 2980 B12R1.50 CC(CO)Nc1cccc(c1)F 61b69c3784d43bb9b9681ef8141ee922 [0,2,0,0,0,0|2,0,0]=4 2981 B12R1.50 CC(CO)Nc1cccc(c1)I 6634a846fe603d296254a7ec9e7b692c [0,2,0,0,0,0|2,0,0]=4 2982 B12R1.50 CC(CO)Nc1cn[nH]c(=O)c1 b9be7bd128daf73da086a7ff8586147f [0,2,0,0,0,0|2,0,0]=4 2983 B12R1.50 CC(CO)Nc1cncc(c1)Br 35101df469554e4f4e3dccffffcd7598 [0,2,0,0,0,0|1,0,0]=3 2984 B12R1.50 CC(CO)Nc1cncc(c1)Cl 9cd6dd7ce678ed3c9777339923035391 [0,2,0,0,0,0|1,0,0]=3 2985 B12R1.50 CC(CO)Nc1cncc(c1)F bce7a232ec681d20b05074d852fdb4d3 [0,2,0,0,0,0|1,0,0]=3 2986 B12R1.50 CC(CO)Nc1cncc(c1)I 82f9a79820c9539597abe5327cff4234 [0,2,0,0,0,0|1,0,0]=3 2987 B12R1.50 CC(CO)Nc1cncc(n1)Br bf81599e19f06b1df451ff66cf160f2c [0,2,0,0,0,0|2,0,0]=4 2988 B12R1.50 CC(CO)Nc1cncc(n1)Cl a6187495715880f309280da1220d7f9a [0,2,0,0,0,0|2,0,0]=4 2989 B12R1.50 CC(CO)Nc1cncc(n1)F 1fcfd48ed8042efaff487b37678eb7c6 [0,2,0,0,0,0|2,0,0]=4 2990 B12R1.50 CC(CO)Nc1cnnc(c1)Cl 4e3aee932ad59dbfeb85643db5c06141 [0,2,0,0,0,0|2,0,0]=4 2991 B12R1.50 CC(CO)Nc1cnnc(c1)F dfb31d308895e790d642df016a00c982 [0,2,0,0,0,0|2,0,0]=4 2992 B12R1.50 CCC(C)Nc1cc(cnn1)Br 11c111a74a7492637f9c08d22aa7fa33 [0,2,0,0,0,0|2,0,0]=4 2993 B12R1.50 CCC(C)Nc1cc(cnn1)C 84a98b9128dbd21104cc8b68c63ffc88 [0,2,0,0,0,0|2,0,0]=4 2994 B12R1.50 CCC(C)Nc1cc(cnn1)Cl 375688fd98e83dcbb2558b2d89af69e5 [0,2,0,0,0,0|2,0,0]=4 2995 B12R1.50 CCC(C)Nc1cccc(c1)Br 1d66578ce06ff9734ac9091e085e6a07 [0,2,0,0,0,0|2,0,0]=4 2996 B12R1.50 CCC(C)Nc1cccc(c1)C d7cf6e3b62030f874de6f1eb9d16cf4f [0,2,0,0,0,0|2,0,0]=4 2997 B12R1.50 CCC(C)Nc1cccc(c1)Cl 08bdcd143bf3141bf35886f1a7a48241 [0,2,0,0,0,0|2,0,0]=4 2998 B12R1.50 CCC(C)Nc1cccc(c1)F abc1ee7f668b8358dc6ca8fd4a50a6d5 [0,2,0,0,0,0|2,0,0]=4 2999 B12R1.50 CCC(C)Nc1cccc(c1)I bc6d04f9805b80597b81c6888c542900 [0,2,0,0,0,0|2,0,0]=4 3000 B12R1.50 CCC(C)Nc1cccc(c1)S 2cd18a9ced79be6a90be5bf41232bef9 [0,2,0,0,0,0|2,0,0]=4 3001 B12R1.50 CCC(C)Nc1cn[nH]c(=O)c1 366284b8766d011ec7697472592af913 [0,2,0,0,0,0|2,0,0]=4 3002 B12R1.50 CCC(C)Nc1cncc(c1)Br 11ee3a83ff17a0c950f87cd89392d758 [0,2,0,0,0,0|1,0,0]=3 3003 B12R1.50 CCC(C)Nc1cncc(c1)C 6a45679c027d7e3c7aa59f2b33b76ccf [0,2,0,0,0,0|1,0,0]=3 3004 B12R1.50 CCC(C)Nc1cncc(c1)Cl b7b671f873787bb176c2918252d6cb15 [0,2,0,0,0,0|1,0,0]=3 3005 B12R1.50 CCC(C)Nc1cncc(c1)F 1a6f9d9f00290d056a9867015deda6c3 [0,2,0,0,0,0|1,0,0]=3 3006 B12R1.50 CCC(C)Nc1cncc(c1)I aea7fe4404ff9ed6b9767ef9464031cf [0,2,0,0,0,0|1,0,0]=3 3007 B12R1.50 CCC(C)Nc1cncc(n1)Br f7ff480eb1324c083c90b1ef9d2b94f8 [0,2,0,0,0,0|2,0,0]=4 3008 B12R1.50 CCC(C)Nc1cncc(n1)C 78a6edb9f41342c20beb9ff0531cecda [0,2,0,0,0,0|2,0,0]=4 3009 B12R1.50 CCC(C)Nc1cncc(n1)F 9c34b959d4a8f49e110b7c0ab52cc1e8 [0,2,0,0,0,0|2,0,0]=4 3010 B12R1.50 CCC(C)Nc1cnnc(c1)Cl 3d28cc6f806f9835a26654d7990be1e8 [0,2,0,0,0,0|2,0,0]=4 3011 B12R1.50 CCC(C)Nc1cnnc(c1)F cc2865be41457d3e863dd9cb2a9bbfe7 [0,2,0,0,0,0|2,0,0]=4 3012 B12R1.50 CCC(C)Oc1ccc[n+](c1)[O-] a8e4f7d8b49eb67b533cc522852da09f [0,2,0,0,0,0|1,0,1]=4 3013 B12R1.50 CCC(C)Oc1cccc(c1)Br 11f5b596601cd571c59ff2afebc8ce7a [0,2,0,0,0,0|2,0,0]=4 3014 B12R1.50 CCC(C)Oc1cccc(c1)C 9cbbc47209d16c8e877df0d39e5bcab2 [0,2,0,0,0,0|2,0,0]=4 3015 B12R1.50 CCC(C)Oc1cccc(c1)Cl 3dfa34a86dfbb1225b2fc77d38aaa045 [0,2,0,0,0,0|2,0,0]=4 3016 B12R1.50 CCC(C)Oc1cccc(c1)F 11c1cebedbe6e61c8d433bebe0c72b96 [0,2,0,0,0,0|2,0,0]=4 3017 B12R1.50 CCC(C)Oc1cccc(c1)I 7ed5e0b105802053e06ca681572fa199 [0,2,0,0,0,0|2,0,0]=4 3018 B12R1.50 CCC(C)Oc1cccc(c1)S 4218a788a21d0fc160d2648a272c1309 [0,2,0,0,0,0|2,0,0]=4 3019 B12R1.50 CCC(C)Oc1cncc(c1)C 0aad02547d755d9761e20ef29077a45d [0,2,0,0,0,0|1,0,0]=3 3020 B12R1.50 CCC(C)Oc1cncc(c1)Cl 0fd4f84080d21e745abce5d5e3c89a32 [0,2,0,0,0,0|1,0,0]=3 3021 B12R1.50 CCC(C)Oc1cncc(c1)F 7d9b909a57c676f99056261286b82d07 [0,2,0,0,0,0|1,0,0]=3 3022 B12R1.50 CCC(C)Oc1cncc(c1)I 05c43e2aff453430b5123e3d78482718 [0,2,0,0,0,0|1,0,0]=3 3023 B12R1.50 CCC(C)Oc1cncc(n1)Br 9f1cd0d3da6e0d1855de66410cf2e088 [0,2,0,0,0,0|2,0,0]=4 3024 B12R1.50 CCC(C)Oc1cncc(n1)Cl 6ecbd2a87346d537c90c32fab2e0037e [0,2,0,0,0,0|2,0,0]=4 3025 B12R1.50 CCC(C)Oc1cnnc(c1)Cl e3efde6a3fe803b2133db325bbf684e6 [0,2,0,0,0,0|2,0,0]=4 3026 B12R1.50 CCN(C)Cc1cccc(c1)Br 0cfb611857c5cb7cc30f39c3873140b0 [0,2,0,0,0,0|2,0,0]=4 3027 B12R1.50 CCN(C)Cc1cccc(c1)C 53ad3a118e4ee122b8b7018696871a03 [0,2,0,0,0,0|2,0,0]=4 3028 B12R1.50 CCN(C)Cc1cccc(c1)Cl e6a716bb03372171d841e30f8f33fb19 [0,2,0,0,0,0|2,0,0]=4 3029 B12R1.50 CCN(C)Cc1cccc(c1)F f82e676ee923805ac44e861b9bf86187 [0,2,0,0,0,0|2,0,0]=4 3030 B12R1.50 CCN(C)Cc1cccc(c1)I e43924ee04038b2970f0d94ad73ebdd0 [0,2,0,0,0,0|2,0,0]=4 3031 B12R1.50 CCN(C)Cc1cncc(c1)Br 3e44c41a970f5384a9488ecb63cd7e91 [0,2,0,0,0,0|1,0,0]=3 3032 B12R1.50 CCN(C)Cc1cncc(c1)F 84e684e126e4fb30e46aa4bbad40ec80 [0,2,0,0,0,0|1,0,0]=3 3033 B12R1.50 CC[C@@H](C)Nc1cccc(c1)C 45d939f81c7b7d38cc39ca453cc6d8b9 [0,2,0,0,0,0|2,0,0]=4 3034 B12R1.50 CC[C@H](C)Nc1cccc(c1)C 5181036d0ad680b57bb138220216ae0c [0,2,0,0,0,0|2,0,0]=4 3035 B12R1.50 CN(C=O)Cc1cncc(c1)Br f607e882739db242cea07c1b2a923b5a [0,2,0,0,0,0|1,0,1]=4 3036 B12R1.50 CN(C=O)Cc1cncc(c1)F 460844f8e2931bfd3d775f9189406365 [0,2,0,0,0,0|1,0,1]=4 3037 B12R1.50 CN(CF)Cc1cccc(c1)Br 6775fcdab4ed66eef72cf962bfbcd2bd [0,2,0,0,0,0|2,0,0]=4 3038 B12R1.50 CN(CF)Cc1cccc(c1)Cl 47b8e773794dda913d7489d774847e23 [0,2,0,0,0,0|2,0,0]=4 3039 B12R1.50 CN(CF)Cc1cccc(c1)F fddef7f62e811634383c4be44d3ad4c2 [0,2,0,0,0,0|2,0,0]=4 3040 B12R1.50 CN(CF)Cc1cccc(c1)I ba46f25f84a9adbaee66606d056f8d9f [0,2,0,0,0,0|2,0,0]=4 3041 B12R1.50 CN(CF)Cc1cncc(c1)F af3ff53ca851719a16d4b4053428a5ff [0,2,0,0,0,0|1,0,0]=3 3042 B12R1.50 CN(CO)Cc1cccc(c1)Br 598209607c72aa6d8108b132f4b46d7e [0,2,0,0,0,0|2,0,0]=4 3043 B12R1.50 CN(CO)Cc1cccc(c1)Cl 2945da4e469cee97956e9210dfcdfe64 [0,2,0,0,0,0|2,0,0]=4 3044 B12R1.50 CN(CO)Cc1cccc(c1)F 6a7f560609911b9b7b05731cdc2a168a [0,2,0,0,0,0|2,0,0]=4 3045 B12R1.50 CN(CO)Cc1cccc(c1)I f120238df6abba66af1a68aaee18110e [0,2,0,0,0,0|2,0,0]=4 3046 B12R1.50 CN(CO)Cc1cncc(c1)Br a467f8629329981ef63f4f9197d99585 [0,2,0,0,0,0|1,0,0]=3 3047 B12R1.50 CN(CO)Cc1cncc(c1)F 7dfc2157dd910fa7b10494199d8c11bc [0,2,0,0,0,0|1,0,0]=3 3048 B12R1.50 C[C@@H](CO)Nc1cc(cnn1)Br 9b19974d1f86547bc391777711f2bf61 [0,2,0,0,0,0|2,0,0]=4 3049 B12R1.50 C[C@@H](CO)Nc1cc(cnn1)Cl e7bd8fe085cb8dfe1576fe000e91a355 [0,2,0,0,0,0|2,0,0]=4 3050 B12R1.50 C[C@@H](CO)Nc1cccc(c1)Br e12c135b7138e7c817f229b4b8639d64 [0,2,0,0,0,0|2,0,0]=4 3051 B12R1.50 C[C@@H](CO)Nc1cccc(c1)Cl b6aa20cbf8f24853667a022c40a8057e [0,2,0,0,0,0|2,0,0]=4 3052 B12R1.50 C[C@@H](CO)Nc1cccc(c1)F c93de07c16abf3a73ffced01d0a7bfc9 [0,2,0,0,0,0|2,0,0]=4 3053 B12R1.50 C[C@@H](CO)Nc1cccc(c1)I 63762b133b4c8dcbd72ab2f4bdb23f98 [0,2,0,0,0,0|2,0,0]=4 3054 B12R1.50 C[C@@H](CO)Nc1cn[nH]c(=O)c1 fa42d1b9ba8a73b40545ec7df8adb8ea [0,2,0,0,0,0|2,0,0]=4 3055 B12R1.50 C[C@@H](CO)Nc1cncc(c1)Br 2c0a4f9edab83f035549f092863a7a06 [0,2,0,0,0,0|1,0,0]=3 3056 B12R1.50 C[C@@H](CO)Nc1cncc(c1)Cl bba7a81e53611335195b3c14cb4a3c79 [0,2,0,0,0,0|1,0,0]=3 3057 B12R1.50 C[C@@H](CO)Nc1cncc(c1)F b1958567279506ec38d63307d2a97d8a [0,2,0,0,0,0|1,0,0]=3 3058 B12R1.50 C[C@@H](CO)Nc1cncc(c1)I 9f3f266bfef0f259410d5b43cf657169 [0,2,0,0,0,0|1,0,0]=3 3059 B12R1.50 C[C@@H](CO)Nc1cncc(n1)F 51e18f40d342707d7d54e8f643f5c266 [0,2,0,0,0,0|2,0,0]=4 3060 B12R1.50 C[C@@H](CO)Nc1cnnc(c1)Cl 8056f0ee4af0f4d4a57d415397e09b5f [0,2,0,0,0,0|2,0,0]=4 3061 B12R1.50 C[C@@H](CO)Nc1cnnc(c1)F cc602d5126d27ff3d785936f9afd4b16 [0,2,0,0,0,0|2,0,0]=4 3062 B12R1.50 C[C@H](C=O)Nc1cncc(c1)Br 9362c6bebb44d5a7d43b9e2de513c6b3 [0,2,0,0,0,0|1,0,1]=4 3063 B12R1.50 C[C@H](C=O)Nc1cncc(c1)Cl f8f82560d15c8b83bb608b1b626896ba [0,2,0,0,0,0|1,0,1]=4 3064 B12R1.50 C[C@H](C=O)Nc1cncc(c1)F 0e1388f9ff997b43be4caf0d04ce020a [0,2,0,0,0,0|1,0,1]=4 3065 B12R1.50 C[C@H](C=O)Nc1cncc(c1)I 0faa607de2635ff12533a104cf23af1c [0,2,0,0,0,0|1,0,1]=4 3066 B12R1.50 C[C@H](C=O)Oc1cncc(c1)Br c0cf3a7663529a18ba660e59294dccad [0,2,0,0,0,0|1,0,1]=4 3067 B12R1.50 C[C@H](C=O)Oc1cncc(c1)Cl 89910438d683591e3f796dfe24e749a7 [0,2,0,0,0,0|1,0,1]=4 3068 B12R1.50 C[C@H](C=O)Oc1cncc(c1)F 049d8378ae392791c653ba9b5c037cfb [0,2,0,0,0,0|1,0,1]=4 3069 B12R1.50 C[C@H](C=O)Oc1cncc(c1)I 5c8d98e528c9632bdb24943aa1f8cbb8 [0,2,0,0,0,0|1,0,1]=4 3070 B12R1.50 C[C@H](CO)Nc1cc(cnn1)Br a57db20979a8bb81f06fb8a6b3a4828a [0,2,0,0,0,0|2,0,0]=4 3071 B12R1.50 C[C@H](CO)Nc1cc(cnn1)Cl af96b56f51f820119c0bb5d83bac6a4a [0,2,0,0,0,0|2,0,0]=4 3072 B12R1.50 C[C@H](CO)Nc1cccc(c1)Br caa603dbf3d611872408e6a5a99c2208 [0,2,0,0,0,0|2,0,0]=4 3073 B12R1.50 C[C@H](CO)Nc1cccc(c1)Cl d80340fe9b92189a6899bc5d360147f0 [0,2,0,0,0,0|2,0,0]=4 3074 B12R1.50 C[C@H](CO)Nc1cccc(c1)F 8c3d08c899d303dc21916719c2ded833 [0,2,0,0,0,0|2,0,0]=4 3075 B12R1.50 C[C@H](CO)Nc1cccc(c1)I e332daa1e085ab96b6afa02650eceef0 [0,2,0,0,0,0|2,0,0]=4 3076 B12R1.50 C[C@H](CO)Nc1cn[nH]c(=O)c1 afae1f81999032bc0c3429f803c5af5d [0,2,0,0,0,0|2,0,0]=4 3077 B12R1.50 C[C@H](CO)Nc1cncc(c1)Br ade9b85c451a03158ed181312036d6fc [0,2,0,0,0,0|1,0,0]=3 3078 B12R1.50 C[C@H](CO)Nc1cncc(c1)Cl f0064f0121e93ff558e0e513bf24b5c0 [0,2,0,0,0,0|1,0,0]=3 3079 B12R1.50 C[C@H](CO)Nc1cncc(c1)F 25251bdf059cd98bede35bc957def282 [0,2,0,0,0,0|1,0,0]=3 3080 B12R1.50 C[C@H](CO)Nc1cncc(c1)I 93b02cec2b28c25913d991da4ccee97e [0,2,0,0,0,0|1,0,0]=3 3081 B12R1.50 C[C@H](CO)Nc1cncc(n1)F 71e34ea1665dc811c735da5caeb596fd [0,2,0,0,0,0|2,0,0]=4 3082 B12R1.50 C[C@H](CO)Nc1cnnc(c1)Cl 4fc0448f4eb24f1b88d4e2be07660a62 [0,2,0,0,0,0|2,0,0]=4 3083 B12R1.50 C[C@H](CO)Nc1cnnc(c1)F 3281913c96fba8db36e2f3e971e06cef [0,2,0,0,0,0|2,0,0]=4 3084 B12R1.50 Cc1cccc(c1)CN(C)CF 609d411a38c58a3e2228564e503d49d3 [0,2,0,0,0,0|2,0,0]=4 3085 B12R1.50 Cc1cccc(c1)CN(C)CO 9ce835e7a7f8a76d68ac785fdcc22b43 [0,2,0,0,0,0|2,0,0]=4 3086 B12R1.50 Cc1cccc(c1)NC(C)CO c23f82ac252bf3ee5441826bde19dba5 [0,2,0,0,0,0|2,0,0]=4 3087 B12R1.50 Cc1cccc(c1)N[C@@H](C)CO b575cd99ac56e48b2608cbaccd98fff4 [0,2,0,0,0,0|2,0,0]=4 3088 B12R1.50 Cc1cccc(c1)N[C@H](C)CO 8c38b6b94b7f7840ff18f43638e4f1b0 [0,2,0,0,0,0|2,0,0]=4 3089 B12R1.50 Cc1cncc(c1)NC(C)C=O 7c7a3ec92d25ae1aa78e568b8ee2d023 [0,2,0,0,0,0|1,0,1]=4 3090 B12R1.50 Cc1cncc(c1)NC(C)CO ef6faecefc32627c2a505f235efd3f9d [0,2,0,0,0,0|1,0,0]=3 3091 B12R1.50 Cc1cncc(c1)N[C@@H](C)CO d4eba8ee68b5a8f0739a160b2c450602 [0,2,0,0,0,0|1,0,0]=3 3092 B12R1.50 Cc1cncc(c1)N[C@H](C)C=O 6928e99dfc5a5216c2ea2c41964755ce [0,2,0,0,0,0|1,0,1]=4 3093 B12R1.50 Cc1cncc(c1)N[C@H](C)CO 7b0f504278d2e19e98afab563e91dd77 [0,2,0,0,0,0|1,0,0]=3 3094 B12R1.50 Cc1cncc(c1)OC(C)C=O 0228620b5b506e17433ff41f00ed0ddb [0,2,0,0,0,0|1,0,1]=4 3095 B12R1.50 Cc1cncc(c1)O[C@H](C)C=O 96d123c7b587bc9d4a326f4100c7d8ab [0,2,0,0,0,0|1,0,1]=4 3096 B12R1.50 Cc1cncc(n1)NC(C)CO 5baff5a797c9456588032d08240f384b [0,2,0,0,0,0|2,0,0]=4 3097 B12R1.50 Cc1cncc(n1)N[C@@H](C)CO b66a09738483f7d2f1e9245eaa7b7563 [0,2,0,0,0,0|2,0,0]=4 3098 B12R1.50 Cc1cncc(n1)N[C@H](C)CO 6f0389ddbd90baa601aec1d0d2d2a0bc [0,2,0,0,0,0|2,0,0]=4 3099 B12R1.50 Cc1cnnc(c1)NC(C)CO d7ecc1d3d87af0bc9ce64a823a30311d [0,2,0,0,0,0|2,0,0]=4 3100 B12R1.50 Cc1cnnc(c1)N[C@@H](C)CO 83a06a6144d82f0e88b55e602d4cd87a [0,2,0,0,0,0|2,0,0]=4 3101 B12R1.50 Cc1cnnc(c1)N[C@H](C)CO 5bfcf88168f29417aa7cb622ea13fcc7 [0,2,0,0,0,0|2,0,0]=4 3102 B12R1.118 C=C[C@@H](CO)Nc1cccnc1 e51b5e6d78d7e3ae98dec5257b614433 [0,2,0,0,0,0|1,0,1]=4 3103 B12R1.118 CCC(C=O)Nc1cccnc1 f2a28a3fdb0a09f8d451d38ec59b2c1d [0,2,0,0,0,0|1,0,1]=4 3104 B12R1.118 CCC(C=O)Oc1cccnc1 c02ea9913f6b45411de0698448d19ec4 [0,2,0,0,0,0|1,0,1]=4 3105 B12R1.118 CCC(CC)Nc1ccccc1 62a5bbda4663c06f44e205dbfccb7cfa [0,2,0,0,0,0|2,0,0]=4 3106 B12R1.118 CCC(CC)Nc1cccnc1 9d074fe2d03393afaa8a1f416d06c27c [0,2,0,0,0,0|1,0,0]=3 3107 B12R1.118 CCC(CC)Nc1cccnn1 c05a7b33409569d5823119a26a6e1ae5 [0,2,0,0,0,0|2,0,0]=4 3108 B12R1.118 CCC(CC)Nc1ccnnc1 21ac1c8fdc16b21395d597b149435178 [0,2,0,0,0,0|2,0,0]=4 3109 B12R1.118 CCC(CC)Nc1cnccn1 b5b9f23c79921a8a4bc5cd3687fa5cac [0,2,0,0,0,0|2,0,0]=4 3110 B12R1.118 CCC(CC)Nc1cncnc1 e715a02f907c0cfb84570cef0d36ff51 [0,2,0,0,0,0|2,0,0]=4 3111 B12R1.118 CCC(CC)Oc1cccnc1 8b905fcc9a0926c38970cda9cd15fb7e [0,2,0,0,0,0|1,0,0]=3 3112 B12R1.118 CCC(CC)Oc1ccnnc1 68dc1dcba0e3abe6b29eddbebafd2a4d [0,2,0,0,0,0|2,0,0]=4 3113 B12R1.118 CCC(CC)Oc1cnccn1 8731edf5eac93888bbdbfe27777036cc [0,2,0,0,0,0|2,0,0]=4 3114 B12R1.118 CCC(CO)Nc1ccccc1 4bbd0090e2c789b85e6c79fc920a972e [0,2,0,0,0,0|2,0,0]=4 3115 B12R1.118 CCC(CO)Nc1cccnc1 ab690edd9c53b8ad72b7a2f868d4b9cb [0,2,0,0,0,0|1,0,0]=3 3116 B12R1.118 CCC(CO)Nc1cccnn1 aa4f1b4b3490a41b5e78e6882708cb10 [0,2,0,0,0,0|2,0,0]=4 3117 B12R1.118 CCC(CO)Nc1ccnnc1 11a93da1e0d364cbf598fd284f8f6b80 [0,2,0,0,0,0|2,0,0]=4 3118 B12R1.118 CCC(CO)Nc1cnccn1 4afe7a15c995405daaa15ad7386ebd34 [0,2,0,0,0,0|2,0,0]=4 3119 B12R1.118 CCC(CO)Nc1cncnc1 65e33ee9da31f07310572366f01e5dfd [0,2,0,0,0,0|2,0,0]=4 3120 B12R1.118 CCN(C#N)Cc1cccnc1 8e2b3dee277f25bc9cd2ff7cdf0090e8 [0,2,0,0,0,0|1,0,1]=4 3121 B12R1.118 CCN(C=O)Cc1cccnc1 30cfe04dc8c3ff4b94dfef66857a2c80 [0,2,0,0,0,0|1,0,1]=4 3122 B12R1.118 CCN(CC)Cc1cccnc1 90a23f01616d7157e3135322314e5d8d [0,2,0,0,0,0|1,0,0]=3 3123 B12R1.118 CCN(CF)Cc1cccnc1 c17dfc7987f45713b72a3f5b278e2e3b [0,2,0,0,0,0|1,0,0]=3 3124 B12R1.118 CCN(CO)Cc1cccnc1 7dd669529cc1c96070ab5b5cfa08c387 [0,2,0,0,0,0|1,0,0]=3 3125 B12R1.118 CC[C@@H](CO)Nc1ccccc1 4e6d1044dff6b69bba19855888009bcf [0,2,0,0,0,0|2,0,0]=4 3126 B12R1.118 CC[C@@H](CO)Nc1cccnc1 f05c3f8431351c797a7cca5153cca11c [0,2,0,0,0,0|1,0,0]=3 3127 B12R1.118 CC[C@H](CO)Nc1ccccc1 6e84965dfbcccf2d9d399d53a4428cff [0,2,0,0,0,0|2,0,0]=4 3128 B12R1.118 CC[C@H](CO)Nc1cccnc1 7165d8fd3e622da53cd91836a6210b4c [0,2,0,0,0,0|1,0,0]=3 3129 B12R1.118 N#CN(CF)Cc1cccnc1 ad797875cdcbfe1f34407988d3151c8c [0,2,0,0,0,0|1,0,1]=4 3130 B12R1.118 N#CN(CO)Cc1cccnc1 31df0ec9bf69e66c3d1c16c3f87ebfec [0,2,0,0,0,0|1,0,1]=4 3131 B12R1.118 OCC(CO)Nc1ccccc1 c6d188a322ff4dea1d0ad1799b765f49 [0,2,0,0,0,0|2,0,0]=4 3132 B12R1.118 OCC(CO)Nc1cccnc1 1c3e06491a2ecd20c68a2060ccf00f2b [0,2,0,0,0,0|1,0,0]=3 3133 B12R1.118 OCC(CO)Nc1cccnn1 82ceda4ea3e3209106acab41ad51169c [0,2,0,0,0,0|2,0,0]=4 3134 B12R1.118 OCC(CO)Nc1ccnnc1 ecac4b32fde997effd978b9613f918ac [0,2,0,0,0,0|2,0,0]=4 3135 B12R1.118 OCC(CO)Nc1cnccn1 a2bd9f09fd055c25373ab5d4335a2b4a [0,2,0,0,0,0|2,0,0]=4 3136 B12R1.118 OCC(CO)Nc1cncnc1 23dae95b60d8ba0ab64411c213453e07 [0,2,0,0,0,0|2,0,0]=4 3137 B12R1.118 OCC(CO)Oc1cccnc1 56f2e8a9cfa225dc92bf293f1fc04855 [0,2,0,0,0,0|1,0,0]=3 3138 B12R1.118 OCC(CO)Oc1ccnnc1 3586e97045d0555d0a8a62cb93f049ce [0,2,0,0,0,0|2,0,0]=4 3139 B12R1.118 OCC(CO)Oc1cnccn1 fa620649ca809d7a35d2b193e63c3c8a [0,2,0,0,0,0|2,0,0]=4 3140 B12R1.118 OCC(CO)Oc1cncnc1 53a5adaaee37fcd8136804b4c8b97eef [0,2,0,0,0,0|2,0,0]=4 3141 B12R1.194 CC(C)(C#N)Nc1cccnc1 607ef22629af5fd0d831ce81e0865ac4 [0,2,0,0,0,0|1,0,0]=3 3142 B12R1.194 CC(C)(CF)Nc1ccccc1 b6beb5eadcdeb337f0158c8ad0d8b555 [0,2,0,0,0,0|2,0,0]=4 3143 B12R1.194 CC(C)(CF)Nc1cccnc1 529569956c5ca9f3b54a7b3c9691fdbc [0,2,0,0,0,0|1,0,0]=3 3144 B12R1.194 CC(C)(CO)Nc1ccccc1 30670d11326256bdda695fca46d82a64 [0,2,0,0,0,0|2,0,0]=4 3145 B12R1.194 CC(C)(CO)Nc1cccnc1 1f0639d7c8fc136873e0aeb22496de83 [0,2,0,0,0,0|1,0,0]=3 3146 B12R1.194 CCC(C)(C)Nc1ccccc1 17a09be9f9cdec5da28d382a8493f798 [0,2,0,0,0,0|2,0,0]=4 3147 B12R1.194 CCC(C)(C)Nc1cccnc1 8aca00507b17dbddb1ede8afa8bba163 [0,2,0,0,0,0|1,0,0]=3 3148 B12R1.371 C#CC(C)Nc1cnccc1I 8e96a3e4c456b87c6add77fa49a5245a [0,2,0,0,0,0|1,0,1]=4 3149 B12R1.371 C#CC(C)Oc1cccnc1Br 9ac4f6fa19ef7233c614c6f6787c151a [0,2,0,0,0,0|1,0,1]=4 3150 B12R1.371 C#CC(C)Oc1cccnc1Cl 66b88720d68ada869d00660ebf274404 [0,2,0,0,0,0|1,0,1]=4 3151 B12R1.371 C#CC(C)Oc1cccnc1F f1ff3da73faa8bbb5d4dfa17e9de8960 [0,2,0,0,0,0|1,0,1]=4 3152 B12R1.371 C#CC(C)Oc1cccnc1I f1d32d6fb32b576cf761eceadf8ef57f [0,2,0,0,0,0|1,0,1]=4 3153 B12R1.371 C=CC(C)Nc1cccnc1Br 55c6fe60b2b37a14dc6173089ebb5456 [0,2,0,0,0,0|1,0,1]=4 3154 B12R1.371 C=CC(C)Nc1cccnc1C 88c5613c9c10ad992a8d9896ed8a0fd6 [0,2,0,0,0,0|1,0,1]=4 3155 B12R1.371 C=CC(C)Nc1cccnc1Cl 207613db2f6582d968ee27191995c476 [0,2,0,0,0,0|1,0,1]=4 3156 B12R1.371 C=CC(C)Nc1cccnc1F 6d02db16ab6da09f9c9d9993735b332b [0,2,0,0,0,0|1,0,1]=4 3157 B12R1.371 C=CC(C)Nc1cccnc1I fd6e1a90a003bb50f880b205ffff3f82 [0,2,0,0,0,0|1,0,1]=4 3158 B12R1.371 C=CC(C)Nc1cnccc1Br e50d8f59b58429e0906fec40c049d881 [0,2,0,0,0,0|1,0,1]=4 3159 B12R1.371 C=CC(C)Nc1cnccc1C 1f2c336ba267d139f0f6cf603a1998bb [0,2,0,0,0,0|1,0,1]=4 3160 B12R1.371 C=CC(C)Nc1cnccc1Cl 6c67d357d90111f98195e8d7eb1a86ea [0,2,0,0,0,0|1,0,1]=4 3161 B12R1.371 C=CC(C)Nc1cnccc1F da3fea7cfd0d806aa8a35d4330e607c6 [0,2,0,0,0,0|1,0,1]=4 3162 B12R1.371 C=CC(C)Nc1cnccc1I 9a09543d5d750a334c12f322f07c3085 [0,2,0,0,0,0|1,0,1]=4 3163 B12R1.371 C=CC(C)Nc1cnccc1S 46f6a21c8c11892a3774779162a5f308 [0,2,0,0,0,0|1,0,1]=4 3164 B12R1.371 C=CC(C)Oc1cccnc1Br e74451be0b4bcd4098b04689cd5f53bb [0,2,0,0,0,0|1,0,1]=4 3165 B12R1.371 C=CC(C)Oc1cccnc1C c6536f9c5b2f3bb158196419c31135b5 [0,2,0,0,0,0|1,0,1]=4 3166 B12R1.371 C=CC(C)Oc1cccnc1Cl b99289c70c3079e8582bf10e5b009314 [0,2,0,0,0,0|1,0,1]=4 3167 B12R1.371 C=CC(C)Oc1cccnc1F 64879e53c9590fb1fb7dafe7f7fbe777 [0,2,0,0,0,0|1,0,1]=4 3168 B12R1.371 C=CC(C)Oc1cccnc1I a86ab4ee6f05d8c555c25cdca716f8a8 [0,2,0,0,0,0|1,0,1]=4 3169 B12R1.371 C=CC(C)Oc1cnccc1Br 01746b89957d70c064883bab796cd5db [0,2,0,0,0,0|1,0,1]=4 3170 B12R1.371 C=CC(C)Oc1cnccc1C 07cea7d3d8f6b01f0ff6128c6d81d3c7 [0,2,0,0,0,0|1,0,1]=4 3171 B12R1.371 C=CC(C)Oc1cnccc1Cl 684a20dab13c231dc0b9bb30f1ace4a3 [0,2,0,0,0,0|1,0,1]=4 3172 B12R1.371 C=CC(C)Oc1cnccc1F 0437667f27f32e267d2d8a153f584b1d [0,2,0,0,0,0|1,0,1]=4 3173 B12R1.371 C=CC(C)Oc1cnccc1I 1eadffac270003f459faa01c810a64ab [0,2,0,0,0,0|1,0,1]=4 3174 B12R1.371 CC(C#N)Oc1cccnc1Cl 632aa5d9b1d1e121365444ecfcdf332d [0,2,0,0,0,0|1,0,1]=4 3175 B12R1.371 CC(C#N)Oc1cccnc1I 5d7686bd7a09a36053c44dfcde517e2a [0,2,0,0,0,0|1,0,1]=4 3176 B12R1.371 CC(C#N)Oc1cnccc1I 08c953fd0ec62cd7fca3f609e59f274b [0,2,0,0,0,0|1,0,1]=4 3177 B12R1.371 CC(C=O)Nc1cccnc1Br 0a26c90bd360ace115d547fe5cf5b19b [0,2,0,0,0,0|1,0,1]=4 3178 B12R1.371 CC(C=O)Nc1cccnc1Cl baa2c711a546b7c180a97ed01a22be5e [0,2,0,0,0,0|1,0,1]=4 3179 B12R1.371 CC(C=O)Nc1cccnc1F 15c63a552a1c45fd58ecacc9fcfa7f78 [0,2,0,0,0,0|1,0,1]=4 3180 B12R1.371 CC(C=O)Nc1cccnc1I d2a72a404b229130c6ff453742c04c0c [0,2,0,0,0,0|1,0,1]=4 3181 B12R1.371 CC(C=O)Nc1cnccc1Br 370a52581eed504f725a88e28145f60f [0,2,0,0,0,0|1,0,1]=4 3182 B12R1.371 CC(C=O)Nc1cnccc1Cl 8e317695d6dd043762c5bda5ec6b66f8 [0,2,0,0,0,0|1,0,1]=4 3183 B12R1.371 CC(C=O)Nc1cnccc1F edf7c0ef125035a3dffdf9586ce7c7f4 [0,2,0,0,0,0|1,0,1]=4 3184 B12R1.371 CC(C=O)Nc1cnccc1I a13e8d0e793b5a7bcd941145d1140767 [0,2,0,0,0,0|1,0,1]=4 3185 B12R1.371 CC(C=O)Nc1cnccc1S 8b9889fbc4230fc744bc055e39c32f42 [0,2,0,0,0,0|1,0,1]=4 3186 B12R1.371 CC(C=O)Oc1cccnc1Br 25a063108c0c5c7fc21648b82de93fb0 [0,2,0,0,0,0|1,0,1]=4 3187 B12R1.371 CC(C=O)Oc1cccnc1Cl da37bcd72710e387ef276b9f27e0d95f [0,2,0,0,0,0|1,0,1]=4 3188 B12R1.371 CC(C=O)Oc1cccnc1F bf18edebccfd5386c2c8bdb0df18fd43 [0,2,0,0,0,0|1,0,1]=4 3189 B12R1.371 CC(C=O)Oc1cccnc1I 41ec164d7812f2a8d2460f68f4dc2a21 [0,2,0,0,0,0|1,0,1]=4 3190 B12R1.371 CC(C=O)Oc1cnccc1Br 239fa55caa9d451b338339f9517c74b7 [0,2,0,0,0,0|1,0,1]=4 3191 B12R1.371 CC(C=O)Oc1cnccc1Cl dc18527fcbff582fdb85a92c2127b384 [0,2,0,0,0,0|1,0,1]=4 3192 B12R1.371 CC(C=O)Oc1cnccc1F 7b6db49ef3026963e0bd44844f108661 [0,2,0,0,0,0|1,0,1]=4 3193 B12R1.371 CC(C=O)Oc1cnccc1I e8d03b3758d5bff7a5b87abc4f919208 [0,2,0,0,0,0|1,0,1]=4 3194 B12R1.371 CC(CO)Nc1c[nH]ccc1=O 321f196e2e776ccc2900ff309758121d [0,2,0,0,0,0|1,0,1]=4 3195 B12R1.371 CC(CO)Nc1c[nH]ccc1=S 41f5c5199c2ede36ed20c07e37caf245 [0,2,0,0,0,0|1,0,1]=4 3196 B12R1.371 CC(CO)Nc1c[nH]cnc1=O e329c827d30fb8ef740b25c0759f2616 [0,2,0,0,0,0|2,0,0]=4 3197 B12R1.371 CC(CO)Nc1ccccc1F ab9abc3c7ad63ce6e7fb98c9c85f3edf [0,2,0,0,0,0|2,0,0]=4 3198 B12R1.371 CC(CO)Nc1ccccc1I 8db44cdfb97be4fe1b6791bb92fd08be [0,2,0,0,0,0|2,0,0]=4 3199 B12R1.371 CC(CO)Nc1cccnc1Br 4206efbd810086848465bb19821fa646 [0,2,0,0,0,0|1,0,0]=3 3200 B12R1.371 CC(CO)Nc1cccnc1Cl a47c452cda368ccadee093edfe71eaa0 [0,2,0,0,0,0|1,0,0]=3 3201 B12R1.371 CC(CO)Nc1cccnc1F 582cc3d4867769ec24ce0209b0b0d73f [0,2,0,0,0,0|1,0,0]=3 3202 B12R1.371 CC(CO)Nc1cccnc1I 44cdbbb32665f3e0eb76bddb8b1ce46a [0,2,0,0,0,0|1,0,0]=3 3203 B12R1.371 CC(CO)Nc1ccnnc1Br a7812a7a3b592f2d3d41c0545f5acc70 [0,2,0,0,0,0|2,0,0]=4 3204 B12R1.371 CC(CO)Nc1ccnnc1Cl 5b8bdf410231bd74f9e820658d3634da [0,2,0,0,0,0|2,0,0]=4 3205 B12R1.371 CC(CO)Nc1cnccc1Br b19333d3c7cf19402552fb8563c2563c [0,2,0,0,0,0|1,0,0]=3 3206 B12R1.371 CC(CO)Nc1cnccc1Cl 99d51db6abcd307736eea9856ba6d401 [0,2,0,0,0,0|1,0,0]=3 3207 B12R1.371 CC(CO)Nc1cnccc1F abfcfb71348f83f221521200795b2f19 [0,2,0,0,0,0|1,0,0]=3 3208 B12R1.371 CC(CO)Nc1cnccc1I b9bd0901c4993ed13ffc4291db07305c [0,2,0,0,0,0|1,0,0]=3 3209 B12R1.371 CC(CO)Nc1cncnc1I fad69260b78befd67681fa6fe67f2e67 [0,2,0,0,0,0|2,0,0]=4 3210 B12R1.371 CC(CO)Nc1cnncc1Br e4be586da959c61d91e7ea112407c352 [0,2,0,0,0,0|2,0,0]=4 3211 B12R1.371 CC(CO)Nc1cnncc1Cl 0f831c92988d8b4262c2386e4fd9687c [0,2,0,0,0,0|2,0,0]=4 3212 B12R1.371 CC(CO)Nc1nccnc1Br 41a5ca9bc2f252d9c8c0597d5368ee90 [0,2,0,0,0,0|2,0,0]=4 3213 B12R1.371 CC(CO)Nc1nccnc1Cl 4d08843b87dd8fb725a775233df819d9 [0,2,0,0,0,0|2,0,0]=4 3214 B12R1.371 CC(CO)Nc1nccnc1I 2b2a4a320db3ed8e38b2bf96c51d72b7 [0,2,0,0,0,0|2,0,0]=4 3215 B12R1.371 CCC(C)Nc1c[nH]ccc1=O c2bd7b571a74a6d57ce8d60d072a5190 [0,2,0,0,0,0|1,0,1]=4 3216 B12R1.371 CCC(C)Nc1c[nH]cnc1=O 8a6e7ad6353ed9261c445476f02dd43f [0,2,0,0,0,0|2,0,0]=4 3217 B12R1.371 CCC(C)Nc1ccc[nH]c1=S 368de1ca7dc374d001ee6648d4f77fac [0,2,0,0,0,0|1,0,1]=4 3218 B12R1.371 CCC(C)Nc1ccccc1Cl de4bf505a5bbedeb31e8a75347207b67 [0,2,0,0,0,0|2,0,0]=4 3219 B12R1.371 CCC(C)Nc1ccccc1I cd67cc2bf7f4f6d6c61e47b710e1bb55 [0,2,0,0,0,0|2,0,0]=4 3220 B12R1.371 CCC(C)Nc1ccccc1S ecd9db41f3061f567fc7308b02ebdeed [0,2,0,0,0,0|2,0,0]=4 3221 B12R1.371 CCC(C)Nc1cccnc1Br 05665b32dd64c7ae5c5d1b204615ea1a [0,2,0,0,0,0|1,0,0]=3 3222 B12R1.371 CCC(C)Nc1cccnc1C 69bdadafe895488d0a0a00a5113c4ce5 [0,2,0,0,0,0|1,0,0]=3 3223 B12R1.371 CCC(C)Nc1cccnc1Cl addbd46ce2d8bf652236f6af07791860 [0,2,0,0,0,0|1,0,0]=3 3224 B12R1.371 CCC(C)Nc1cccnc1F 86776cb828a8411f498af86bf48f5666 [0,2,0,0,0,0|1,0,0]=3 3225 B12R1.371 CCC(C)Nc1cccnc1I c824747a50c87a7afb1d272abc64c318 [0,2,0,0,0,0|1,0,0]=3 3226 B12R1.371 CCC(C)Nc1ccnnc1Br 9777a56caa5c7d06565ce2af45d931ac [0,2,0,0,0,0|2,0,0]=4 3227 B12R1.371 CCC(C)Nc1ccnnc1C 259b230697a32f7672020e1b74261922 [0,2,0,0,0,0|2,0,0]=4 3228 B12R1.371 CCC(C)Nc1ccnnc1Cl 63b862a0805f1d9780d7cf53a2a3578e [0,2,0,0,0,0|2,0,0]=4 3229 B12R1.371 CCC(C)Nc1cnccc1Br be5c526def45f85b78701f9c364d6941 [0,2,0,0,0,0|1,0,0]=3 3230 B12R1.371 CCC(C)Nc1cnccc1C d27518f8439192787b0708e4ab3d13c2 [0,2,0,0,0,0|1,0,0]=3 3231 B12R1.371 CCC(C)Nc1cnccc1Cl e90478fa0b65ce55c439c0b1c8006b30 [0,2,0,0,0,0|1,0,0]=3 3232 B12R1.371 CCC(C)Nc1cnccc1F 6ac19dd3e4360bff6b8ca24903e41a4d [0,2,0,0,0,0|1,0,0]=3 3233 B12R1.371 CCC(C)Nc1cnccc1I aff4ff6560012d41a1561eb3ff7ddc09 [0,2,0,0,0,0|1,0,0]=3 3234 B12R1.371 CCC(C)Nc1cnccc1S 875cdd65e289b4072dc22abcd6eb587d [0,2,0,0,0,0|1,0,0]=3 3235 B12R1.371 CCC(C)Nc1cncnc1I fa52b2d3bd990c0e87e9df67914d66e3 [0,2,0,0,0,0|2,0,0]=4 3236 B12R1.371 CCC(C)Nc1cnncc1Cl 6b0d6f256946806fbe19312e709fb820 [0,2,0,0,0,0|2,0,0]=4 3237 B12R1.371 CCC(C)Nc1nccnc1Br 391ace3ba46c36a5e28b36e3224162af [0,2,0,0,0,0|2,0,0]=4 3238 B12R1.371 CCC(C)Nc1nccnc1C 26d7499e1a5dfd793371d8cabb4973d3 [0,2,0,0,0,0|2,0,0]=4 3239 B12R1.371 CCC(C)Nc1nccnc1Cl 6bee06affd2b8f84eef2cb8101d441a8 [0,2,0,0,0,0|2,0,0]=4 3240 B12R1.371 CCC(C)Nc1nccnc1I fcc955fece6d39b93d820b90aac34256 [0,2,0,0,0,0|2,0,0]=4 3241 B12R1.371 CCC(C)Nc1nnccc1C 223b3d1087faa97e65d2d4bf7c1ef4e9 [0,2,0,0,0,0|2,0,0]=4 3242 B12R1.371 CCC(C)Oc1c[nH]cnc1=O 5e98b6d08492bddf88528b12927c08f8 [0,2,0,0,0,0|2,0,0]=4 3243 B12R1.371 CCC(C)Oc1ccc[nH]c1=S 1edb3b7c94c955c0f6bb6b8e37c06528 [0,2,0,0,0,0|1,0,1]=4 3244 B12R1.371 CCC(C)Oc1ccccc1C a9f8caaebcb535b77e0f35c5ea074362 [0,2,0,0,0,0|2,0,0]=4 3245 B12R1.371 CCC(C)Oc1ccccc1Cl 6f598d947434a44e209cdf34b797bf91 [0,2,0,0,0,0|2,0,0]=4 3246 B12R1.371 CCC(C)Oc1ccccc1F b533bd9cc207ae92fa5d1dd0e1595cbc [0,2,0,0,0,0|2,0,0]=4 3247 B12R1.371 CCC(C)Oc1ccccc1I 35e6ee1db321949fbb0c54358fea5b12 [0,2,0,0,0,0|2,0,0]=4 3248 B12R1.371 CCC(C)Oc1ccccc1S 430f323aec7886fe8f11d201c4780b84 [0,2,0,0,0,0|2,0,0]=4 3249 B12R1.371 CCC(C)Oc1cccnc1Br 17ade39b89ae2e472cfddf9f69d94e5d [0,2,0,0,0,0|1,0,0]=3 3250 B12R1.371 CCC(C)Oc1cccnc1C fe15051a6bd5aaedc8a649111b9ec1b4 [0,2,0,0,0,0|1,0,0]=3 3251 B12R1.371 CCC(C)Oc1cccnc1Cl e999631a6145695341485be94bff93f5 [0,2,0,0,0,0|1,0,0]=3 3252 B12R1.371 CCC(C)Oc1cccnc1F e467cf8b9fbd5f0e2071fb47ae22bab6 [0,2,0,0,0,0|1,0,0]=3 3253 B12R1.371 CCC(C)Oc1cccnc1I 74d7b0aa04aed7e7e3f4b2f7bbe48cec [0,2,0,0,0,0|1,0,0]=3 3254 B12R1.371 CCC(C)Oc1cccoc1=O 8ab19b07cd3846476105eb33401c096c [0,2,0,0,0,0|2,0,0]=4 3255 B12R1.371 CCC(C)Oc1ccnnc1Cl fcd8dc0eb6de19f86e924dee2698ecb8 [0,2,0,0,0,0|2,0,0]=4 3256 B12R1.371 CCC(C)Oc1cnccc1Br 54a4b999a8d7696e8efe64135f2ef53b [0,2,0,0,0,0|1,0,0]=3 3257 B12R1.371 CCC(C)Oc1cnccc1C 272e47027479d9121397120e6585370c [0,2,0,0,0,0|1,0,0]=3 3258 B12R1.371 CCC(C)Oc1cnccc1Cl d71a4703f9a17a848b4eb5ffe8ed1db1 [0,2,0,0,0,0|1,0,0]=3 3259 B12R1.371 CCC(C)Oc1cnccc1F f55bcc4d7fe5dc38aaf8f86596f07c4f [0,2,0,0,0,0|1,0,0]=3 3260 B12R1.371 CCC(C)Oc1cnccc1I dfb1da60b3ddb7bdb30209d05ea27899 [0,2,0,0,0,0|1,0,0]=3 3261 B12R1.371 CCC(C)Oc1cncnc1C 9fc85212839b3a88add53469495df929 [0,2,0,0,0,0|2,0,0]=4 3262 B12R1.371 CCC(C)Oc1cncnc1I 50c4f668eea5457d343aa39f1cc218f5 [0,2,0,0,0,0|2,0,0]=4 3263 B12R1.371 CCC(C)Oc1cnncc1Br 989a0c60fefc0a8f45a6aee8f90d9fd2 [0,2,0,0,0,0|2,0,0]=4 3264 B12R1.371 CCC(C)Oc1cnncc1Cl 6583b543c665b7751aae366fae0b1996 [0,2,0,0,0,0|2,0,0]=4 3265 B12R1.371 CCC(C)Oc1coccc1=O e3af58d878f2178e5a2470ad6660cfa0 [0,2,0,0,0,0|2,0,0]=4 3266 B12R1.371 CCC(C)Oc1nccnc1Br 18ac154d995d3762329e49138900b1bb [0,2,0,0,0,0|2,0,0]=4 3267 B12R1.371 CCC(C)Oc1nccnc1C b759fee9631070f452e4c12ac1c71564 [0,2,0,0,0,0|2,0,0]=4 3268 B12R1.371 CCC(C)Oc1nnccc1C 6aa3069268c166d6d9e2b43b1d27a18f [0,2,0,0,0,0|2,0,0]=4 3269 B12R1.371 CCC(C)Oc1nnccc1Cl d60219bbd75cff5b057ddcea818805e4 [0,2,0,0,0,0|2,0,0]=4 3270 B12R1.371 CCC(C)Oc1nnccc1I 95730b57c00d28d7655eb0f73b3f8a3d [0,2,0,0,0,0|2,0,0]=4 3271 B12R1.371 CCN(C)Cc1ccccc1Cl e51c361dfc91d5636e1e5a4513a1b110 [0,2,0,0,0,0|2,0,0]=4 3272 B12R1.371 CCN(C)Cc1ccccc1F 7c051a9a85266df48aaa13dcfa2254cd [0,2,0,0,0,0|2,0,0]=4 3273 B12R1.371 CCN(C)Cc1ccccc1I 83032bc0e16de05a0971afc60500c87f [0,2,0,0,0,0|2,0,0]=4 3274 B12R1.371 CCN(C)Cc1cccnc1Br d5937d6d16af0eb475817a8e6257426d [0,2,0,0,0,0|1,0,0]=3 3275 B12R1.371 CCN(C)Cc1cccnc1C 70551dee8e6ff192c5e165ca8afa772b [0,2,0,0,0,0|1,0,0]=3 3276 B12R1.371 CCN(C)Cc1cccnc1Cl 47457dc9ad955f1fb32541e3574a7044 [0,2,0,0,0,0|1,0,0]=3 3277 B12R1.371 CCN(C)Cc1cccnc1F 6ef63222aa464a5828dd477ab63ebad8 [0,2,0,0,0,0|1,0,0]=3 3278 B12R1.371 CCN(C)Cc1nccnc1C d9523029c9ee5f89dd45302a5ec1d35d [0,2,0,0,0,0|2,0,0]=4 3279 B12R1.371 CC[C@@H](C)Nc1c[nH]ccc1=O 31d6009ee69a5222219443c4bc01d780 [0,2,0,0,0,0|1,0,1]=4 3280 B12R1.371 CC[C@H](C)Nc1c[nH]ccc1=O f420a58c38eb5041c85c1af5028e4024 [0,2,0,0,0,0|1,0,1]=4 3281 B12R1.371 CN(C=O)Cc1cccnc1Cl b30e649845fa620026db59669e6e217d [0,2,0,0,0,0|1,0,1]=4 3282 B12R1.371 CN(CF)Cc1ccccc1Cl 6ed036767b7fb14071dacefe6e13d31c [0,2,0,0,0,0|2,0,0]=4 3283 B12R1.371 CN(CF)Cc1ccccc1F a8bd67ba066085685e654ad08e1c2328 [0,2,0,0,0,0|2,0,0]=4 3284 B12R1.371 CN(CF)Cc1ccccc1I 3f50ee944367b71e9fe1367ce96f9fad [0,2,0,0,0,0|2,0,0]=4 3285 B12R1.371 CN(CF)Cc1cccnc1Cl f0953fc10cc91266e3554d3e6c7c3222 [0,2,0,0,0,0|1,0,0]=3 3286 B12R1.371 CN(CO)Cc1ccccc1Br 9ac13c39fec83267043e3355bc9d3c6e [0,2,0,0,0,0|2,0,0]=4 3287 B12R1.371 CN(CO)Cc1ccccc1Cl 2fb26837977d5eacf5cb47738766ffa1 [0,2,0,0,0,0|2,0,0]=4 3288 B12R1.371 CN(CO)Cc1ccccc1F 661f3a9dbe61fe63a175ae38e8094802 [0,2,0,0,0,0|2,0,0]=4 3289 B12R1.371 CN(CO)Cc1ccccc1I fd2e6b3f5dd3915c1a3ff85b0c15f004 [0,2,0,0,0,0|2,0,0]=4 3290 B12R1.371 CN(CO)Cc1cccnc1Cl 0096f3012ba49aab17dd5fc213dda4db [0,2,0,0,0,0|1,0,0]=3 3291 B12R1.371 C[C@@H](CO)Nc1c[nH]ccc1=O 7810a1b63ffe35a9ff772efbb8e01bc9 [0,2,0,0,0,0|1,0,1]=4 3292 B12R1.371 C[C@@H](CO)Nc1c[nH]ccc1=S 8e8ca1a6258cce2612613812fae01a3b [0,2,0,0,0,0|1,0,1]=4 3293 B12R1.371 C[C@@H](CO)Nc1c[nH]cnc1=O dc884a5f3a3c29dab60048ee89ee2fbd [0,2,0,0,0,0|2,0,0]=4 3294 B12R1.371 C[C@@H](CO)Nc1ccccc1F bc7a17b0246c7bfaa6b92e68ea47eff7 [0,2,0,0,0,0|2,0,0]=4 3295 B12R1.371 C[C@@H](CO)Nc1ccccc1I 4e52463ff6b81e76a206c779e1fbf0a0 [0,2,0,0,0,0|2,0,0]=4 3296 B12R1.371 C[C@@H](CO)Nc1cccnc1Br 24aa745af7e142700d0a9ae82fef0c92 [0,2,0,0,0,0|1,0,0]=3 3297 B12R1.371 C[C@@H](CO)Nc1cccnc1Cl 3a158f99af71bde69cf4b3700326f46d [0,2,0,0,0,0|1,0,0]=3 3298 B12R1.371 C[C@@H](CO)Nc1cccnc1F bb7c41784fb9989e3c0c52c7ab03d625 [0,2,0,0,0,0|1,0,0]=3 3299 B12R1.371 C[C@@H](CO)Nc1cccnc1I 9f52320e20d31b8cbbd09c2e9f3666a8 [0,2,0,0,0,0|1,0,0]=3 3300 B12R1.371 C[C@@H](CO)Nc1ccnnc1Br 9648643a0d3fc9417bab82839aa7ab07 [0,2,0,0,0,0|2,0,0]=4 3301 B12R1.371 C[C@@H](CO)Nc1ccnnc1Cl f2fc1aa5ae38ead49e445d899a73dbd6 [0,2,0,0,0,0|2,0,0]=4 3302 B12R1.371 C[C@@H](CO)Nc1cnccc1Br 68bd4b22d7b10850e2fbb2b1f923dd6a [0,2,0,0,0,0|1,0,0]=3 3303 B12R1.371 C[C@@H](CO)Nc1cnccc1Cl c018d48e5f71dfcfca16bc355b1c532b [0,2,0,0,0,0|1,0,0]=3 3304 B12R1.371 C[C@@H](CO)Nc1cnccc1F cad0e8353ad35717ae0d259787d986b7 [0,2,0,0,0,0|1,0,0]=3 3305 B12R1.371 C[C@@H](CO)Nc1cnccc1I 29832140efef6c9c316346d339b28a43 [0,2,0,0,0,0|1,0,0]=3 3306 B12R1.371 C[C@@H](CO)Nc1cncnc1I 79d4f25558e718b9644f8594d8f89dd3 [0,2,0,0,0,0|2,0,0]=4 3307 B12R1.371 C[C@@H](CO)Nc1cnncc1Br a62ff586f703487101928fe854df8e66 [0,2,0,0,0,0|2,0,0]=4 3308 B12R1.371 C[C@@H](CO)Nc1cnncc1Cl 945d3faa5ac408e6798fe0dc2fded9a7 [0,2,0,0,0,0|2,0,0]=4 3309 B12R1.371 C[C@@H](CO)Nc1nccnc1Br 93453409d53e5fe2de3971f477b37dfe [0,2,0,0,0,0|2,0,0]=4 3310 B12R1.371 C[C@@H](CO)Nc1nccnc1Cl d1756166d2a4162d2f802803455261ed [0,2,0,0,0,0|2,0,0]=4 3311 B12R1.371 C[C@@H](CO)Nc1nccnc1I d51f4ad8e2d23f03d1e453208c6ec7b3 [0,2,0,0,0,0|2,0,0]=4 3312 B12R1.371 C[C@H](C=O)Nc1cccnc1Br 9b50e3c410266f4b71ca020d124c8e8c [0,2,0,0,0,0|1,0,1]=4 3313 B12R1.371 C[C@H](C=O)Nc1cccnc1Cl 5fca5b9c6b33ec7d356343e04b79db4d [0,2,0,0,0,0|1,0,1]=4 3314 B12R1.371 C[C@H](C=O)Nc1cccnc1F 4ffd4a4ac39d627c17d2172a3a3d4947 [0,2,0,0,0,0|1,0,1]=4 3315 B12R1.371 C[C@H](C=O)Nc1cccnc1I 369aaf913c7a29c8f20fbec953349a91 [0,2,0,0,0,0|1,0,1]=4 3316 B12R1.371 C[C@H](C=O)Nc1cnccc1Br de5d8c22fa63b25645f441340d2945f1 [0,2,0,0,0,0|1,0,1]=4 3317 B12R1.371 C[C@H](C=O)Nc1cnccc1Cl c05451624da7aca02421906ea9468acb [0,2,0,0,0,0|1,0,1]=4 3318 B12R1.371 C[C@H](C=O)Nc1cnccc1F 72a7b9a20422a017b0a94463fc7cd1d2 [0,2,0,0,0,0|1,0,1]=4 3319 B12R1.371 C[C@H](C=O)Nc1cnccc1I 5a6b18bdf9fcaa8ee68409c8a88f9060 [0,2,0,0,0,0|1,0,1]=4 3320 B12R1.371 C[C@H](C=O)Nc1cnccc1S ccd228b2eb28c5773e20a1cca43ca075 [0,2,0,0,0,0|1,0,1]=4 3321 B12R1.371 C[C@H](C=O)Oc1cccnc1Br aef4b98b0baf895d90bf4234d949dae3 [0,2,0,0,0,0|1,0,1]=4 3322 B12R1.371 C[C@H](C=O)Oc1cccnc1Cl f06d3f745d72abaefb33bbe78312f957 [0,2,0,0,0,0|1,0,1]=4 3323 B12R1.371 C[C@H](C=O)Oc1cccnc1F 8cdeda7a0203e782c7cae4f3804226ac [0,2,0,0,0,0|1,0,1]=4 3324 B12R1.371 C[C@H](C=O)Oc1cccnc1I a2f72903c09534a669446e7d3d1186b1 [0,2,0,0,0,0|1,0,1]=4 3325 B12R1.371 C[C@H](C=O)Oc1cnccc1Br 22480ef637fd798247198d07af5368bc [0,2,0,0,0,0|1,0,1]=4 3326 B12R1.371 C[C@H](C=O)Oc1cnccc1Cl 7a9ea33442715ee2534f3ad367915049 [0,2,0,0,0,0|1,0,1]=4 3327 B12R1.371 C[C@H](C=O)Oc1cnccc1F eccfa6859c53c8e5a2553b97c6911c3b [0,2,0,0,0,0|1,0,1]=4 3328 B12R1.371 C[C@H](C=O)Oc1cnccc1I fe7be7484019359f69ffbeb783abd002 [0,2,0,0,0,0|1,0,1]=4 3329 B12R1.371 C[C@H](CO)Nc1c[nH]ccc1=O 345d2d48e1b1e18627a40f9cda7b6bc9 [0,2,0,0,0,0|1,0,1]=4 3330 B12R1.371 C[C@H](CO)Nc1c[nH]ccc1=S 90f7bc531c4ebfc391a209921baf149a [0,2,0,0,0,0|1,0,1]=4 3331 B12R1.371 C[C@H](CO)Nc1c[nH]cnc1=O d9bdd3fe2c7b990a71e353cb8ada09c8 [0,2,0,0,0,0|2,0,0]=4 3332 B12R1.371 C[C@H](CO)Nc1ccccc1F 636c9c06865906a75d3375bd72489d82 [0,2,0,0,0,0|2,0,0]=4 3333 B12R1.371 C[C@H](CO)Nc1ccccc1I aa96d8a3924e58569f2c3ab4fed9a92f [0,2,0,0,0,0|2,0,0]=4 3334 B12R1.371 C[C@H](CO)Nc1cccnc1Br acd550c245392c716c32ad2be2a6be06 [0,2,0,0,0,0|1,0,0]=3 3335 B12R1.371 C[C@H](CO)Nc1cccnc1Cl 83aa3e6845006824faaa3d57649128e2 [0,2,0,0,0,0|1,0,0]=3 3336 B12R1.371 C[C@H](CO)Nc1cccnc1F f8f79e4454dfaaa6b0b449961b593d41 [0,2,0,0,0,0|1,0,0]=3 3337 B12R1.371 C[C@H](CO)Nc1cccnc1I c104c5f6f5c3f912195ac0e1b4b12e43 [0,2,0,0,0,0|1,0,0]=3 3338 B12R1.371 C[C@H](CO)Nc1ccnnc1Br 29321af83a22b67b8a2dc02dcf6c79a4 [0,2,0,0,0,0|2,0,0]=4 3339 B12R1.371 C[C@H](CO)Nc1ccnnc1Cl 570dfd209d083624ff2e01f6c4bb02c7 [0,2,0,0,0,0|2,0,0]=4 3340 B12R1.371 C[C@H](CO)Nc1cnccc1Br c2165ca874ba408d1063254d8c7208a7 [0,2,0,0,0,0|1,0,0]=3 3341 B12R1.371 C[C@H](CO)Nc1cnccc1Cl a89a2924800a44bb2016498b4fb660f3 [0,2,0,0,0,0|1,0,0]=3 3342 B12R1.371 C[C@H](CO)Nc1cnccc1F 45443282ceaf000126126539fac6711d [0,2,0,0,0,0|1,0,0]=3 3343 B12R1.371 C[C@H](CO)Nc1cnccc1I 4fd2687202a5a6aba254ebbe10f70c2f [0,2,0,0,0,0|1,0,0]=3 3344 B12R1.371 C[C@H](CO)Nc1cncnc1I 20be0d7f0528c8ffeb6cbeddd20918ad [0,2,0,0,0,0|2,0,0]=4 3345 B12R1.371 C[C@H](CO)Nc1cnncc1Br 5592301d9e77b8485401bf0316847ac5 [0,2,0,0,0,0|2,0,0]=4 3346 B12R1.371 C[C@H](CO)Nc1cnncc1Cl e64f8d7a2ef03d71fa084963822656d2 [0,2,0,0,0,0|2,0,0]=4 3347 B12R1.371 C[C@H](CO)Nc1nccnc1Br 1483927f7016590fe2902907428363eb [0,2,0,0,0,0|2,0,0]=4 3348 B12R1.371 C[C@H](CO)Nc1nccnc1Cl 8451145aafb8e154fddc687b27ca80d0 [0,2,0,0,0,0|2,0,0]=4 3349 B12R1.371 C[C@H](CO)Nc1nccnc1I 808dc898e334bf3ee8426aeba466446c [0,2,0,0,0,0|2,0,0]=4 3350 B12R1.371 Cc1ccccc1CN(C)CF c4adb1d2d43ad8f4548a4d1e53228779 [0,2,0,0,0,0|2,0,0]=4 3351 B12R1.371 Cc1ccccc1CN(C)CO 63199def7303a7d9eb3beb52a0338d30 [0,2,0,0,0,0|2,0,0]=4 3352 B12R1.371 Cc1ccccc1NC(C)CO d135b508699b5774eadc8e5bb668b2c9 [0,2,0,0,0,0|2,0,0]=4 3353 B12R1.371 Cc1ccccc1N[C@@H](C)CO ca1b58b1899397ab399e5320d36d8569 [0,2,0,0,0,0|2,0,0]=4 3354 B12R1.371 Cc1ccccc1N[C@H](C)CO e0d94c7afbeca89e50d0334be68e4a7b [0,2,0,0,0,0|2,0,0]=4 3355 B12R1.371 Cc1ccncc1NC(C)C=O f36e5ec1044cd27eaa191af83c6bd7a3 [0,2,0,0,0,0|1,0,1]=4 3356 B12R1.371 Cc1ccncc1NC(C)CO a6aa25f37fabf51f6ef3ddf4ceb40fa2 [0,2,0,0,0,0|1,0,0]=3 3357 B12R1.371 Cc1ccncc1N[C@@H](C)CO 6ef02d04834754f51b94d7313bca761e [0,2,0,0,0,0|1,0,0]=3 3358 B12R1.371 Cc1ccncc1N[C@H](C)C=O 662dc48ecb3a17fcbcad54f169ad770b [0,2,0,0,0,0|1,0,1]=4 3359 B12R1.371 Cc1ccncc1N[C@H](C)CO a48fc52e32a72d0ae6388a59332be89b [0,2,0,0,0,0|1,0,0]=3 3360 B12R1.371 Cc1ccncc1OC(C)C=O b9ff80de5f4e6aa306223a3d0957c586 [0,2,0,0,0,0|1,0,1]=4 3361 B12R1.371 Cc1ccncc1O[C@H](C)C=O c5b137b71ac2a977df48accb3ff24451 [0,2,0,0,0,0|1,0,1]=4 3362 B12R1.371 Cc1ccnnc1NC(C)CO f6cda52c7e5d8ea1d10a340811f3e33f [0,2,0,0,0,0|2,0,0]=4 3363 B12R1.371 Cc1ccnnc1N[C@@H](C)CO 809c6ad516c338e1746641354ac2e7ce [0,2,0,0,0,0|2,0,0]=4 3364 B12R1.371 Cc1ccnnc1N[C@H](C)CO 8b6c6db80a74baf7a0802260176978ea [0,2,0,0,0,0|2,0,0]=4 3365 B12R1.371 Cc1ncccc1CN(C)C=O b582e5d507d9c0c818270d007008813a [0,2,0,0,0,0|1,0,1]=4 3366 B12R1.371 Cc1ncccc1CN(C)CF 7b5970fe2fc0462b3f404cc335b5c145 [0,2,0,0,0,0|1,0,0]=3 3367 B12R1.371 Cc1ncccc1CN(C)CO d93575a113941397f7a6ddcf0107fddd [0,2,0,0,0,0|1,0,0]=3 3368 B12R1.371 Cc1ncccc1NC(C)C=O 05215448219b80de42d43152df869833 [0,2,0,0,0,0|1,0,1]=4 3369 B12R1.371 Cc1ncccc1NC(C)CO 0a7c12e91115c1b45d7ae4e356970fc1 [0,2,0,0,0,0|1,0,0]=3 3370 B12R1.371 Cc1ncccc1N[C@@H](C)CO 7de9eebb40b8cef235e9005db18a568e [0,2,0,0,0,0|1,0,0]=3 3371 B12R1.371 Cc1ncccc1N[C@H](C)C=O 4baacc54a703c37ae8b79c6b553cd7b3 [0,2,0,0,0,0|1,0,1]=4 3372 B12R1.371 Cc1ncccc1N[C@H](C)CO e3a38a589aca8ac1df731739aa516f6c [0,2,0,0,0,0|1,0,0]=3 3373 B12R1.371 Cc1ncccc1OC(C)C#N 7d4e842b28db3c15a08047ec1b004b9d [0,2,0,0,0,0|1,0,1]=4 3374 B12R1.371 Cc1ncccc1OC(C)C=O 3a5968a7561333f745e719ab10ab453e [0,2,0,0,0,0|1,0,1]=4 3375 B12R1.371 Cc1ncccc1O[C@H](C)C=O 88b23a22e9c33b2fd90e7ce25ac05c17 [0,2,0,0,0,0|1,0,1]=4 3376 B12R1.371 Cc1nccnc1NC(C)CO 7b19c829617907b2e92f40b72c3802db [0,2,0,0,0,0|2,0,0]=4 3377 B12R1.371 Cc1nccnc1N[C@@H](C)CO 70e451d54217408e7bf70212f195b7d6 [0,2,0,0,0,0|2,0,0]=4 3378 B12R1.371 Cc1nccnc1N[C@H](C)CO c8098ca7458a2dd2387626d20fe718db [0,2,0,0,0,0|2,0,0]=4 3379 B12R1.371 Cc1nnccc1NC(C)CO df9915fb6d9141421d07de896ed4c390 [0,2,0,0,0,0|2,0,0]=4 3380 B12R1.371 Cc1nnccc1N[C@@H](C)CO 64b233b13f769efb9aa5df08cfa5ccca [0,2,0,0,0,0|2,0,0]=4 3381 B12R1.371 Cc1nnccc1N[C@H](C)CO 2c428cca9c2cfbcb160703ffc031078b [0,2,0,0,0,0|2,0,0]=4 3382 B12R1.75 C#Cc1ccccc1NC(C)C bfd82a9d189fa7bb52f5fdd602beb28a [0,2,0,0,0,0|2,0,0]=4 3383 B12R1.75 C#Cc1ccccc1OC(C)C 5fb2785bb6f1845ea9d7399e4082f45c [0,2,0,0,0,0|2,0,0]=4 3384 B12R1.75 C#Cc1ccncc1NC(C)C ceca1edf038e9a52746b83d643d21190 [0,2,0,0,0,0|1,0,0]=3 3385 B12R1.75 C#Cc1ncccc1NC(C)C 6dd54503d528da1ccfac774874020961 [0,2,0,0,0,0|1,0,0]=3 3386 B12R1.75 C#Cc1nccnc1NC(C)C f08fdafdc863bebbb1dcdfcc658bde0a [0,2,0,0,0,0|2,0,0]=4 3387 B12R1.75 C=Cc1ccccc1NC(C)C 995e7d4374b987994664cf5d8c4bc074 [0,2,0,0,0,0|2,0,0]=4 3388 B12R1.75 C=Cc1ccccc1OC(C)C d531882f2c23a56b1654c2b774a48133 [0,2,0,0,0,0|2,0,0]=4 3389 B12R1.75 C=Cc1ncccc1NC(C)C 6c66cb38a3b113b5d8f932f1b835504a [0,2,0,0,0,0|1,0,0]=3 3390 B12R1.75 CC(C)Nc1ccccc1C#N 348e21eb4884c996eb78d5c145f6019e [0,2,0,0,0,0|2,0,0]=4 3391 B12R1.75 CC(C)Nc1ccccc1C=O 1ea42160d99500f2f247d1c323ae97a3 [0,2,0,0,0,0|2,0,0]=4 3392 B12R1.75 CC(C)Nc1ccccc1CO af5c5fc98c450568aadbe8196cf0a208 [0,2,0,0,0,0|2,0,0]=4 3393 B12R1.75 CC(C)Nc1ccccc1CS 6950b8c71ea0a99d4719e22f4c9179fc [0,2,0,0,0,0|2,0,0]=4 3394 B12R1.75 CC(C)Nc1cccnc1C#N 3af28b064fe9861b1f5296b668423555 [0,2,0,0,0,0|1,0,0]=3 3395 B12R1.75 CC(C)Nc1cccnc1C=O 5ec6675e6fed52e68b1387f0ab900277 [0,2,0,0,0,0|1,0,0]=3 3396 B12R1.75 CC(C)Nc1cccnc1CCl 7361da4573b96166c5b6fccded09dcd2 [0,2,0,0,0,0|1,0,0]=3 3397 B12R1.75 CC(C)Nc1cccnc1CO e2183bf29d55ddd1c3037f87606ec26b [0,2,0,0,0,0|1,0,0]=3 3398 B12R1.75 CC(C)Nc1cnccc1C#N f4d8baa99045d9bc6f30864954b9071c [0,2,0,0,0,0|1,0,0]=3 3399 B12R1.75 CC(C)Nc1cnccc1C=O 5a7b45adb419ddf911e82d9031356bb3 [0,2,0,0,0,0|1,0,0]=3 3400 B12R1.75 CC(C)Nc1cnccc1CO 7a6badedfe2bf97ec328332794ff6930 [0,2,0,0,0,0|1,0,0]=3 3401 B12R1.75 CC(C)Nc1cncnc1C=O 269826d555903819277078cb984acfd6 [0,2,0,0,0,0|2,0,0]=4 3402 B12R1.75 CC(C)Nc1nccnc1C#N 80e4b27956278913f7d02d2fe219e38c [0,2,0,0,0,0|2,0,0]=4 3403 B12R1.75 CC(C)Nc1nccnc1C=O 5620ebe52980a7450def83a227cdba40 [0,2,0,0,0,0|2,0,0]=4 3404 B12R1.75 CC(C)Nc1nccnc1CO 42a6d31fa57d49bbf4b11e1fa004ee77 [0,2,0,0,0,0|2,0,0]=4 3405 B12R1.75 CC(C)Nc1nnccc1C#N 16d974fb5ff0d8c8d36ad9a058572c45 [0,2,0,0,0,0|2,0,0]=4 3406 B12R1.75 CC(C)Oc1ccccc1C#N 7149e888e8961e276dfd552220244434 [0,2,0,0,0,0|2,0,0]=4 3407 B12R1.75 CC(C)Oc1ccccc1C=O fc188e20ae7067ec467c46f7640666a7 [0,2,0,0,0,0|2,0,0]=4 3408 B12R1.75 CC(C)Oc1cccnc1C#N f7b59f05374fb01c8ecffb1f0f3b87d2 [0,2,0,0,0,0|1,0,0]=3 3409 B12R1.75 CC(C)Oc1cccnc1C=O 1a364e417b83d5b80cfc81df9ddcb05b [0,2,0,0,0,0|1,0,0]=3 3410 B12R1.75 CC(C)Oc1cnccc1C#N 018465aae7acd98b2e209def587784fa [0,2,0,0,0,0|1,0,0]=3 3411 B12R1.75 CC(C)Oc1cnccc1C=O 47cc2fcdb40f808589b853bff2ac8dc0 [0,2,0,0,0,0|1,0,0]=3 3412 B12R1.75 CCc1ccccc1OC(C)C b797575d38ba5b9ee07e898e057c7852 [0,2,0,0,0,0|2,0,0]=4 3413 B12R1.75 CCc1ccncc1OC(C)C a4cc636b923187e8b2011d9bd9832506 [0,2,0,0,0,0|1,0,0]=3 3414 B12R1.75 CCc1ncccc1NC(C)C 83f2eec9fb1c0ceeec7d68093d60d070 [0,2,0,0,0,0|1,0,0]=3 3415 B12R1.75 CCc1ncccc1OC(C)C d4e97828ffb2811afa6c085ad0b3400b [0,2,0,0,0,0|1,0,0]=3 3416 B12R1.75 CCc1nccnc1NC(C)C 77e2a813d30daf392e99d63a90c143c7 [0,2,0,0,0,0|2,0,0]=4 3417 B12R1.75 COc1ccccc1OC(C)C c1dcbb1f48c176cca0a792de0db2234a [0,2,0,0,0,0|2,0,0]=4 3418 B12R1.75 COc1ccncc1OC(C)C 594bdbdd2d469ffcaa6252043ae1ba25 [0,2,0,0,0,0|1,0,0]=3 3419 B12R1.75 COc1ncccc1NC(C)C 800739fcd1ef15b29d8c63ae686f9f96 [0,2,0,0,0,0|1,0,0]=3 3420 B12R1.75 COc1ncccc1OC(C)C d220caab44ed1eb3251ca98e513c4975 [0,2,0,0,0,0|1,0,0]=3 3421 B12R1.75 COc1nccnc1NC(C)C 655de8cc36421b1edfe8c7c37440c49c [0,2,0,0,0,0|2,0,0]=4 3422 B12R1.75 COc1nnccc1NC(C)C c3fd86f6f79b3b9390c4c3b4ed152ed2 [0,2,0,0,0,0|2,0,0]=4 3423 B12R1.75 CSc1ccccc1OC(C)C 8232f49eaf6b0b7ba6b339a5985799c9 [0,2,0,0,0,0|2,0,0]=4 3424 B12R1.127 CC(C)Nc1cc(ccc1Cl)Cl 3bc364d4a2a04cb63326e16ff866022c [0,2,0,0,0,0|2,0,0]=4 3425 B12R1.127 CC(C)Nc1cc(ccc1Cl)I 917594a9dfc86f00ad0b561acc198caf [0,2,0,0,0,0|2,0,0]=4 3426 B12R1.127 CC(C)Nc1cc(ccc1F)Cl f94d5f66f5469156e62d77a0d956c1b0 [0,2,0,0,0,0|2,0,0]=4 3427 B12R1.127 CC(C)Nc1cc(ccc1F)F a68abc104ca57449f291ba06b9ce4af9 [0,2,0,0,0,0|2,0,0]=4 3428 B12R1.127 CC(C)Nc1cc(ccc1F)I 61507874eea88c7732535bca188147a3 [0,2,0,0,0,0|2,0,0]=4 3429 B12R1.127 CC(C)Nc1cc(ccc1I)Br 49d2e6a2bb03a15f7ebff778427d5518 [0,2,0,0,0,0|2,0,0]=4 3430 B12R1.127 CC(C)Nc1cc(ccc1I)Cl 44969bf80dd7bc8463c2296b8456c08c [0,2,0,0,0,0|2,0,0]=4 3431 B12R1.127 CC(C)Nc1cc(ccc1I)F bcd4f3b11b33975920ae01347a0103b7 [0,2,0,0,0,0|2,0,0]=4 3432 B12R1.127 CC(C)Nc1cc(ccc1S)Cl 7e92bdc15e1e2c513a74a2baac6cf02e [0,2,0,0,0,0|2,0,0]=4 3433 B12R1.127 CC(C)Nc1cc(cnc1Br)Cl 0e6f248bb9015c06e2455ee5cf618b8a [0,2,0,0,0,0|1,0,0]=3 3434 B12R1.127 CC(C)Nc1cc(cnc1Br)F b189b63d1e65940d824b7812f46da114 [0,2,0,0,0,0|1,0,0]=3 3435 B12R1.127 CC(C)Nc1cc(cnc1Br)I 6f3d337ab8e7986df41aed8dce36e461 [0,2,0,0,0,0|1,0,0]=3 3436 B12R1.127 CC(C)Nc1cc(cnc1Cl)Br 86c924f1d5b644c0863c85a651250360 [0,2,0,0,0,0|1,0,0]=3 3437 B12R1.127 CC(C)Nc1cc(cnc1Cl)Cl 4799f4348e46f059bdf83fd5fb0e9af1 [0,2,0,0,0,0|1,0,0]=3 3438 B12R1.127 CC(C)Nc1cc(cnc1Cl)F ba358aecb680ad7e2e4b15c23c458842 [0,2,0,0,0,0|1,0,0]=3 3439 B12R1.127 CC(C)Nc1cc(cnc1Cl)I 2db1f78b295725208e6b3f3d6445bf06 [0,2,0,0,0,0|1,0,0]=3 3440 B12R1.127 CC(C)Nc1cc(cnc1F)Br c992b92150ae59553a112d3cdde297a9 [0,2,0,0,0,0|1,0,0]=3 3441 B12R1.127 CC(C)Nc1cc(cnc1F)Cl 8dd33208789604c80e560c8d5583fb36 [0,2,0,0,0,0|1,0,0]=3 3442 B12R1.127 CC(C)Nc1cc(cnc1I)Br 7c386fd0a4adb5a4d7b4a05129ede286 [0,2,0,0,0,0|1,0,0]=3 3443 B12R1.127 CC(C)Nc1cc(cnc1I)Cl fb952e4d045aff20c2725845e2cc9191 [0,2,0,0,0,0|1,0,0]=3 3444 B12R1.127 CC(C)Nc1cc(nnc1Cl)Cl c4210553a77416e612054035f187c129 [0,2,0,0,0,0|2,0,0]=4 3445 B12R1.127 CC(C)Nc1nc(cnc1Br)Br 797cc49524024c189e2e34a21be393a2 [0,2,0,0,0,0|2,0,0]=4 3446 B12R1.127 CC(C)Nc1nc(cnc1Br)Cl 369ad49d393816f264508333ee5c755b [0,2,0,0,0,0|2,0,0]=4 3447 B12R1.127 CC(C)Nc1nc(cnc1Cl)Cl b3c4c6089fbb88e0f2beb4292e925c76 [0,2,0,0,0,0|2,0,0]=4 3448 B12R1.127 CC(C)Nc1nc(cnc1I)Cl 6ed220041c531a588a1e22c03ff06c22 [0,2,0,0,0,0|2,0,0]=4 3449 B12R1.127 CC(C)Oc1cc(ccc1Br)F 2646d59679a0119b669476cc3e1b4563 [0,2,0,0,0,0|2,0,0]=4 3450 B12R1.127 CC(C)Oc1cc(ccc1Cl)Br 9468624fb0d08de85e1c148696e0ae50 [0,2,0,0,0,0|2,0,0]=4 3451 B12R1.127 CC(C)Oc1cc(ccc1Cl)Cl 71efbd6723ba2fc279387d2be3e5f755 [0,2,0,0,0,0|2,0,0]=4 3452 B12R1.127 CC(C)Oc1cc(ccc1Cl)F 256df4c3a77745d1768ec0c02b58e2b0 [0,2,0,0,0,0|2,0,0]=4 3453 B12R1.127 CC(C)Oc1cc(ccc1Cl)I 69c7a055aa19c603e95e2cfc5d444be0 [0,2,0,0,0,0|2,0,0]=4 3454 B12R1.127 CC(C)Oc1cc(ccc1F)Br 7d9170d0420d4d4fd0276e57ab4d0e0b [0,2,0,0,0,0|2,0,0]=4 3455 B12R1.127 CC(C)Oc1cc(ccc1F)Cl 7c9852a5c41d853f90db4a80c08deb31 [0,2,0,0,0,0|2,0,0]=4 3456 B12R1.127 CC(C)Oc1cc(ccc1F)F adb7375e5c4ed6f7e22ff456d3f52c59 [0,2,0,0,0,0|2,0,0]=4 3457 B12R1.127 CC(C)Oc1cc(ccc1F)I 7e6adccc2f7e2086d629938d91699ff6 [0,2,0,0,0,0|2,0,0]=4 3458 B12R1.127 CC(C)Oc1cc(ccc1I)Br f165204843f5060803a4322d5f83e91a [0,2,0,0,0,0|2,0,0]=4 3459 B12R1.127 CC(C)Oc1cc(ccc1I)Cl 0d310dc2bdd46050a03683dcd93ec581 [0,2,0,0,0,0|2,0,0]=4 3460 B12R1.127 CC(C)Oc1cc(ccc1I)F 39a1185950e035aef719641c0a0a864b [0,2,0,0,0,0|2,0,0]=4 3461 B12R1.127 CC(C)Oc1cc(cnc1Br)Br 2907d580a4a711e8a71b8a8ce0beaad0 [0,2,0,0,0,0|1,0,0]=3 3462 B12R1.127 CC(C)Oc1cc(cnc1Br)Cl 0ce9952ba6351a9fc29ab7a7c98ab376 [0,2,0,0,0,0|1,0,0]=3 3463 B12R1.127 CC(C)Oc1cc(cnc1Br)F 65dba579a322a189df926e1ceb7db459 [0,2,0,0,0,0|1,0,0]=3 3464 B12R1.127 CC(C)Oc1cc(cnc1Cl)Br 6221e1a9fc5ffeebb2a07972b2c23a7a [0,2,0,0,0,0|1,0,0]=3 3465 B12R1.127 CC(C)Oc1cc(cnc1Cl)Cl de0e85529de2d674fb409a014a33eb82 [0,2,0,0,0,0|1,0,0]=3 3466 B12R1.127 CC(C)Oc1cc(cnc1Cl)F 62fec4448a6a35bd409843025136e820 [0,2,0,0,0,0|1,0,0]=3 3467 B12R1.127 CC(C)Oc1cc(cnc1F)Br f9f1cc28cd330cc4480ff53daab9e5bf [0,2,0,0,0,0|1,0,0]=3 3468 B12R1.127 CC(C)Oc1cc(cnc1F)Cl ba8dffed072e7cd07abf752ca9abd34f [0,2,0,0,0,0|1,0,0]=3 3469 B12R1.127 CC(C)Oc1cc(cnc1F)F b1beefa25f5105e122e023dac6246341 [0,2,0,0,0,0|1,0,0]=3 3470 B12R1.127 CC(C)Oc1cc(cnc1I)Br ee63c3cae18fa4c854ba5e90ebba2731 [0,2,0,0,0,0|1,0,0]=3 3471 B12R1.127 CC(C)Oc1cc(cnc1I)Cl 3ca0779d4d685bfdd6f7c5ad95301018 [0,2,0,0,0,0|1,0,0]=3 3472 B12R1.127 CC(C)Oc1cc(cnc1I)F 4147b66534f1aa6c69be0c0b4f130e95 [0,2,0,0,0,0|1,0,0]=3 3473 B12R1.127 CC(C)Oc1cc(nnc1Cl)Cl f3d7557d8b29394b3f67cf22db380da3 [0,2,0,0,0,0|2,0,0]=4 3474 B12R1.127 CC(C)Oc1cn(ccc1=O)C 2c52ec2565cf05eb3cc719d0b661267b [0,2,0,0,0,0|1,0,1]=4 3475 B12R1.127 Cc1ccc(c(c1)NC(C)C)I eff339ae364ac1ab92947630ad0924f6 [0,2,0,0,0,0|2,0,0]=4 3476 B12R1.127 Cc1ccc(c(c1)OC(C)C)C 0b90220c912680e151ad9c07ad864a3e [0,2,0,0,0,0|2,0,0]=4 3477 B12R1.127 Cc1ccc(c(c1)OC(C)C)Cl d4c8fcf031559b895582caebaafd2bfe [0,2,0,0,0,0|2,0,0]=4 3478 B12R1.127 Cc1ccc(c(c1)OC(C)C)F 3b6a0c269bbca2fa025f72338f3cca06 [0,2,0,0,0,0|2,0,0]=4 3479 B12R1.127 Cc1ccc(c(c1)OC(C)C)I 4375ec63921a760372b3c3df06883bb8 [0,2,0,0,0,0|2,0,0]=4 3480 B12R1.127 Cc1ccc(cc1NC(C)C)Cl f47c79f6349a9d7074bb60991664adde [0,2,0,0,0,0|2,0,0]=4 3481 B12R1.127 Cc1ccc(cc1NC(C)C)F 274f12a96715dc0590278235734a9aa0 [0,2,0,0,0,0|2,0,0]=4 3482 B12R1.127 Cc1ccc(cc1NC(C)C)I 2283d1315c934709c83b221f38d34255 [0,2,0,0,0,0|2,0,0]=4 3483 B12R1.127 Cc1ccc(cc1OC(C)C)Br 99e26b0ada7d7c01430f6a8b5e05839b [0,2,0,0,0,0|2,0,0]=4 3484 B12R1.127 Cc1ccc(cc1OC(C)C)Cl 4d21ff7d37b8da505a74e45dfdcab2b7 [0,2,0,0,0,0|2,0,0]=4 3485 B12R1.127 Cc1ccc(cc1OC(C)C)F 204fa36252cb332a629bd09aba4e9602 [0,2,0,0,0,0|2,0,0]=4 3486 B12R1.127 Cc1ccc(cc1OC(C)C)I a5fba2a18a650c3cb96ebd4044a8b1b3 [0,2,0,0,0,0|2,0,0]=4 3487 B12R1.127 Cc1cnc(c(c1)NC(C)C)C 3abfe7192c9659f20c2705b529ee7a33 [0,2,0,0,0,0|1,0,0]=3 3488 B12R1.127 Cc1cnc(c(c1)NC(C)C)Cl f96fc5759e0b59917fa6952c40166981 [0,2,0,0,0,0|1,0,0]=3 3489 B12R1.127 Cc1cnc(c(c1)NC(C)C)F 71ac761bc656834c27778087cf890b8d [0,2,0,0,0,0|1,0,0]=3 3490 B12R1.127 Cc1cnc(c(c1)OC(C)C)Br 41349ef2c8082701c1d06b85c2809bde [0,2,0,0,0,0|1,0,0]=3 3491 B12R1.127 Cc1cnc(c(c1)OC(C)C)Cl 31d58bea7707ac27e69a518e7e16b8ae [0,2,0,0,0,0|1,0,0]=3 3492 B12R1.127 Cc1cnc(c(c1)OC(C)C)F 7131912b2dc518497e102d4a26d82782 [0,2,0,0,0,0|1,0,0]=3 3493 B12R1.127 Cc1cnc(c(n1)NC(C)C)C 691cf4f2959493df7ad3b9fcbcbc7883 [0,2,0,0,0,0|2,0,0]=4 3494 B12R1.127 Cc1cnc(c(n1)NC(C)C)Cl 4433a46d2606cc10b94c26913bd8e72a [0,2,0,0,0,0|2,0,0]=4 3495 B12R1.127 Cc1cnc(c(n1)NC(C)C)I aea3509883d2cd11cdc2e04bb4050f02 [0,2,0,0,0,0|2,0,0]=4 3496 B12R1.127 Cc1ncc(cc1NC(C)C)Br 8286988c487f5d04bbcf881dc5a29684 [0,2,0,0,0,0|1,0,0]=3 3497 B12R1.127 Cc1ncc(cc1NC(C)C)Cl 00749a4aba209ebab892cd10f49fc449 [0,2,0,0,0,0|1,0,0]=3 3498 B12R1.127 Cc1ncc(cc1NC(C)C)F 89cc70c9b3906d5aeb0c4dd9118fda60 [0,2,0,0,0,0|1,0,0]=3 3499 B12R1.127 Cc1ncc(cc1OC(C)C)Br 3d7d23661242a1d9e038f7949a1e4dd0 [0,2,0,0,0,0|1,0,0]=3 3500 B12R1.127 Cc1ncc(cc1OC(C)C)Cl c387ca2603458bc584b29876a5f07cdf [0,2,0,0,0,0|1,0,0]=3 3501 B12R1.127 Cc1ncc(cc1OC(C)C)F 9a4404b2f9d7d0cf7025ef52290ff60a [0,2,0,0,0,0|1,0,0]=3 3502 B12R1.127 Cc1ncc(nc1NC(C)C)Cl 82d5fd1fe72c50d781beb37aa9e3d78b [0,2,0,0,0,0|2,0,0]=4 3503 B12R1.151 CC(C)(C)Nc1c[nH]ccc1=O 10de700c858690fb06026b70f71a4cdc [0,2,0,0,0,0|1,0,1]=4 3504 B12R1.151 CC(C)(C)Nc1cnccc1F 023d0ef3428f50e2a359b335d47f8491 [0,2,0,0,0,0|1,0,0]=3 3505 B12R1.224 CC(C)Nc1cccc(c1Br)Cl 53f631048adef89ff41cef89e4c1759e [0,2,0,0,0,0|2,0,0]=4 3506 B12R1.224 CC(C)Nc1cccc(c1Cl)F dec62e55b510382a7a147658ccb9fc98 [0,2,0,0,0,0|2,0,0]=4 3507 B12R1.224 CC(C)Nc1cccn(c1=O)C 00e044af703a6808aefb4673944219d6 [0,2,0,0,0,0|1,0,1]=4 3508 B12R1.224 CC(C)Nc1cn[nH]c(=O)c1Cl 5eb416e5e3f02de23ba6f8a57fae1a99 [0,2,0,0,0,0|2,0,0]=4 3509 B12R1.224 CC(C)Nc1cncc(c1Br)Cl 59d462265ff06857b7feb5424d7f0dfa [0,2,0,0,0,0|1,0,0]=3 3510 B12R1.224 CC(C)Nc1cncc(c1Cl)Br 32ab7dc3dedb29e4b11a91177835881d [0,2,0,0,0,0|1,0,0]=3 3511 B12R1.224 CC(C)Nc1cncc(c1Cl)Cl c9223f4900f1104eed38dbea076e1f89 [0,2,0,0,0,0|1,0,0]=3 3512 B12R1.224 CC(C)Nc1cncc(c1Cl)F a7e8d03ec5c2f87e79e84e64882e0f8e [0,2,0,0,0,0|1,0,0]=3 3513 B12R1.224 CC(C)Nc1cncc(c1F)Cl c749e9da5b3343cc0a74f58228319991 [0,2,0,0,0,0|1,0,0]=3 3514 B12R1.224 CC(C)Nc1cncc(c1I)Br 13f9c3d4dbe7a3b11d134639e6a2be88 [0,2,0,0,0,0|1,0,0]=3 3515 B12R1.224 CC(C)Nc1cncc(c1I)Cl 5faa22d71b52d74bc8d0457138b82dbf [0,2,0,0,0,0|1,0,0]=3 3516 B12R1.224 CC(C)Nc1cncc(c1I)F a188f355c922e5613a00835d506a5326 [0,2,0,0,0,0|1,0,0]=3 3517 B12R1.224 CC(C)Nc1cncn(c1=O)C adcd13fc33cea0ad6089cb635578bd4d [0,2,0,0,0,0|2,0,0]=4 3518 B12R1.224 CC(C)Nc1cnnc(c1Cl)Cl 993cfc97dc61404e1871a8a519e409f4 [0,2,0,0,0,0|2,0,0]=4 3519 B12R1.224 CC(C)Oc1c[nH]cc(c1=O)F 009bb11277a13232063df6050ab33666 [0,2,0,0,0,0|1,0,1]=4 3520 B12R1.224 CC(C)Oc1cccc(c1Br)Br be7c69550c62dfc035cde811bad22360 [0,2,0,0,0,0|2,0,0]=4 3521 B12R1.224 CC(C)Oc1cccc(c1Br)Cl 1b49eea272b356f246dc8b9b05cb2a27 [0,2,0,0,0,0|2,0,0]=4 3522 B12R1.224 CC(C)Oc1cccc(c1Br)F 5adceb2b52fdf9675ce25706ffc21607 [0,2,0,0,0,0|2,0,0]=4 3523 B12R1.224 CC(C)Oc1cccc(c1Br)I aa8adc2641b9dc45b52d916ddf60dd9d [0,2,0,0,0,0|2,0,0]=4 3524 B12R1.224 CC(C)Oc1cccc(c1Cl)Br e45582288a884403b9faee35fcca9645 [0,2,0,0,0,0|2,0,0]=4 3525 B12R1.224 CC(C)Oc1cccc(c1Cl)Cl c20891242a1ef82f96eba7e624f573b3 [0,2,0,0,0,0|2,0,0]=4 3526 B12R1.224 CC(C)Oc1cccc(c1Cl)F cc9b87f18592b15f040d2b202e85598d [0,2,0,0,0,0|2,0,0]=4 3527 B12R1.224 CC(C)Oc1cccc(c1Cl)I 03f301a845c9ebf4dd792d342ee3f96f [0,2,0,0,0,0|2,0,0]=4 3528 B12R1.224 CC(C)Oc1cccc(c1F)Cl fec6e116b2cf6776dd79637095a47955 [0,2,0,0,0,0|2,0,0]=4 3529 B12R1.224 CC(C)Oc1cccc(c1F)F 9a5d7937ae29d4f07cb68f8c89987366 [0,2,0,0,0,0|2,0,0]=4 3530 B12R1.224 CC(C)Oc1cccc(c1F)I b5bb5bd994fdd596707ba2ad01904a93 [0,2,0,0,0,0|2,0,0]=4 3531 B12R1.224 CC(C)Oc1cccc(c1I)Br ab4ee7eb4278f2cc0de6076cf9ab2390 [0,2,0,0,0,0|2,0,0]=4 3532 B12R1.224 CC(C)Oc1cccc(c1I)Cl 69fdb3f6b8a4ecdf7d4d7ca9b0e18a96 [0,2,0,0,0,0|2,0,0]=4 3533 B12R1.224 CC(C)Oc1cccc(c1I)F a7b38987f78de0278bf1ff80fb64fc30 [0,2,0,0,0,0|2,0,0]=4 3534 B12R1.224 CC(C)Oc1cccn(c1=O)C 77ad55e86b8068292f27eec6c5c56f43 [0,2,0,0,0,0|1,0,1]=4 3535 B12R1.224 CC(C)Oc1cccn(c1=S)C 53ded2d898bdb20dc07acf1336be2c75 [0,2,0,0,0,0|1,0,1]=4 3536 B12R1.224 CC(C)Oc1cn[nH]c(=O)c1Cl c7d96d635ebd43ac2d0becef58d801a2 [0,2,0,0,0,0|2,0,0]=4 3537 B12R1.224 CC(C)Oc1cncc(c1F)Br 2a05b88b2234f150cab59c0696277094 [0,2,0,0,0,0|1,0,0]=3 3538 B12R1.224 Cc1c(cccc1OC(C)C)Br 1a7527c236845cad3dc776fd2623f89a [0,2,0,0,0,0|2,0,0]=4 3539 B12R1.224 Cc1c(cccc1OC(C)C)Cl 32051cf527c255f5c9526b4e9d8c9270 [0,2,0,0,0,0|2,0,0]=4 3540 B12R1.224 Cc1c(cccc1OC(C)C)F 3362faf6a06d7f191009b6ad4914990e [0,2,0,0,0,0|2,0,0]=4 3541 B12R1.224 Cc1c(cccc1OC(C)C)I 1f48205280453ad6d511c7023b8738df [0,2,0,0,0,0|2,0,0]=4 3542 B12R1.224 Cc1c(cncc1NC(C)C)Br 1efa970b53540d20356f5f083fc0fb99 [0,2,0,0,0,0|1,0,0]=3 3543 B12R1.224 Cc1c(cncc1NC(C)C)Cl 98c65b571dae9437a67486ca0871587d [0,2,0,0,0,0|1,0,0]=3 3544 B12R1.224 Cc1c(cncc1NC(C)C)F f30a84f0ae3d542ee37423bd283a7d9b [0,2,0,0,0,0|1,0,0]=3 3545 B12R1.224 Cc1c(cncc1OC(C)C)Br 2526f788c0a149b04eb703c5a87ee8ff [0,2,0,0,0,0|1,0,0]=3 3546 B12R1.224 Cc1cccc(c1Br)OC(C)C 9f8c304ec70da7d671abfcd89d55d6a9 [0,2,0,0,0,0|2,0,0]=4 3547 B12R1.224 Cc1cccc(c1C)OC(C)C 795bed37a5696b93bab568ac1d277fdc [0,2,0,0,0,0|2,0,0]=4 3548 B12R1.224 Cc1cccc(c1Cl)OC(C)C 45c00ab00a852614bf8395afe9da39f8 [0,2,0,0,0,0|2,0,0]=4 3549 B12R1.224 Cc1cccc(c1F)OC(C)C 4b33c375e882d56de9aea4261ef37260 [0,2,0,0,0,0|2,0,0]=4 3550 B12R1.224 Cc1cccc(c1I)OC(C)C 4048eb28bc554829441f1c3422c8f6e7 [0,2,0,0,0,0|2,0,0]=4 3551 B12R1.224 Cc1cncc(c1Br)OC(C)C 932f38b7fe65dac3aa4b76a5050111c0 [0,2,0,0,0,0|1,0,0]=3 3552 B12R1.224 Cc1cncc(c1Cl)OC(C)C a1282128d600d46f5540421864fb8b98 [0,2,0,0,0,0|1,0,0]=3 3553 B12R1.1009 CC(C)Nc1c(cc[nH]c1=O)F 55ad190e90d72f6f3faad2f40e4a8110 [0,2,0,0,0,0|1,0,1]=4 3554 B12R1.1009 CC(C)Nc1c(cccc1F)F 470022a8587eb7236328233cbb60f95c [0,2,0,0,0,0|2,0,0]=4 3555 B12R1.1009 CC(C)Nc1c(cccc1I)F 14ce88a58c45e33dae9aad2cd4d3ab93 [0,2,0,0,0,0|2,0,0]=4 3556 B12R1.1009 CC(C)Nc1c(cccc1S)F 0b373eca56263ffff23bbe01e0d9662d [0,2,0,0,0,0|2,0,0]=4 3557 B12R1.1009 CC(C)Nc1c(ccnc1Cl)Br 0a4d20b6e33ebe3cc94bd894dc6cef9b [0,2,0,0,0,0|1,0,0]=3 3558 B12R1.1009 CC(C)Nc1c(ccnc1Cl)Cl cb9b6cdd776b2959b4d6d99e8c550ff4 [0,2,0,0,0,0|1,0,0]=3 3559 B12R1.1009 CC(C)Nc1c(ccnc1Cl)I 11e49c5616ce7598b0a5386564181e7a [0,2,0,0,0,0|1,0,0]=3 3560 B12R1.1009 CC(C)Nc1c(ccnc1F)Cl 09fb320eafa2b798a85028f27a0a688d [0,2,0,0,0,0|1,0,0]=3 3561 B12R1.1009 CC(C)Nc1c(cnnc1Cl)Cl 69be6f968c712211c805b24093971df0 [0,2,0,0,0,0|2,0,0]=4 3562 B12R1.1009 CC(C)Nc1c(ncnc1Cl)Cl b466566df556cc59fa78a043d1b8e339 [0,2,0,0,0,0|2,0,0]=4 3563 B12R1.1009 CC(C)Nc1c(ncnc1I)I 350ec83de528d0efc5364c0d5f857643 [0,2,0,0,0,0|2,0,0]=4 3564 B12R1.1009 CC(C)Oc1c(cccc1Br)F 7867c222c052c8cc2982ef2fc699664b [0,2,0,0,0,0|2,0,0]=4 3565 B12R1.1009 CC(C)Oc1c(cccc1Cl)Cl f542c331107b7d01c4399c8fa2effefe [0,2,0,0,0,0|2,0,0]=4 3566 B12R1.1009 CC(C)Oc1c(cccc1Cl)F cccc8e6852f8614f38509456cdc51827 [0,2,0,0,0,0|2,0,0]=4 3567 B12R1.1009 CC(C)Oc1c(cccc1F)F b27287b1172887fdb45edd4b5d562ef3 [0,2,0,0,0,0|2,0,0]=4 3568 B12R1.1009 CC(C)Oc1c(cccc1I)Cl 5731189536b0eaf81f4b695548041fe3 [0,2,0,0,0,0|2,0,0]=4 3569 B12R1.1009 CC(C)Oc1c(cccc1I)F 3e89607ed3974d5ada50b29bda1bdafe [0,2,0,0,0,0|2,0,0]=4 3570 B12R1.1009 CC(C)Oc1c(cccc1I)I 01e136ff24362bbac6d437d5134aec3b [0,2,0,0,0,0|2,0,0]=4 3571 B12R1.1009 CC(C)Oc1c(ccnc1Br)Br 36680078785b47b7d4fb4a9d92ecae87 [0,2,0,0,0,0|1,0,0]=3 3572 B12R1.1009 CC(C)Oc1c(ccnc1Br)Cl cf075910f146b73b3be955dd15e915b4 [0,2,0,0,0,0|1,0,0]=3 3573 B12R1.1009 CC(C)Oc1c(ccnc1Br)F ca7590d2a641ef15e933456e6ac3cbf9 [0,2,0,0,0,0|1,0,0]=3 3574 B12R1.1009 CC(C)Oc1c(ccnc1Cl)Br 36577772c5469683e9ef299064fdfa91 [0,2,0,0,0,0|1,0,0]=3 3575 B12R1.1009 CC(C)Oc1c(ccnc1Cl)Cl 42b621daacdd9fd27b7e37c81ce7e942 [0,2,0,0,0,0|1,0,0]=3 3576 B12R1.1009 CC(C)Oc1c(ccnc1Cl)F 2c6bef3deadaaeb1e2b299f4f813d2f4 [0,2,0,0,0,0|1,0,0]=3 3577 B12R1.1009 CC(C)Oc1c(ccnc1Cl)I 07527c93f0cde056c4b5762f7dd830fa [0,2,0,0,0,0|1,0,0]=3 3578 B12R1.1009 CC(C)Oc1c(ccnc1F)Br 2e1e50a509732c40bf479610088e26b1 [0,2,0,0,0,0|1,0,0]=3 3579 B12R1.1009 CC(C)Oc1c(ccnc1F)F 72943d120ce1baedaaf753fe4f610160 [0,2,0,0,0,0|1,0,0]=3 3580 B12R1.1009 CC(C)Oc1c(ccnc1F)I d69a17850d0b8f1d2c6103834a57bb36 [0,2,0,0,0,0|1,0,0]=3 3581 B12R1.1009 CC(C)Oc1c(ccnc1I)Cl e1b434cfff296421caedb9bbd95d2af9 [0,2,0,0,0,0|1,0,0]=3 3582 B12R1.1009 CC(C)Oc1c(ccnc1I)I be64a8f20065334fe56ba2d7cd3343ad [0,2,0,0,0,0|1,0,0]=3 3583 B12R1.1009 CC(C)Oc1c(ncnc1Cl)Cl 656e466ab93b70bb41a99ebef81ebf3c [0,2,0,0,0,0|2,0,0]=4 3584 B12R1.1009 Cc1[nH]ccc(=O)c1OC(C)C d9b968c9d705b81cedabb46000017ce1 [0,2,0,0,0,0|1,0,1]=4 3585 B12R1.1009 Cc1cccc(c1NC(C)C)C 6cd32127934fee8a8b404daa0d07afc4 [0,2,0,0,0,0|2,0,0]=4 3586 B12R1.1009 Cc1cccc(c1NC(C)C)F 934b8fb88d3f665ab8914d77a5e930ef [0,2,0,0,0,0|2,0,0]=4 3587 B12R1.1009 Cc1cccc(c1NC(C)C)I 1ed72108b19807cd27bbac81856b42f0 [0,2,0,0,0,0|2,0,0]=4 3588 B12R1.1009 Cc1cccc(c1OC(C)C)C bb37a196b10053a7b647b1439dc6d342 [0,2,0,0,0,0|2,0,0]=4 3589 B12R1.1009 Cc1cccc(c1OC(C)C)Cl c68212e5fdd8fc31327757aa294d790b [0,2,0,0,0,0|2,0,0]=4 3590 B12R1.1009 Cc1cccc(c1OC(C)C)F 387ce16a8241ff8ee157dafd0815cc33 [0,2,0,0,0,0|2,0,0]=4 3591 B12R1.1009 Cc1cccc(c1OC(C)C)I ac1875791951941e1a376222c111517d [0,2,0,0,0,0|2,0,0]=4 3592 B12R1.1009 Cc1ccnc(c1NC(C)C)Br 95eb709b6fba092a9cf0c2d7795a5add [0,2,0,0,0,0|1,0,0]=3 3593 B12R1.1009 Cc1ccnc(c1NC(C)C)C d3879dac3cd62bdbcef27ac70cb5ac21 [0,2,0,0,0,0|1,0,0]=3 3594 B12R1.1009 Cc1ccnc(c1NC(C)C)Cl 767e60818f42d83ec2c4a2f687e8f8f2 [0,2,0,0,0,0|1,0,0]=3 3595 B12R1.1009 Cc1ccnc(c1NC(C)C)F 9aea2902f90db625ac5f094febca173c [0,2,0,0,0,0|1,0,0]=3 3596 B12R1.1009 Cc1ccnc(c1OC(C)C)Br 53ef50e8a340399e49e5a458248b2f50 [0,2,0,0,0,0|1,0,0]=3 3597 B12R1.1009 Cc1ccnc(c1OC(C)C)C c6dc1905de53cd982e739d2fd26579b7 [0,2,0,0,0,0|1,0,0]=3 3598 B12R1.1009 Cc1ccnc(c1OC(C)C)Cl d28bb53384411c3df27352e4f3c5d353 [0,2,0,0,0,0|1,0,0]=3 3599 B12R1.1009 Cc1ccnc(c1OC(C)C)F 4fc14962a9d2d124d962cfb5bc9cf568 [0,2,0,0,0,0|1,0,0]=3 3600 B12R1.1009 Cc1nc[nH]c(=O)c1NC(C)C 7bc0c3a0947ec7be43b29bf1ec5747b4 [0,2,0,0,0,0|2,0,0]=4 3601 B12R1.1009 Cc1nccc(c1NC(C)C)Br 2dc63d44ad4e5791c3161919bfee748c [0,2,0,0,0,0|1,0,0]=3 3602 B12R1.1009 Cc1nccc(c1NC(C)C)Cl 8e72f12300e25b2c1b5f35b4681730ac [0,2,0,0,0,0|1,0,0]=3 3603 B12R1.1009 Cc1ncnc(c1NC(C)C)C deece0999760a012fced45b04cf6c0a9 [0,2,0,0,0,0|2,0,0]=4 3604 B12R1.1009 Cc1ncnc(c1NC(C)C)Cl 64999573df3e9afe477b555ccd8d056d [0,2,0,0,0,0|2,0,0]=4 3605 B12R1.1009 Cc1ncnc(c1OC(C)C)C 8d1c4156345d9a75ab97b2d518b0926a [0,2,0,0,0,0|2,0,0]=4 3606 B12R1.1009 Cc1occc(=O)c1OC(C)C 14a71400e5bc18abeb6638b0993d96ce [0,2,0,0,0,0|2,0,0]=4 3607 B12R1.1009 Cc1occc(=S)c1OC(C)C b485fd11518aac14dc5a36463ef65b9b [0,2,0,0,0,0|2,0,0]=4 3608 B12R1.101 CC(C)Nc1cc(cc(c1)Br)Br 3ec75cd22625baf94e716b0d86cec300 [0,2,0,0,0,0|2,0,0]=4 3609 B12R1.101 CC(C)Nc1cc(cc(c1)Br)Cl 4000e0ba3010bc7a9b59a076c918e4fd [0,2,0,0,0,0|2,0,0]=4 3610 B12R1.101 CC(C)Nc1cc(cc(c1)Br)F 7bb88c1d7736a3f9f70f144069492576 [0,2,0,0,0,0|2,0,0]=4 3611 B12R1.101 CC(C)Nc1cc(cc(c1)Cl)Cl f30a94ed8a0fce642490e684e5283c3a [0,2,0,0,0,0|2,0,0]=4 3612 B12R1.101 CC(C)Nc1cc(cc(c1)Cl)F bd95dee3047071a168f54fa29120d71b [0,2,0,0,0,0|2,0,0]=4 3613 B12R1.101 CC(C)Nc1cc(cc(c1)F)F 55335530e40935f80378a868789e33c9 [0,2,0,0,0,0|2,0,0]=4 3614 B12R1.101 CC(C)Nc1cc(cc(c1)I)Br dafe41b594a5491fc5f14521e072ece2 [0,2,0,0,0,0|2,0,0]=4 3615 B12R1.101 CC(C)Nc1cc(cc(c1)I)Cl 21b26717636f04298c3157f92147fe12 [0,2,0,0,0,0|2,0,0]=4 3616 B12R1.101 CC(C)Nc1cc(cc(c1)I)F c3ab045b7c0d8d709f86243b63b24e41 [0,2,0,0,0,0|2,0,0]=4 3617 B12R1.101 CC(C)Nc1cc(cc(c1)I)I 067de7ee82d5d74159693c0599cce6c0 [0,2,0,0,0,0|2,0,0]=4 3618 B12R1.101 CC(C)Oc1cc(cc(c1)Br)Br 908a36ad040e083a32a0870e00ca5462 [0,2,0,0,0,0|2,0,0]=4 3619 B12R1.101 CC(C)Oc1cc(cc(c1)Br)Cl 90832d38f45494d9c534a27e70a33dab [0,2,0,0,0,0|2,0,0]=4 3620 B12R1.101 CC(C)Oc1cc(cc(c1)Br)F cc304cb852aa35b5ca8dc03183accb58 [0,2,0,0,0,0|2,0,0]=4 3621 B12R1.101 CC(C)Oc1cc(cc(c1)Cl)Cl 96cb338d5eaea2f32efef96d114d240a [0,2,0,0,0,0|2,0,0]=4 3622 B12R1.101 CC(C)Oc1cc(cc(c1)Cl)F 867bcb16d843f0bc98d5db4872f89328 [0,2,0,0,0,0|2,0,0]=4 3623 B12R1.101 CC(C)Oc1cc(cc(c1)F)F fd20f0814f72fd78fb4c03f50f7974a0 [0,2,0,0,0,0|2,0,0]=4 3624 B12R1.101 CC(C)Oc1cc(cc(c1)I)Br b82d1c7a023e0aeec9350380142ba167 [0,2,0,0,0,0|2,0,0]=4 3625 B12R1.101 CC(C)Oc1cc(cc(c1)I)Cl 40b7c52ad4fa29be1801a205eb0792a2 [0,2,0,0,0,0|2,0,0]=4 3626 B12R1.101 CC(C)Oc1cc(cc(c1)I)F 4b4513273e57ee4ce806790dfb79209b [0,2,0,0,0,0|2,0,0]=4 3627 B12R1.101 Cc1cc(cc(c1)NC(C)C)Br 885b9e61828ef2723175de94e6bd176b [0,2,0,0,0,0|2,0,0]=4 3628 B12R1.101 Cc1cc(cc(c1)NC(C)C)C ccc8ef4ab081b9a8f889f8a1174a230b [0,2,0,0,0,0|2,0,0]=4 3629 B12R1.101 Cc1cc(cc(c1)NC(C)C)Cl c2aff29ea5afc858a1c49f03bbc68cd0 [0,2,0,0,0,0|2,0,0]=4 3630 B12R1.101 Cc1cc(cc(c1)NC(C)C)F 15f06000c23ee02df2d873cadb899dbd [0,2,0,0,0,0|2,0,0]=4 3631 B12R1.101 Cc1cc(cc(c1)NC(C)C)I 6d29ab071cd1bea007d875602ad02d46 [0,2,0,0,0,0|2,0,0]=4 3632 B12R1.101 Cc1cc(cc(c1)OC(C)C)Br ac8af97887813bcbf58c5b92454bfdbb [0,2,0,0,0,0|2,0,0]=4 3633 B12R1.101 Cc1cc(cc(c1)OC(C)C)C bd8f6b107f52d68240d91e34be996788 [0,2,0,0,0,0|2,0,0]=4 3634 B12R1.101 Cc1cc(cc(c1)OC(C)C)Cl a64b4b8994146108dd2b4a21c188be33 [0,2,0,0,0,0|2,0,0]=4 3635 B12R1.101 Cc1cc(cc(c1)OC(C)C)F 314f83a9e2788f714312e7aa465ae3ff [0,2,0,0,0,0|2,0,0]=4 3636 B12R1.101 Cc1cc(cc(c1)OC(C)C)I ce8f72e0562a9ba1f13513f5d114bf95 [0,2,0,0,0,0|2,0,0]=4 3637 B12R1.119 CC(C)(C)Nc1cccc(c1)F 058f11174665294bc6a7120d8cf40fe3 [0,2,0,0,0,0|2,0,0]=4 3638 B12R1.119 CC(C)(C)Nc1cccc(c1)S ae373faa66a0562332ee24065ad1032d [0,2,0,0,0,0|2,0,0]=4 3639 B12R1.119 CC(C)(C)Nc1cncc(c1)F 4231d490601dbbc9473923789e5f5378 [0,2,0,0,0,0|1,0,0]=3 3640 B12R1.119 Cc1cccc(c1)NC(C)(C)C 62708c2bd281ff9df156c2aea8165c63 [0,2,0,0,0,0|2,0,0]=4 3641 B12R1.438 C#Cc1cccc(c1)NC(C)C 072249a3986c38fddcb6be0135aa07be [0,2,0,0,0,0|2,0,0]=4 3642 B12R1.438 C#Cc1cccc(c1)OC(C)C 99bebe74a0dec152fc399c49bf41ab27 [0,2,0,0,0,0|2,0,0]=4 3643 B12R1.438 C#Cc1cncc(c1)NC(C)C cf94347250c86fce5090720f1e9d8450 [0,2,0,0,0,0|1,0,0]=3 3644 B12R1.438 C#Cc1cncc(c1)OC(C)C f2ceb964d8c6ce518457b3056c372de1 [0,2,0,0,0,0|1,0,0]=3 3645 B12R1.438 C=Cc1cccc(c1)NC(C)C 44f99f3f736f8fbb53d56250eca6fc2d [0,2,0,0,0,0|2,0,0]=4 3646 B12R1.438 C=Cc1cccc(c1)OC(C)C aaa7ec7c9b22cec63f98cb575696cfc5 [0,2,0,0,0,0|2,0,0]=4 3647 B12R1.438 CC(C)Nc1cccc(c1)C#N 8e4d59a055e304d02518f03073200efa [0,2,0,0,0,0|2,0,0]=4 3648 B12R1.438 CC(C)Nc1cccc(c1)CBr 85c2d8585b2edbab393b973b1417bb53 [0,2,0,0,0,0|2,0,0]=4 3649 B12R1.438 CC(C)Nc1cccc(c1)CF dbd879566412fcd8363e57bef510c5f9 [0,2,0,0,0,0|2,0,0]=4 3650 B12R1.438 CC(C)Nc1cccc(c1)CO fc75fc740a569329c12318f6051b3a5e [0,2,0,0,0,0|2,0,0]=4 3651 B12R1.438 CC(C)Nc1cncc(c1)C#N 3f02f4e9032dd761f530e54c1219d38e [0,2,0,0,0,0|1,0,0]=3 3652 B12R1.438 CC(C)Nc1cncc(c1)CCl 1f4476734bc8f5057f6bab8dfa312006 [0,2,0,0,0,0|1,0,0]=3 3653 B12R1.438 CC(C)Nc1cncc(c1)CO eef8c2f4693dea60f6ef12e307ffbf9e [0,2,0,0,0,0|1,0,0]=3 3654 B12R1.438 CC(C)Nc1cncc(n1)C#N 6ddfc9698e55f250e73c7d52191b0ab4 [0,2,0,0,0,0|2,0,0]=4 3655 B12R1.438 CC(C)Nc1cncc(n1)CO 2afe3e2ef22d33608a64b558a951d09c [0,2,0,0,0,0|2,0,0]=4 3656 B12R1.438 CC(C)Oc1cccc(c1)C#N 6269a85c3b23b7ec14b55d094cbc5998 [0,2,0,0,0,0|2,0,0]=4 3657 B12R1.438 CC(C)Oc1cccc(c1)C=O 38c2027ae121387f1f4e344f65c26cff [0,2,0,0,0,0|2,0,0]=4 3658 B12R1.438 CC(C)Oc1cncc(c1)C#N e9584723d57c8c02d1994b3efd60ccaf [0,2,0,0,0,0|1,0,0]=3 3659 B12R1.438 CC(C)Oc1cncc(c1)C=O 1ec663b8482f5c3c01eeafba8f8c735a [0,2,0,0,0,0|1,0,0]=3 3660 B12R1.438 CCc1cccc(c1)NC(C)C 804632297f29fdf0a11162bd8c1b96e0 [0,2,0,0,0,0|2,0,0]=4 3661 B12R1.438 CCc1cccc(c1)OC(C)C 1563f98e02639576b92e8ec328eb6057 [0,2,0,0,0,0|2,0,0]=4 3662 B12R1.438 CCc1cncc(c1)NC(C)C 46fe3af434d2ad515eb9b28095758989 [0,2,0,0,0,0|1,0,0]=3 3663 B12R1.438 CCc1cncc(c1)OC(C)C e46257baa433559e3662d1f27ce24379 [0,2,0,0,0,0|1,0,0]=3 3664 B12R1.438 CCc1cncc(n1)OC(C)C b06fca753dd362e2c7293a753236929f [0,2,0,0,0,0|2,0,0]=4 3665 B12R1.438 CCc1cnnc(c1)OC(C)C b959c89271421a7de620b20fdc02b283 [0,2,0,0,0,0|2,0,0]=4 3666 B12R1.438 COc1cc(cnn1)NC(C)C 0171b2d30a7bcbc9d24a098251bad5e2 [0,2,0,0,0,0|2,0,0]=4 3667 B12R1.438 COc1cccc(c1)NC(C)C d213ee741fc293232afa2f08da10a83a [0,2,0,0,0,0|2,0,0]=4 3668 B12R1.438 COc1cccc(c1)OC(C)C 6f8c6ff1542b239a8405bb976aacd35e [0,2,0,0,0,0|2,0,0]=4 3669 B12R1.438 COc1cncc(c1)NC(C)C fb8f15e955189c9675a4b71dff540463 [0,2,0,0,0,0|1,0,0]=3 3670 B12R1.438 COc1cncc(c1)OC(C)C ad328f88c3266fc2415f07e263541b4f [0,2,0,0,0,0|1,0,0]=3 3671 B12R1.438 COc1cnnc(c1)NC(C)C c807cbae14afb4b93f61cf292e03d50e [0,2,0,0,0,0|2,0,0]=4 3672 B12R1.438 CSc1cccc(c1)NC(C)C 192603825632b8fee2c0c2a3ef649c93 [0,2,0,0,0,0|2,0,0]=4 3673 B12R1.438 CSc1cccc(c1)OC(C)C ad3aec57a579c1784e039ccebe1884c0 [0,2,0,0,0,0|2,0,0]=4 3674 B12R1.438 CSc1cncc(c1)OC(C)C 5a8e061b160d5bd9396fc7c6796cf902 [0,2,0,0,0,0|1,0,0]=3 3675 B10R1.66 CC(C)CNc1cc[nH]n1 d30f3d9f735de26e6dfb045fd907401f [0,0,1,1,0,0|2,0,0]=4 3676 B10R1.66 CC(C)CNc1cccs1 67dcb3c9cca955e96d2162e1f77ad9d3 [0,0,1,1,0,0|2,0,0]=4 3677 B10R1.66 CC(C)CNc1ccno1 d420346ba8917b35352d6152b17bb83c [0,0,1,1,0,0|2,0,0]=4 3678 B10R1.66 CC(C)CNc1ccns1 2b5f6f1887d9e5decd9620245fa92d0f [0,0,1,1,0,0|2,0,0]=4 3679 B10R1.66 CC(C)CNc1ccoc1 92d7f688a6d1f51c3400fe3a15833da1 [0,0,1,1,0,0|2,0,0]=4 3680 B10R1.66 CC(C)CNc1ccon1 603a476ab3e5d06007016561080e4211 [0,0,1,1,0,0|2,0,0]=4 3681 B10R1.66 CC(C)CNc1ccsc1 7cc22761b2fabc54b5196a591e8fc4c9 [0,0,1,1,0,0|2,0,0]=4 3682 B10R1.66 CC(C)CNc1cn[nH]c1 fcd3baf95446f9bb175849d10b60a021 [0,0,1,1,0,0|2,0,0]=4 3683 B10R1.66 CC(C)CNc1cncs1 1675bf6cd829f5bf1a63ea5f5545bb1e [0,0,1,1,0,0|2,0,0]=4 3684 B10R1.66 CC(C)CNc1cnoc1 08e57a722de5cccca3cdae311c1ec6ed [0,0,1,1,0,0|2,0,0]=4 3685 B10R1.66 CC(C)CNc1cnsc1 c2cc689c1fcead83502813ee1d628e42 [0,0,1,1,0,0|2,0,0]=4 3686 B10R1.66 CC(C)CNc1cocn1 45ddbb9a7109368c0c6340d68958763c [0,0,1,1,0,0|2,0,0]=4 3687 B10R1.66 CC(C)CNc1cscn1 84a1d8bf5382cf239191c71ffc20e506 [0,0,1,1,0,0|2,0,0]=4 3688 B10R1.66 CC(C)CNc1ncc[nH]1 9831b6d9d33420b283b5239da94f05d7 [0,0,1,1,0,0|2,0,0]=4 3689 B10R1.66 CC(C)CNc1ncco1 8259e209777df60cb7a7ca8861c36e93 [0,0,1,1,0,0|2,0,0]=4 3690 B10R1.66 CC(C)CNc1nccs1 57d5b8e82d624238ba5df3d643c93ee0 [0,0,1,1,0,0|2,0,0]=4 3691 B10R1.66 CC(C)COc1c[nH]cn1 5a6a70e59cd27d2b7c499cd9ff765ea7 [0,0,1,1,0,0|2,0,0]=4 3692 B10R1.66 CC(C)COc1ccco1 9a23c54afcd88900faea26a95d44c122 [0,0,1,1,0,0|2,0,0]=4 3693 B10R1.66 CC(C)COc1cccs1 c3a2875732f90e39bc97fc0388c7ee98 [0,0,1,1,0,0|2,0,0]=4 3694 B10R1.66 CC(C)COc1ccn[nH]1 3d6e15f86279d1facf6c68f6a20710c7 [0,0,1,1,0,0|2,0,0]=4 3695 B10R1.66 CC(C)COc1ccsc1 374674527614a256faaff2fdb87d8e4a [0,0,1,1,0,0|2,0,0]=4 3696 B10R1.66 CC(C)COc1cn[nH]c1 affea68a248bf5dd8e9c2ab0f2b9e419 [0,0,1,1,0,0|2,0,0]=4 3697 B10R1.66 CC(C)COc1cnoc1 ac433910e62eb771c55b92bcee4ae870 [0,0,1,1,0,0|2,0,0]=4 3698 B10R1.66 CC(C)COc1nccs1 c7d517a6b08e547f6b5f0267e322a342 [0,0,1,1,0,0|2,0,0]=4 3699 B10R1.66 CC(C)COn1cccn1 f2ab86970e2e625f8da0ffe6fabf186c [0,0,1,1,0,0|2,0,0]=4 3700 B10R1.66 CC(C)COn1ccnc1 43f98893080b348e71bd2ae253eb374e [0,0,1,1,0,0|2,0,0]=4 3701 B10R2.193 c1cc([nH]n1)OC2CC2 ce03683572f15826c7eaee83ed462b4f [0,0,0,1,1,0|2,0,0]=4 3702 B10R2.193 c1cc(co1)NC2CC2 6731c2251f866d9ad88bd656e4844633 [0,0,0,1,1,0|2,0,0]=4 3703 B10R2.193 c1cc(cs1)NC2CC2 fd6df036eb088cb3033620ead481a627 [0,0,0,1,1,0|2,0,0]=4 3704 B10R2.193 c1cc(cs1)OC2CC2 108cdba10863c72d0f5f9a0606e43b33 [0,0,0,1,1,0|2,0,0]=4 3705 B10R2.193 c1cc(n[nH]1)NC2CC2 c68a8c08457d5cc65e21655dd756f18f [0,0,0,1,1,0|2,0,0]=4 3706 B10R2.193 c1cc(sn1)NC2CC2 8cf82130360e591a9a7c3cb28260c3c2 [0,0,0,1,1,0|2,0,0]=4 3707 B10R2.193 c1cn(cn1)OC2CC2 95abc55bf8977048109cd3ec6c15b713 [0,0,0,1,1,0|2,0,0]=4 3708 B10R2.193 c1cnn(c1)OC2CC2 8b02ba4478bdf77c8683425e5984a0f0 [0,0,0,1,1,0|2,0,0]=4 3709 B10R2.193 c1coc(c1)OC2CC2 8985027cbca38de40f7977ffc4fa9731 [0,0,0,1,1,0|2,0,0]=4 3710 B10R2.193 c1coc(n1)NC2CC2 3ac008138901a81cc9d1e786fff3438e [0,0,0,1,1,0|2,0,0]=4 3711 B10R2.193 c1csc(n1)NC2CC2 8b25791cb25d86e962191a5c0fa30087 [0,0,0,1,1,0|2,0,0]=4 3712 B10R2.193 c1n[nH]cc1OC2CC2 41b64cbe3c964d084947da520a60d7ab [0,0,0,1,1,0|2,0,0]=4 3713 B10R2.193 c1nc(c[nH]1)OC2CC2 7b8d58aef1c8875bcc52347aadcfdd89 [0,0,0,1,1,0|2,0,0]=4 3714 B10R2.193 c1nocc1NC2CC2 670a5dffbc9f0a135e1a1e238a3f44e2 [0,0,0,1,1,0|2,0,0]=4 3715 B10R2.193 c1nocc1OC2CC2 0fa0acc27a9afec6c1cb8e2de576f704 [0,0,0,1,1,0|2,0,0]=4 3716 B10R2.193 c1nscc1NC2CC2 f342a26687fa8a01a6f336a3aec097cc [0,0,0,1,1,0|2,0,0]=4 3717 B12R2.11 CC1CC1Nc2ccccc2 6c2b1ed9451679c2c2b0f3748602bd6d [0,0,0,1,0,1|1,0,0]=3 3718 B12R2.11 CC1CC1Nc2cccnc2 e0f55178f08b4b2b54d9d876d97d2290 [0,0,0,1,0,1|0,0,0]=2 3719 B12R2.11 F[C@@H]1C[C@@H]1Nc2ccccc2 25c07123a823d9ea2969aff7da72cef4 [0,0,0,1,0,1|2,0,0]=4 3720 B12R2.11 F[C@@H]1C[C@@H]1Nc2cccnc2 9a55f17e12e7bd55a0d9204d46e602d2 [0,0,0,1,0,1|1,0,0]=3 3721 B12R2.11 F[C@@H]1C[C@@H]1Nc2cnccn2 17ad0f6a412e18d1388640b2dd918d1e [0,0,0,1,0,1|2,0,0]=4 3722 B12R2.11 F[C@@H]1C[C@H]1Nc2ccccc2 b0efbced164dabbe532e6255951097b4 [0,0,0,1,0,1|2,0,0]=4 3723 B12R2.11 F[C@@H]1C[C@H]1Nc2cccnc2 0d6be40ecda6b776d8730416c6199b26 [0,0,0,1,0,1|1,0,0]=3 3724 B12R2.11 F[C@@H]1C[C@H]1Nc2cnccn2 847448d513daab96512baf4a4956cf38 [0,0,0,1,0,1|2,0,0]=4 3725 B12R2.11 F[C@H]1C[C@@H]1Nc2ccccc2 e610ffc6a467ed241d6c7f91606b201b [0,0,0,1,0,1|2,0,0]=4 3726 B12R2.11 F[C@H]1C[C@@H]1Nc2cccnc2 8475542138490fb913b76b598d12ad5e [0,0,0,1,0,1|1,0,0]=3 3727 B12R2.11 F[C@H]1C[C@@H]1Nc2cnccn2 0f117c1c77e8c296447cda49159d8ccc [0,0,0,1,0,1|2,0,0]=4 3728 B12R2.2057 c1cc(ccn1)COC2CC2 da3247f4bbaea1ae4c65fbee8045d76d [0,0,0,1,0,1|2,0,0]=4 3729 B12R2.2057 c1cc(ccn1)NCC2CC2 849918da92a0c0498a218bfd0f4ee058 [0,0,0,1,0,1|2,0,0]=4 3730 B12R2.2057 c1cc(ccn1)OCC2CC2 c00853e2b14f5a610ec89d61eadf6a66 [0,0,0,1,0,1|2,0,0]=4 3731 B12R2.2057 c1cc(cnn1)CNC2CC2 1484f36ca419b7b204a1eaa6e6af3c25 [0,0,0,1,0,1|1,0,0]=3 3732 B12R2.2057 c1cc(cnn1)COC2CC2 18fada06023a50715c3f206fdf8364eb [0,0,0,1,0,1|1,0,0]=3 3733 B12R2.2057 c1cc(cnn1)NCC2CC2 8901432212af77fb897e9d7c1d8669c0 [0,0,0,1,0,1|1,0,0]=3 3734 B12R2.2057 c1cc(cnn1)OCC2CC2 26520dc87c12851a0d2f40463006660e [0,0,0,1,0,1|1,0,0]=3 3735 B12R2.2057 c1ccc(cc1)CNC2CC2 0722218fcfefdcb8b8f0e8dc60326858 [0,0,0,1,0,1|1,0,0]=3 3736 B12R2.2057 c1ccc(cc1)COC2CC2 4f6efb1abdd284b3ec5fbe724b10a332 [0,0,0,1,0,1|1,0,0]=3 3737 B12R2.2057 c1ccc(cc1)NCC2CC2 14003b7d6af1ed476ecb017534f042ad [0,0,0,1,0,1|1,0,0]=3 3738 B12R2.2057 c1ccc(nc1)CNC2CC2 072625a4614190be9cbf10388fa5861b [0,0,0,1,0,1|2,0,0]=4 3739 B12R2.2057 c1ccc(nc1)COC2CC2 abde439d2a0ddaaa61aa7afca3b1da4d [0,0,0,1,0,1|2,0,0]=4 3740 B12R2.2057 c1ccc(nc1)NCC2CC2 a4bb220accadbaa000279249a4daf5cf [0,0,0,1,0,1|2,0,0]=4 3741 B12R2.2057 c1ccc(nc1)OCC2CC2 05ede210d3ae4cc4a2c3f7154d855ada [0,0,0,1,0,1|2,0,0]=4 3742 B12R2.2057 c1cnc(cn1)COC2CC2 fdc47d726f6cd28e1efa561853273f47 [0,0,0,1,0,1|1,0,0]=3 3743 B12R2.2057 c1cnc(cn1)NCC2CC2 a6ff6ae7eefb0681b8e64d1d299083be [0,0,0,1,0,1|1,0,0]=3 3744 B12R2.2057 c1cnc(cn1)OCC2CC2 b2726dc332261b3161c83cefeba4125b [0,0,0,1,0,1|1,0,0]=3 3745 B12R2.2057 c1cnc(nn1)NCC2CC2 84d7ab3aedeb6ea313ccfe6bcb7dc29e [0,0,0,1,0,1|2,0,0]=4 3746 B12R2.2057 c1cncc(c1)CNC2CC2 de74061854556603c3b7f6c7b31bcca1 [0,0,0,1,0,1|0,0,0]=2 3747 B12R2.2057 c1cncc(c1)COC2CC2 4f1f4bbe9c5cccaf786a2469b1a1b939 [0,0,0,1,0,1|0,0,0]=2 3748 B12R2.2057 c1cncc(c1)NCC2CC2 116af6c2af65d4c96c0cfbf27938bace [0,0,0,1,0,1|0,0,0]=2 3749 B12R2.2057 c1cncc(c1)OCC2CC2 6e3515b4fef3884dcd9b31bc8938b0e1 [0,0,0,1,0,1|0,0,0]=2 3750 B12R2.2057 c1cnnc(c1)CNC2CC2 514c968ed269ecf84ec95620d443c6f3 [0,0,0,1,0,1|1,0,0]=3 3751 B12R2.2057 c1cnnc(c1)COC2CC2 5647e20affbc8a5d9e818133ea4a6290 [0,0,0,1,0,1|1,0,0]=3 3752 B12R2.2057 c1cnnc(c1)NCC2CC2 fd86c67f390e8038e0981f3804df0169 [0,0,0,1,0,1|1,0,0]=3 3753 B12R2.2057 c1ncc(cn1)CNC2CC2 fc59c8df262b31da217a1e644ed7db26 [0,0,0,1,0,1|1,0,0]=3 3754 B12R2.2057 c1ncc(cn1)COC2CC2 8a5f17aaf736ed02e3fc96b2c1377b07 [0,0,0,1,0,1|1,0,0]=3 3755 B12R2.2057 c1ncc(cn1)NCC2CC2 00feae471e768555afc958c0335cbe4b [0,0,0,1,0,1|1,0,0]=3 3756 B12R2.2057 c1ncc(cn1)OCC2CC2 64adeb1eb0d558ed55a405fd3b5d8be4 [0,0,0,1,0,1|1,0,0]=3 3757 B12R2.2057 c1nncc(n1)NCC2CC2 e4d7b52d075c0e4498614f6f085ad3ff [0,0,0,1,0,1|2,0,0]=4 3758 B12R2.294 Clc1ccc(cn1)OC2CC2 28455e4f6c7ff578720b6b78d9388738 [0,1,0,1,0,0|1,0,0]=3 3759 B12R2.294 Clc1ncc(cn1)NC2CC2 438475d285a100905ad3b4d98b9464f2 [0,1,0,1,0,0|2,0,0]=4 3760 B12R2.294 Clc1ncc(cn1)OC2CC2 bcb49a8a76f6f9d1434e23eba5a4fd41 [0,1,0,1,0,0|2,0,0]=4 3761 B12R2.294 Fc1ccc(cn1)OC2CC2 daf55823bec2955c7b3c6d9e81d39941 [0,1,0,1,0,0|1,0,0]=3 3762 B12R2.294 O=c1ccc(c[nH]1)NC2CC2 33be8a87d3f12fed44c542b3313058ad [0,1,0,1,0,0|1,0,1]=4 3763 B12R2.294 Sc1ccc(cc1)NC2CC2 0824eade139ba6c64308f26ae03b3bd0 [0,1,0,1,0,0|2,0,0]=4 3764 B12R2.27 CCN1CC1c2ccccc2 9688627107d4117581407497e721ccee [0,1,0,1,0,0|2,0,0]=4 3765 B12R2.27 CCN1C[C@@H]1c2ccccc2 c32dec6f3160b9b7bc8c2839caf72878 [0,1,0,1,0,0|2,0,0]=4 3766 B12R2.27 FCN1CC1c2ccccc2 961cd8c1338ecdce6a27ac300fedcc98 [0,1,0,1,0,0|2,0,0]=4 3767 B12R2.27 FCN1C[C@@H]1c2ccccc2 186c23a739812eaa2456c8641683ea36 [0,1,0,1,0,0|2,0,0]=4 3768 B12R2.27 OCN1CC1c2ccccc2 380946bf56a518a4f82b6f06607820f1 [0,1,0,1,0,0|2,0,0]=4 3769 B12R2.27 OCN1C[C@@H]1c2ccccc2 b0131158d23691f2ccd2899d00b705c5 [0,1,0,1,0,0|2,0,0]=4 3770 B12R2.32 CCN1Cc2ccccc2C1 20c2942768350a956e6d394a0b65e9b5 [0,1,0,1,0,0|2,0,0]=4 3771 B12R2.32 CCN1Cc2cccnc2C1 8eff7749ade43972deb21bf7f1c49138 [0,1,0,1,0,0|1,0,0]=3 3772 B12R2.32 CCN1Cc2ccncc2C1 3498f74c96ad10f548bc294c683604ea [0,1,0,1,0,0|1,0,0]=3 3773 B12R2.32 CCN1Cc2cncnc2C1 5992e52c291f7214513af80f9a4ae380 [0,1,0,1,0,0|2,0,0]=4 3774 B12R2.32 CCN1Cc2nccnc2C1 7e1bde9eaf2aacfd11ebe950511b0ec1 [0,1,0,1,0,0|2,0,0]=4 3775 B12R2.32 FCN1Cc2ccccc2C1 6ebe33568e88966b195306172afa5c83 [0,1,0,1,0,0|2,0,0]=4 3776 B12R2.32 FCN1Cc2cccnc2C1 2d880692ffc481b82e38df7d112397d9 [0,1,0,1,0,0|1,0,0]=3 3777 B12R2.32 FCN1Cc2ccncc2C1 139a9c2958a7b2bcb0dab1092f4edc9f [0,1,0,1,0,0|1,0,0]=3 3778 B12R2.32 FCN1Cc2cncnc2C1 6f81bca9b90354a2d858b15e65690fdd [0,1,0,1,0,0|2,0,0]=4 3779 B12R2.32 FCN1Cc2nccnc2C1 d5c461b714be198b9aaff058023ae0da [0,1,0,1,0,0|2,0,0]=4 3780 B12R2.32 O=CN1Cc2cccnc2C1 1f4bf6851ed9c560f3b39735c49c0112 [0,1,0,1,0,0|1,0,1]=4 3781 B12R2.32 O=CN1Cc2ccncc2C1 43ab0b1c2e4ed932b475d0c7eeb96d13 [0,1,0,1,0,0|1,0,1]=4 3782 B12R2.32 OCN1Cc2ccccc2C1 67d53a903b838c41ecebb3a336e33160 [0,1,0,1,0,0|2,0,0]=4 3783 B12R2.32 OCN1Cc2cccnc2C1 95b006eb218084c5021f92d2645268ce [0,1,0,1,0,0|1,0,0]=3 3784 B12R2.32 OCN1Cc2ccncc2C1 c230a7a6f54e7188e3946b67f3c03eeb [0,1,0,1,0,0|1,0,0]=3 3785 B12R2.32 OCN1Cc2cncnc2C1 fc95805bc891489dfc958be063609278 [0,1,0,1,0,0|2,0,0]=4 3786 B12R2.32 OCN1Cc2nccnc2C1 8939ea4fb517c440e20ab117fa53e1de [0,1,0,1,0,0|2,0,0]=4 3787 B12R2.94 CC1(CC1)Nc2cccnc2 7578bbb55e576acda721e7cce0ab0877 [0,1,0,1,0,0|1,0,0]=3 3788 B12R2.2058 c1cc(cnn1)NC2CCC2 17b5b44351c51eca0c80de5a3abf6ee4 [0,1,0,1,0,0|2,0,0]=4 3789 B12R2.2058 c1cc(cnn1)NC2COC2 832de64a070e45283ca4c8c704290819 [0,1,0,1,0,0|2,0,0]=4 3790 B12R2.2058 c1cc(cnn1)OC2CCC2 f241dac5b2e23a2b3c77241e6ccd43d1 [0,1,0,1,0,0|2,0,0]=4 3791 B12R2.2058 c1cc(cnn1)OC2COC2 1cdf19e114e99f8966fbb5da824c5c85 [0,1,0,1,0,0|2,0,0]=4 3792 B12R2.2058 c1ccc(cc1)CN2CCC2 79f0a156a4476249fe3e90dbe2fa6274 [0,1,0,1,0,0|2,0,0]=4 3793 B12R2.2058 c1ccc(cc1)NC2COC2 638d2081ed3e07246cd09300ecb8f6dc [0,1,0,1,0,0|2,0,0]=4 3794 B12R2.2058 c1cnc(cn1)NC2CCC2 44336cb13f75395d2c0705f2ea1af01f [0,1,0,1,0,0|2,0,0]=4 3795 B12R2.2058 c1cncc(c1)CN2CCC2 b1361fa162d89a1875554b0e74a89d35 [0,1,0,1,0,0|1,0,0]=3 3796 B12R2.2058 c1cncc(c1)NC2CCC2 dd91e6f1e99e09367d72a057d00ff1a5 [0,1,0,1,0,0|1,0,0]=3 3797 B12R2.2058 c1cncc(c1)NC2COC2 2aae7bd2fd3ce1179be00cfde2c027d7 [0,1,0,1,0,0|1,0,0]=3 3798 B12R2.2058 c1cncc(c1)OC2CCC2 7a6fdcb9cb0be6f7ba06c65562ff0c48 [0,1,0,1,0,0|1,0,0]=3 3799 B12R2.2058 c1cncc(c1)OC2COC2 a8dd711f09c8c96411b2f1503a563f21 [0,1,0,1,0,0|1,0,0]=3 3800 B12R2.2058 c1cnnc(c1)CN2CCC2 6ffec972d2f9ac52f4eceae0deced11c [0,1,0,1,0,0|2,0,0]=4 3801 B12R2.2058 c1ncc(cn1)CN2CCC2 3b29f8e552d1f90fa8b65a5a571ae9d0 [0,1,0,1,0,0|2,0,0]=4 3802 B12R2.225 Brc1ncccc1OC2CC2 3f469fbe1e71b7986e4cb9fec40ce7b9 [0,1,0,1,0,0|1,0,0]=3 3803 B12R2.225 Brc1nccnc1OC2CC2 89b9e53b010138744352f76f7211fd00 [0,1,0,1,0,0|2,0,0]=4 3804 B12R2.225 Cc1ccnnc1OC2CC2 4bddfb583d6938a17292f68a70ecda33 [0,1,0,1,0,0|2,0,0]=4 3805 B12R2.225 Clc1ccccc1OC2CC2 a4bab8f7130a623ddfe359429eb2845e [0,1,0,1,0,0|2,0,0]=4 3806 B12R2.225 Clc1nccnc1NC2CC2 96c35c539eb694298491bab562821218 [0,1,0,1,0,0|2,0,0]=4 3807 B12R2.225 Ic1ccnnc1OC2CC2 072adf1a765faa8636820ab082a08bab [0,1,0,1,0,0|2,0,0]=4 3808 B12R2.225 Ic1ncccc1OC2CC2 3b26f13282054f6b903f3ca94f0a8ced [0,1,0,1,0,0|1,0,0]=3 3809 B12R2.225 O=c1cc[nH]cc1NC2CC2 62357ec54cf085a0af17c2d6579f3c13 [0,1,0,1,0,0|1,0,1]=4 3810 B12R2.225 O=c1ccocc1OC2CC2 e227e1b9ebfd18d63a3e9500766959b7 [0,1,0,1,0,0|2,0,0]=4 3811 B12R2.1286 Brc1cccc(c1)OC2CC2 86a1316c992baf3081c1c927bc09a287 [0,1,0,1,0,0|2,0,0]=4 3812 B12R2.1286 Cc1cccc(c1)NC2CC2 5416fc1bda4e7fcd886b594e4b5d1c15 [0,1,0,1,0,0|2,0,0]=4 3813 B12R2.1286 Cc1cccc(c1)OC2CC2 c5e41ef21eaec44bf0109887340004b0 [0,1,0,1,0,0|2,0,0]=4 3814 B12R2.1286 Clc1cccc(c1)NC2CC2 da0b3d09a41ad9d3b62eef57d7091303 [0,1,0,1,0,0|2,0,0]=4 3815 B12R2.1286 Clc1cccc(c1)OC2CC2 3517e32596ee199dca8f3a8989d328df [0,1,0,1,0,0|2,0,0]=4 3816 B12R2.1286 Clc1cncc(c1)NC2CC2 be14770f6cf1e24ece1016203fee9186 [0,1,0,1,0,0|1,0,0]=3 3817 B12R2.1286 Fc1cccc(c1)NC2CC2 f9cd48a2521ccf98e9a7217233e95127 [0,1,0,1,0,0|2,0,0]=4 3818 B12R2.1286 Fc1cccc(c1)OC2CC2 fd5bcec64f0f04cfa2f0c44c0567737a [0,1,0,1,0,0|2,0,0]=4 3819 B12R2.1286 Fc1cncc(c1)NC2CC2 f621da5d4e70406c889de05f0794e0e0 [0,1,0,1,0,0|1,0,0]=3 3820 B12R2.1286 Ic1cccc(c1)OC2CC2 c806530f93f705072682a29e36637503 [0,1,0,1,0,0|2,0,0]=4 3821 B12R2.1286 Ic1cncc(c1)NC2CC2 be81df06baf063d77041c9224e0f23e3 [0,1,0,1,0,0|1,0,0]=3 3822 B12R2.1286 Ic1cncc(c1)OC2CC2 ab658ce51f422ba768ed6884440f8a54 [0,1,0,1,0,0|1,0,0]=3 3823 B12R2.1286 O=c1cc(cn[nH]1)NC2CC2 225c514c178614c742924b4d01fd6277 [0,1,0,1,0,0|2,0,0]=4 3824 B12R2.1286 Sc1cccc(c1)OC2CC2 5fb16c6390673deaae2d1fc21856fb80 [0,1,0,1,0,0|2,0,0]=4 3825 B8R1.8 CCNc1cc[nH]n1 1ec90843b0b722deac22a6d0b9230c30 [1,0,0,0,1,0|2,0,0]=4 3826 B8R1.8 CCNc1cccs1 f92887221cdfe270aa88f70a5b6538c3 [1,0,0,0,1,0|2,0,0]=4 3827 B8R1.8 CCNc1ccno1 c991bcc5829788fabf092ecd54bd220e [1,0,0,0,1,0|2,0,0]=4 3828 B8R1.8 CCNc1ccns1 2d79a3b4135a06a1b489318190c2601d [1,0,0,0,1,0|2,0,0]=4 3829 B8R1.8 CCNc1ccon1 1b2b81379cbfa300ef6ff7f035534561 [1,0,0,0,1,0|2,0,0]=4 3830 B8R1.8 CCNc1ccsc1 cda8850b0edc8792e319ed7aad994bf3 [1,0,0,0,1,0|2,0,0]=4 3831 B8R1.8 CCNc1cn[nH]c1 b1c09f867de50b2a6691b568cd573581 [1,0,0,0,1,0|2,0,0]=4 3832 B8R1.8 CCNc1cncs1 caf47a09a037d51cb6d8de3ed1ef2cd8 [1,0,0,0,1,0|2,0,0]=4 3833 B8R1.8 CCNc1cnoc1 7ede5cefbf1003e34ed87f516c2c1282 [1,0,0,0,1,0|2,0,0]=4 3834 B8R1.8 CCNc1cnsc1 b83999fdcaeb46b261fae566a1d2013d [1,0,0,0,1,0|2,0,0]=4 3835 B8R1.8 CCNc1cocn1 d8e901dc9f64240d769713656ef981d4 [1,0,0,0,1,0|2,0,0]=4 3836 B8R1.8 CCNc1cscn1 deb4d5205f2d6ad6b5aceaad6dba2646 [1,0,0,0,1,0|2,0,0]=4 3837 B8R1.8 CCNc1ncc[nH]1 9c694d8670fe0b12710364903a725787 [1,0,0,0,1,0|2,0,0]=4 3838 B8R1.8 CCNc1ncco1 9fef4809a1ac3d1c666a8faacb65e06b [1,0,0,0,1,0|2,0,0]=4 3839 B8R1.8 CCNc1nccs1 80b16777a8c3f760bbf265ac2cdb6521 [1,0,0,0,1,0|2,0,0]=4 3840 B8R1.8 CCOc1c[nH]cn1 5a57d5d014ff5f703d52daf8ebbbcbe1 [1,0,0,0,1,0|2,0,0]=4 3841 B8R1.8 CCOc1ccco1 e09af78840aa7c50339c3ce236ba2f4c [1,0,0,0,1,0|2,0,0]=4 3842 B8R1.8 CCOc1cccs1 d21292a98c2ee3c1ea9b8b00e074b6ef [1,0,0,0,1,0|2,0,0]=4 3843 B8R1.8 CCOc1ccn[nH]1 945a2fb7b2311859d19fa2575122eac5 [1,0,0,0,1,0|2,0,0]=4 3844 B8R1.8 CCOc1ccsc1 e97ca04b8e5d46ec67b2ebe625463cd4 [1,0,0,0,1,0|2,0,0]=4 3845 B8R1.8 CCOc1cn[nH]c1 52d616a1a3f747120e4f737d6e118b37 [1,0,0,0,1,0|2,0,0]=4 3846 B8R1.8 CCOc1cnoc1 71780b3f37fd1dd55c042a85806d3464 [1,0,0,0,1,0|2,0,0]=4 3847 B8R1.8 CCOc1nccs1 c7bf9113a012f962fcb198e0f8e767fe [1,0,0,0,1,0|2,0,0]=4 3848 B8R1.8 CCOn1cccn1 770cadc5246353a2a295ab96e14141ca [1,0,0,0,1,0|2,0,0]=4 3849 B8R1.8 CCOn1ccnc1 921caec73394249c90584a8e262f5331 [1,0,0,0,1,0|2,0,0]=4 3850 B12R1.252 C/C(=C/CNc1cccnc1)/I e46e99bdcfb10d6a6a48df5bc3ed1bbd [0,0,0,0,0,2|1,0,1]=4 3851 B12R1.252 C/C(=C/COc1cccnc1)/I 1b70c4c9ebd9f9aad4d82171c8f9887a [0,0,0,0,0,2|1,0,1]=4 3852 B12R1.252 C/C(=C\CNc1cccnc1)/Cl 831f274c0937e57a49958180bce06e0f [0,0,0,0,0,2|1,0,1]=4 3853 B12R1.252 C/C(=C\COc1cccnc1)/Cl 7cbe4a627fa2e592c136ed8cd70e95f8 [0,0,0,0,0,2|1,0,1]=4 3854 B12R1.252 C=C(C)CCNc1cccnc1 dcc89e34d299a787ec22fb495cec5588 [0,0,0,0,0,2|0,0,2]=4 3855 B12R1.252 C=C(C)CCOc1cccnc1 d43cc30ba2b0fd5d44c99c3588da0768 [0,0,0,0,0,2|0,0,2]=4 3856 B12R1.252 C=C(C)CNCc1cccnc1 192e89945e3f944c819998a53866b100 [0,0,0,0,0,2|0,0,2]=4 3857 B12R1.252 C=C(C)COCc1cccnc1 b1309dd5e0e34a6f1f94f4da7e73dca6 [0,0,0,0,0,2|0,0,2]=4 3858 B12R1.252 CC(=CCNc1ccccc1)C eb01c4541faf3d2e0c0e5ab3c7071819 [0,0,0,0,0,2|1,0,1]=4 3859 B12R1.252 CC(=CCNc1cccnc1)C ef307f73c413cbc7408c24c61f6eac1f [0,0,0,0,0,2|0,0,1]=3 3860 B12R1.252 CC(=CCNc1cccnc1)Cl a60fdbf1597e18de92ee73ecea3f07c3 [0,0,0,0,0,2|1,0,1]=4 3861 B12R1.252 CC(=CCNc1cccnc1)I 45be3207bdd9c4f36ea717ac038d2744 [0,0,0,0,0,2|1,0,1]=4 3862 B12R1.252 CC(=CCNc1cccnn1)C 05cd92fe72daa192af1c1629c0ba469f [0,0,0,0,0,2|1,0,1]=4 3863 B12R1.252 CC(=CCNc1ccnnc1)C c04f45204d21996b70876ac1cd2849f3 [0,0,0,0,0,2|1,0,1]=4 3864 B12R1.252 CC(=CCNc1cnccn1)C a6a45cf44a8dfb07f364345c191f2260 [0,0,0,0,0,2|1,0,1]=4 3865 B12R1.252 CC(=CCNc1cncnc1)C 5f05c773f4dc65c6ed62216e6139a3f7 [0,0,0,0,0,2|1,0,1]=4 3866 B12R1.252 CC(=CCOc1cccnc1)C 979e5f53d6cea52698942999cfcc260c [0,0,0,0,0,2|0,0,1]=3 3867 B12R1.252 CC(=CCOc1cccnc1)Cl 664730f2f6f0379895667f09b04e79c5 [0,0,0,0,0,2|1,0,1]=4 3868 B12R1.252 CC(=CCOc1cccnc1)I d8bc6c51e20bfb0f29479ce751a96ac8 [0,0,0,0,0,2|1,0,1]=4 3869 B12R1.252 CC(=CCOc1ccnnc1)C bd182d3d0d143f852d5a6b13df20364d [0,0,0,0,0,2|1,0,1]=4 3870 B12R1.252 CC(=CCOc1cnccn1)C 823470a3be6eead9fe26a9645b6fc2da [0,0,0,0,0,2|1,0,1]=4 3871 B12R1.252 CC(=CCOc1cncnc1)C 3abc54d1beb0d6a98ea02e37470c14ea [0,0,0,0,0,2|1,0,1]=4 3872 B12R1.252 CC(=O)CCNc1cccnc1 d55d133f13b833b5bf8507a979c71c53 [0,0,0,0,0,2|1,0,1]=4 3873 B12R1.252 CC(=O)CCOc1cccnc1 67dae2709723517ab5af883d0837054b [0,0,0,0,0,2|1,0,1]=4 3874 B12R1.252 CC(=O)CNCc1cccnc1 39d89333d7252b4434a1fdfd17a4d718 [0,0,0,0,0,2|1,0,1]=4 3875 B12R1.252 CC(=O)COCc1cccnc1 36638c01e0a61511be9d007508b97b48 [0,0,0,0,0,2|1,0,1]=4 3876 B12R1.252 CC(=O)NCCc1cccnc1 3962e9654ba13e9ef1bdd3c037e7deff [0,0,0,0,0,2|1,0,1]=4 3877 B12R1.252 CC(=O)OCNc1cccnc1 4178bffb832b0edcfc9121cf9bba84c2 [0,0,0,0,0,2|1,0,1]=4 3878 B12R1.252 CC(=O)OCOc1cccnc1 276102d131e97a552c86e2e9163e6724 [0,0,0,0,0,2|1,0,1]=4 3879 B12R1.252 CC(C)CCNc1ccccc1 a9665cd268e7b4518a4ee939be46ff28 [0,0,0,0,0,2|1,0,0]=3 3880 B12R1.252 CC(C)CCNc1ccccn1 5b6942b64e33834b458baec7cf378581 [0,0,0,0,0,2|2,0,0]=4 3881 B12R1.252 CC(C)CCNc1cccnc1 69f5877c25712220cf9d8582cf74056f [0,0,0,0,0,2|0,0,0]=2 3882 B12R1.252 CC(C)CCNc1cccnn1 49603a690558b49ae61b3e35c8c0d434 [0,0,0,0,0,2|1,0,0]=3 3883 B12R1.252 CC(C)CCNc1ccncc1 51f5e7e7cccdd7bf4f868dbc1d306bf9 [0,0,0,0,0,2|2,0,0]=4 3884 B12R1.252 CC(C)CCNc1ccnnc1 e97971f91d8080802d8d384ce559991b [0,0,0,0,0,2|1,0,0]=3 3885 B12R1.252 CC(C)CCNc1cnccn1 97e2470ed9c067d0275d682bf33fd1a4 [0,0,0,0,0,2|1,0,0]=3 3886 B12R1.252 CC(C)CCNc1cncnc1 26b8835dec95f3fb5d76438a06f580b5 [0,0,0,0,0,2|1,0,0]=3 3887 B12R1.252 CC(C)CCNc1cnncn1 443264a52a34d8b730661d2defb118ce [0,0,0,0,0,2|2,0,0]=4 3888 B12R1.252 CC(C)CCNc1nccnn1 ab73286e31172121b9f2ab5596f94690 [0,0,0,0,0,2|2,0,0]=4 3889 B12R1.252 CC(C)CCOc1ccccn1 7f883afab874ab8f83be331ad8cd7edb [0,0,0,0,0,2|2,0,0]=4 3890 B12R1.252 CC(C)CCOc1cccnc1 b89b58f2b508e626016a4b78466a2d25 [0,0,0,0,0,2|0,0,0]=2 3891 B12R1.252 CC(C)CCOc1ccncc1 d280f435e28fd77803bc44ac9ebf5e18 [0,0,0,0,0,2|2,0,0]=4 3892 B12R1.252 CC(C)CCOc1ccnnc1 7baaf15abe4368b26e2fb152c1b407a1 [0,0,0,0,0,2|1,0,0]=3 3893 B12R1.252 CC(C)CCOc1cnccn1 73ba6622223f14158ed8b6786344556e [0,0,0,0,0,2|1,0,0]=3 3894 B12R1.252 CC(C)CCOc1cncnc1 f13c236cab6a25e32a87a9e0cf542271 [0,0,0,0,0,2|1,0,0]=3 3895 B12R1.252 CC(C)CCOc1cncnn1 dee774261a720478b4cf30e5783e4173 [0,0,0,0,0,2|2,0,0]=4 3896 B12R1.252 CC(C)CNCc1ccccc1 c48ab8ad76cb980676fd518bfed01255 [0,0,0,0,0,2|1,0,0]=3 3897 B12R1.252 CC(C)CNCc1ccccn1 6d7ebb6c45d12163344e2670abad50d7 [0,0,0,0,0,2|2,0,0]=4 3898 B12R1.252 CC(C)CNCc1cccnc1 317cc81cae733d174c088ce8c918791e [0,0,0,0,0,2|0,0,0]=2 3899 B12R1.252 CC(C)CNCc1cccnn1 84be549ae7f23e584a9cd16132c3740f [0,0,0,0,0,2|1,0,0]=3 3900 B12R1.252 CC(C)CNCc1ccncc1 e68ace07204ad5f64fa8daf124fe226c [0,0,0,0,0,2|2,0,0]=4 3901 B12R1.252 CC(C)CNCc1ccnnc1 e272f82a038176e960733a3193d82b39 [0,0,0,0,0,2|1,0,0]=3 3902 B12R1.252 CC(C)CNCc1cnccn1 0929626c3926e9b5408d0567fa20c060 [0,0,0,0,0,2|1,0,0]=3 3903 B12R1.252 CC(C)CNCc1cncnc1 b12fe9f286ba850c74878865cff93b90 [0,0,0,0,0,2|1,0,0]=3 3904 B12R1.252 CC(C)COCc1ccccc1 5769ac6c29ea9be863f0068a3148d1e9 [0,0,0,0,0,2|1,0,0]=3 3905 B12R1.252 CC(C)COCc1ccccn1 41f471be8d0443a395a59a6edd4b2170 [0,0,0,0,0,2|2,0,0]=4 3906 B12R1.252 CC(C)COCc1cccnc1 e949ee90c476dd3afee631c02891b751 [0,0,0,0,0,2|0,0,0]=2 3907 B12R1.252 CC(C)COCc1cccnn1 bcec46c8daa86302f285ba1f41a4db4d [0,0,0,0,0,2|1,0,0]=3 3908 B12R1.252 CC(C)COCc1ccncc1 243716518cbf836169ff83c6e87d1a68 [0,0,0,0,0,2|2,0,0]=4 3909 B12R1.252 CC(C)COCc1ccnnc1 ff5d3e92e07d7c89d2f784ea78b2a712 [0,0,0,0,0,2|1,0,0]=3 3910 B12R1.252 CC(C)COCc1cnccn1 54d1f572f89be35af98ac5c6d0a00bd4 [0,0,0,0,0,2|1,0,0]=3 3911 B12R1.252 CC(C)COCc1cncnc1 82d59111480f34498710471232a2f8e6 [0,0,0,0,0,2|1,0,0]=3 3912 B12R1.252 CC(C)NCCc1ccccc1 800f62166be48d31d0f1f8e8246a3d11 [0,0,0,0,0,2|1,0,0]=3 3913 B12R1.252 CC(C)NCCc1ccccn1 60db3ccccaed87369474311fbbb2ee61 [0,0,0,0,0,2|2,0,0]=4 3914 B12R1.252 CC(C)NCCc1cccnc1 f39609cf740b878733069b3389a379d4 [0,0,0,0,0,2|0,0,0]=2 3915 B12R1.252 CC(C)NCCc1ccncc1 2e03fedf55e71e95c0abd0f4865dc22e [0,0,0,0,0,2|2,0,0]=4 3916 B12R1.252 CC(C)NCCc1cnccn1 35c3b70c1897dffd7b3a32c2343123fc [0,0,0,0,0,2|1,0,0]=3 3917 B12R1.252 CC(C)OCCc1ccccc1 cd2036e50db53ec52d80c5b70290b19c [0,0,0,0,0,2|1,0,0]=3 3918 B12R1.252 CC(C)OCCc1ccccn1 618810b4708a73ec52035c34c4054b87 [0,0,0,0,0,2|2,0,0]=4 3919 B12R1.252 CC(C)OCCc1cccnc1 ad83d4217e0420d4f686447a978fc953 [0,0,0,0,0,2|0,0,0]=2 3920 B12R1.252 CC(C)OCCc1ccncc1 07cefd4f30952a7fff1efa12f3f8cb0e [0,0,0,0,0,2|2,0,0]=4 3921 B12R1.252 CC(C)OCCc1cnccn1 ae26b65e22ea6fcf5c22fdff048110ff [0,0,0,0,0,2|1,0,0]=3 3922 B12R1.252 CC(C)OCNc1ccccc1 4ab9f406843d3d3dea8c678f7ec5fd29 [0,0,0,0,0,2|1,0,0]=3 3923 B12R1.252 CC(C)OCNc1ccccn1 f79533e956cd51a6f0cee4ac927e1136 [0,0,0,0,0,2|2,0,0]=4 3924 B12R1.252 CC(C)OCNc1cccnc1 6dd37a3ca9a4168d344f1af36676e50f [0,0,0,0,0,2|0,0,0]=2 3925 B12R1.252 CC(C)OCNc1cccnn1 4233edd1b8acbdda6e2ed07ac97c4f18 [0,0,0,0,0,2|1,0,0]=3 3926 B12R1.252 CC(C)OCNc1ccncc1 8f9b47fcb224f8aeae405dd2ac59e733 [0,0,0,0,0,2|2,0,0]=4 3927 B12R1.252 CC(C)OCNc1ccnnc1 26cfc83030fdfc0497495b1d6b64dd5d [0,0,0,0,0,2|1,0,0]=3 3928 B12R1.252 CC(C)OCNc1cnccn1 1ae9e037a0f2b87cad7a04a6488d98a1 [0,0,0,0,0,2|1,0,0]=3 3929 B12R1.252 CC(C)OCNc1cncnc1 e21b2d56154d31f0eeec35e29c17d629 [0,0,0,0,0,2|1,0,0]=3 3930 B12R1.252 CC(C)OCNc1cnncn1 d9b5a643672e4561313c8f1921165709 [0,0,0,0,0,2|2,0,0]=4 3931 B12R1.252 CC(C)OCNc1nccnn1 0a5b8da3a38e5120f028a1c30c7fd3e6 [0,0,0,0,0,2|2,0,0]=4 3932 B12R1.252 CC(C)OCOc1ccccn1 1f60fa9657a31d54ae86707f451d8353 [0,0,0,0,0,2|2,0,0]=4 3933 B12R1.252 CC(C)OCOc1cccnc1 0adf6c0a61ffae293502a60ec48e9b78 [0,0,0,0,0,2|0,0,0]=2 3934 B12R1.252 CC(C)OCOc1ccncc1 2419024f861ffb40c39021803c819ad7 [0,0,0,0,0,2|2,0,0]=4 3935 B12R1.252 CC(C)OCOc1ccnnc1 481cc49ec8ace7adc6477ac7bb51f20b [0,0,0,0,0,2|1,0,0]=3 3936 B12R1.252 CC(C)OCOc1cnccn1 8b455fe88e72e81fb797f6202bd7e240 [0,0,0,0,0,2|1,0,0]=3 3937 B12R1.252 CC(C)OCOc1cncnc1 b9a9b4358d869e2fc748716251d8ff8c [0,0,0,0,0,2|1,0,0]=3 3938 B12R1.252 CC(F)COCc1ccccc1 ceaaa348669e5aa8cbad2a4c64558f8e [0,0,0,0,0,2|2,0,0]=4 3939 B12R1.252 CC(F)COCc1cccnc1 c074e95bfd5d6d05bfe23c42186cba2a [0,0,0,0,0,2|1,0,0]=3 3940 B12R1.252 CC(F)COCc1cccnn1 a8676d0003d9a388121c44b40728d121 [0,0,0,0,0,2|2,0,0]=4 3941 B12R1.252 CC(F)COCc1cncnc1 8a1dba7261b289eecc7c37a372cdfe43 [0,0,0,0,0,2|2,0,0]=4 3942 B12R1.252 CC(O)CCNc1ccccc1 5c6c9358fbd8939fc6c9f54dcb2d3a37 [0,0,0,0,0,2|2,0,0]=4 3943 B12R1.252 CC(O)CCNc1cccnc1 ddabe466465a030ebf6055c0cc168740 [0,0,0,0,0,2|1,0,0]=3 3944 B12R1.252 CC(O)CCNc1cccnn1 47b97190e8ab1842f9cd5e0dee7ed3e8 [0,0,0,0,0,2|2,0,0]=4 3945 B12R1.252 CC(O)CCNc1ccnnc1 a504757203161e263e7f337405390bb3 [0,0,0,0,0,2|2,0,0]=4 3946 B12R1.252 CC(O)CCNc1cnccn1 6eb47df63aaf1411aa20597fd2d69a7f [0,0,0,0,0,2|2,0,0]=4 3947 B12R1.252 CC(O)CCNc1cncnc1 0b737784ac7e5816d1ebeb3501421956 [0,0,0,0,0,2|2,0,0]=4 3948 B12R1.252 CC(O)CNCc1ccccc1 19d19f96fb686d7cbd72f5df359e9dd8 [0,0,0,0,0,2|2,0,0]=4 3949 B12R1.252 CC(O)CNCc1cccnc1 0379a455e7b583f17fba58d3189059b6 [0,0,0,0,0,2|1,0,0]=3 3950 B12R1.252 CC(O)CNCc1cccnn1 ca0f502bcc801933ee5c767e5093148e [0,0,0,0,0,2|2,0,0]=4 3951 B12R1.252 CC(O)CNCc1ccnnc1 63d088ff8ad7b93fb69e3ad1f2381588 [0,0,0,0,0,2|2,0,0]=4 3952 B12R1.252 CC(O)CNCc1cnccn1 c8835bddb9845c918606787997b443d4 [0,0,0,0,0,2|2,0,0]=4 3953 B12R1.252 CC(O)CNCc1cncnc1 151206bce7a643e1e4818f076bf8f1d9 [0,0,0,0,0,2|2,0,0]=4 3954 B12R1.252 CC(S)COCc1ccccc1 a2dbb8c27ced04cd31e27a2a08aed095 [0,0,0,0,0,2|2,0,0]=4 3955 B12R1.252 CC(S)COCc1cccnc1 355ce467de5bbf28efe4538348b90e14 [0,0,0,0,0,2|1,0,0]=3 3956 B12R1.252 CC(S)COCc1cccnn1 d2ecb2d0e631a99f442e857229dbdd98 [0,0,0,0,0,2|2,0,0]=4 3957 B12R1.252 CC(S)COCc1cncnc1 d68e602e35e59e87317aa2e9eec6f5f4 [0,0,0,0,0,2|2,0,0]=4 3958 B12R1.252 CN(C)CCNc1ccccc1 d3b2e620d30900fb427915c44cfde5dc [0,0,0,0,0,2|2,0,0]=4 3959 B12R1.252 CN(C)CCNc1cccnc1 22a4008b463a870f2daa263a95fbffba [0,0,0,0,0,2|1,0,0]=3 3960 B12R1.252 CN(C)CCNc1cccnn1 f51377c01c96fdc88384854f00f73356 [0,0,0,0,0,2|2,0,0]=4 3961 B12R1.252 CN(C)CCNc1ccnnc1 6e4902398e9583d6ad8048503dd9cc6e [0,0,0,0,0,2|2,0,0]=4 3962 B12R1.252 CN(C)CCNc1cnccn1 99b5e064c6c4102ef678e43c645d6e69 [0,0,0,0,0,2|2,0,0]=4 3963 B12R1.252 CN(C)CCNc1cncnc1 84c94e22cb013dfab709c0c95f8aded2 [0,0,0,0,0,2|2,0,0]=4 3964 B12R1.252 CN(C)CCOc1cccnc1 f5e21fc4088e0b2f79fcf350bb578a86 [0,0,0,0,0,2|1,0,0]=3 3965 B12R1.252 CN(C)CCOc1ccnnc1 54fe87e9bdd9049bedd2880b4f4fc65f [0,0,0,0,0,2|2,0,0]=4 3966 B12R1.252 CN(C)CCOc1cnccn1 be4a48ac312e1b2ba1ac35f772f0f9b6 [0,0,0,0,0,2|2,0,0]=4 3967 B12R1.252 CN(C)CCOc1cncnc1 6b1857c9871efec56f3937a74de848ef [0,0,0,0,0,2|2,0,0]=4 3968 B12R1.252 CN(C)CNCc1ccccc1 0202e986c8da8d9c48034425b18c3dfe [0,0,0,0,0,2|2,0,0]=4 3969 B12R1.252 CN(C)CNCc1cccnc1 0ce03a303d2964fc78c4354a4a9686bb [0,0,0,0,0,2|1,0,0]=3 3970 B12R1.252 CN(C)CNCc1cccnn1 edb85eed85dffb6aff21e0071b036dad [0,0,0,0,0,2|2,0,0]=4 3971 B12R1.252 CN(C)CNCc1ccnnc1 8d4e707147a3f51418bfe435aef241e4 [0,0,0,0,0,2|2,0,0]=4 3972 B12R1.252 CN(C)CNCc1cnccn1 303398dd218f1390f1eac5b97feabe25 [0,0,0,0,0,2|2,0,0]=4 3973 B12R1.252 CN(C)COCc1ccccc1 a063060d7f5ce478c07330412cbf8447 [0,0,0,0,0,2|2,0,0]=4 3974 B12R1.252 CN(C)COCc1cccnc1 0f0029a575393373338b79601babfc55 [0,0,0,0,0,2|1,0,0]=3 3975 B12R1.252 CN(C)COCc1cccnn1 ac01354b378cf6d9281d0c823aad81fa [0,0,0,0,0,2|2,0,0]=4 3976 B12R1.252 CN(C)COCc1ccnnc1 7d9d7c5a44834047359b5b7c74c064d7 [0,0,0,0,0,2|2,0,0]=4 3977 B12R1.252 CN(C)COCc1cnccn1 9470c70b6acb2c5f48e9d9b28b3f08b2 [0,0,0,0,0,2|2,0,0]=4 3978 B12R1.252 CN(C)COCc1cncnc1 bcde2ac89fad6bd525f112498353eaff [0,0,0,0,0,2|2,0,0]=4 3979 B12R1.252 CS(=O)CCNc1cccnc1 c989b0c74f35fcb5f1937809390bfccd [0,0,0,0,0,2|2,0,0]=4 3980 B12R1.252 CS(=O)CCOc1cccnc1 fba82d99e9c5926738121fef3b403577 [0,0,0,0,0,2|2,0,0]=4 3981 B12R1.252 C[C@@H](F)COCc1ccccc1 ba1a50f79e3a1a52d90fe2949f8a3658 [0,0,0,0,0,2|2,0,0]=4 3982 B12R1.252 C[C@@H](F)COCc1cccnc1 aed0ead164612a30bbdf73120135ebce [0,0,0,0,0,2|1,0,0]=3 3983 B12R1.252 C[C@@H](F)COCc1cccnn1 06cb4b03e5d2138a02ec68b491d736db [0,0,0,0,0,2|2,0,0]=4 3984 B12R1.252 C[C@@H](F)COCc1cncnc1 6c6b988da2bf934da719d30239039da0 [0,0,0,0,0,2|2,0,0]=4 3985 B12R1.252 C[C@@H](O)CCNc1ccccc1 3c324f6ae4acc93f637fccf82ee7ce0d [0,0,0,0,0,2|2,0,0]=4 3986 B12R1.252 C[C@@H](O)CCNc1cccnc1 d2f9effd7c499379710e94d2300db828 [0,0,0,0,0,2|1,0,0]=3 3987 B12R1.252 C[C@@H](O)CCNc1cccnn1 cf73112336214ad7cbf0dc1846b2b8b5 [0,0,0,0,0,2|2,0,0]=4 3988 B12R1.252 C[C@@H](O)CCNc1cnccn1 d98d70b012f52698df30b7825b3d3f44 [0,0,0,0,0,2|2,0,0]=4 3989 B12R1.252 C[C@@H](O)CNCc1ccccc1 6c2312c00225852faacfd748f3e179a9 [0,0,0,0,0,2|2,0,0]=4 3990 B12R1.252 C[C@@H](O)CNCc1cccnc1 b84ffcc76f02e485a00f4000a256d608 [0,0,0,0,0,2|1,0,0]=3 3991 B12R1.252 C[C@@H](O)CNCc1cccnn1 cd1031e294d6f0d361dd47fa33d49ff3 [0,0,0,0,0,2|2,0,0]=4 3992 B12R1.252 C[C@@H](O)CNCc1ccnnc1 a6adabbfe9ec36728297c10c7c100d6e [0,0,0,0,0,2|2,0,0]=4 3993 B12R1.252 C[C@@H](O)CNCc1cnccn1 eef2e176f843886c7abc553819e37052 [0,0,0,0,0,2|2,0,0]=4 3994 B12R1.252 C[C@@H](O)CNCc1cncnc1 19165fd007380eca62afeda6cfb37644 [0,0,0,0,0,2|2,0,0]=4 3995 B12R1.252 C[C@H](F)COCc1ccccc1 bbc793e84de595855390c7dc0e162e4e [0,0,0,0,0,2|2,0,0]=4 3996 B12R1.252 C[C@H](F)COCc1cccnc1 0c09d4ffa6c243373fe47064ad603e31 [0,0,0,0,0,2|1,0,0]=3 3997 B12R1.252 C[C@H](F)COCc1cccnn1 2be52db7760fdc7844e251123071f59c [0,0,0,0,0,2|2,0,0]=4 3998 B12R1.252 C[C@H](F)COCc1cncnc1 9eff2fbe069ecca8868c961efa887e39 [0,0,0,0,0,2|2,0,0]=4 3999 B12R1.252 C[C@H](O)CCNc1ccccc1 6e2f4bd6880dfbdf2c0288d2956dbdc6 [0,0,0,0,0,2|2,0,0]=4 4000 B12R1.252 C[C@H](O)CCNc1cccnc1 a74a77e227ccf23689573201eeb443f8 [0,0,0,0,0,2|1,0,0]=3 4001 B12R1.252 C[C@H](O)CCNc1cccnn1 c62b16aa58dfc3c8ac3d7053343062a4 [0,0,0,0,0,2|2,0,0]=4 4002 B12R1.252 C[C@H](O)CCNc1cnccn1 5d34a9c581c97e3e5cec72109f7ba47d [0,0,0,0,0,2|2,0,0]=4 4003 B12R1.252 C[C@H](O)CNCc1ccccc1 300dc860ca45284f1e63efe30c8515f8 [0,0,0,0,0,2|2,0,0]=4 4004 B12R1.252 C[C@H](O)CNCc1cccnc1 4f2f0e9e68ec9a4c8887410d5a461943 [0,0,0,0,0,2|1,0,0]=3 4005 B12R1.252 C[C@H](O)CNCc1cccnn1 30faf4d5d2d2cfc53436874f05fa4323 [0,0,0,0,0,2|2,0,0]=4 4006 B12R1.252 C[C@H](O)CNCc1ccnnc1 a7bd5629dc85409dec43db9307521148 [0,0,0,0,0,2|2,0,0]=4 4007 B12R1.252 C[C@H](O)CNCc1cnccn1 3fe1c33c64283497dd89455f2ff7b9fd [0,0,0,0,0,2|2,0,0]=4 4008 B12R1.252 C[C@H](O)CNCc1cncnc1 43c1e13a89f1e44e47019870762f2938 [0,0,0,0,0,2|2,0,0]=4 4009 B12R1.252 FC(F)CCNc1cccnc1 8ff2eecd22f347407ae84953032c8976 [0,0,0,0,0,2|2,0,0]=4 4010 B12R1.252 FC(F)CNCc1cccnc1 10faa1bbbf72a799d263592383123ca2 [0,0,0,0,0,2|2,0,0]=4 4011 B12R1.252 FC(F)COCc1cccnc1 3532f1ad3bafa18adc371def44f6b40f [0,0,0,0,0,2|2,0,0]=4