0 B10R1.18 CC(=O)Nc1ccccn1 eb929aff8406d4b1d349799cd9970928 [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)Nc1ccncn1 21d9a226b27ccfaa0b4194dd907a60f4 [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|1,0,0]=1 7 B10R1.18 CC(C)Nc1cccnc1 b32b013363863cea153240b96e97c19f [0,0,0,0,0,0|3,0,0]=3 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|2,0,0]=2 11 B10R1.18 CC(C)Nc1ccnnc1 ca5f97416f9a66603da37ac043765b94 [0,0,0,0,0,0|4,0,0]=4 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|4,0,0]=4 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|2,0,0]=2 16 B10R1.18 CC(C)Nc1nccnn1 9d7094c1641b452d6a07a9ee90930c9f [0,0,0,0,0,0|3,0,0]=3 17 B10R1.18 CC(C)Nc1ncncn1 2369b8ea499e1a0918db752ae6c2e799 [0,0,0,0,0,0|3,0,0]=3 18 B10R1.18 CC(C)Oc1ccccn1 0855bdc27823287e98107cda25a8e4de [0,0,0,0,0,0|1,0,0]=1 19 B10R1.18 CC(C)Oc1cccnc1 2d5fbf8b6573bcaaa6ad1437daf348fa [0,0,0,0,0,0|3,0,0]=3 20 B10R1.18 CC(C)Oc1ccncc1 fcbd1de824cfd0b7040632344868de57 [0,0,0,0,0,0|3,0,0]=3 21 B10R1.18 CC(C)Oc1ccnnc1 5f378768fb399f97727c7d2434a4ccad [0,0,0,0,0,0|4,0,0]=4 22 B10R1.18 CC(C)Oc1cnccn1 f445429d4d0106398179ba53f8ca2052 [0,0,0,0,0,0|2,0,0]=2 23 B10R1.18 CC(C)Oc1cncnc1 987ff7423f824d1dd79f18db733241ff [0,0,0,0,0,0|4,0,0]=4 24 B10R1.18 CC(C)Oc1ncccn1 9c1a5b776824ae13ad1499e2cad8b03a [0,0,0,0,0,0|2,0,0]=2 25 B9R1.8 CCNc1ccccc1 33257e4a9e1d882742dfd4cfddb78cda [1,0,0,0,0,0|2,0,0]=3 26 B9R1.8 CCNc1ccccn1 2525c23bd886b96c78c0be1e9ad1905b [1,0,0,0,0,0|1,0,0]=2 27 B9R1.8 CCNc1cccnc1 e16c06cad87ecb5a3a4a58b6d8537631 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.8 CCNc1cccnn1 8ce46420a68f085572db040256d5d2b7 [1,0,0,0,0,0|2,0,0]=3 29 B9R1.8 CCNc1ccncc1 76118d388bf159fc52a5b3b43773c6d0 [1,0,0,0,0,0|3,0,0]=4 30 B9R1.8 CCNc1ccncn1 e04846be86a5c479e545d0cb402fe182 [1,0,0,0,0,0|2,0,0]=3 31 B9R1.8 CCNc1cnccn1 692286fa82997f2fb685e4d3ad5b2443 [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 CCNc1ncccn1 e5f30c193b5ab11515bad37a4470b1a9 [1,0,0,0,0,0|2,0,0]=3 34 B9R1.8 CCNc1nccnn1 de6c00a96ec865d94fb0210d389d00df [1,0,0,0,0,0|3,0,0]=4 35 B9R1.8 CCNc1ncncn1 95af6b7d0adfcc03c2c5620567ce30a7 [1,0,0,0,0,0|3,0,0]=4 36 B9R1.8 CCOc1ccccn1 8b10ed115fcb5b65f209d3b07c05b728 [1,0,0,0,0,0|1,0,0]=2 37 B9R1.8 CCOc1cccnc1 efa582b018c37c3ab155936515b551ea [1,0,0,0,0,0|3,0,0]=4 38 B9R1.8 CCOc1ccncc1 365c1eef106f5326bc3144a980f01ba5 [1,0,0,0,0,0|3,0,0]=4 39 B9R1.8 CCOc1cnccn1 aa9d1d61b4f8dce5da42fe3ddcc6df85 [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 CCOc1ncccn1 c537ae1cbb412be3ee508a248bc8885d [1,0,0,0,0,0|2,0,0]=3 42 B9R1.8 FCNc1ccccc1 c8185de2a7206057ede93409452a493c [1,0,0,0,0,0|3,0,0]=4 43 B9R1.8 FCNc1ccccn1 e54f22e64e1a3858aca2c223c703a3f4 [1,0,0,0,0,0|2,0,0]=3 44 B9R1.8 FCNc1cccnn1 b8bf7f385d541b86a7f5923a27fa760f [1,0,0,0,0,0|3,0,0]=4 45 B9R1.8 FCNc1ccncn1 3985bc8bdaefccce56c4c94f092d4343 [1,0,0,0,0,0|3,0,0]=4 46 B9R1.8 FCNc1cnccn1 3cbe94cf9594c68ec8b94825e8905ed8 [1,0,0,0,0,0|3,0,0]=4 47 B9R1.8 FCNc1ncccn1 3a7b3466aa5c957afc7c3f30aab56590 [1,0,0,0,0,0|3,0,0]=4 48 B9R1.8 FCOc1ccccn1 104b8f973c7a9ebb04a489743f7e956b [1,0,0,0,0,0|2,0,0]=3 49 B9R1.8 FCOc1cnccn1 e656ed16372ac6d21dfc0a12172339fc [1,0,0,0,0,0|3,0,0]=4 50 B9R1.8 FCOc1ncccn1 e56294909723d2bb0cb4671cfab08325 [1,0,0,0,0,0|3,0,0]=4 51 B9R1.8 O=CNc1ccccn1 881aba1a1d89f4a286d5001a309ad574 [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 OCNc1ccccn1 d59bc8d9974c705420d0aeed6cce1b06 [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 OCNc1ccncn1 5807087c5c4108ffa8c52d7444f962d7 [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 OCNc1ncccn1 9fc76ad0c84f53b08af40c3faa9bb85c [1,0,0,0,0,0|3,0,0]=4 58 B11R1.20 CC(=O)Nc1ccc(cn1)C 2566880c2cbd95238b8573fbab7352b5 [0,1,0,0,0,0|2,0,1]=4 59 B11R1.20 CC(=O)Nc1ccc(cn1)F 3f83a13c2f6c9200683a59445f5568b5 [0,1,0,0,0,0|2,0,1]=4 60 B11R1.20 CC(=O)Nc1ccc(cn1)I f69d5717020ba5469ac098b5ee595c2e [0,1,0,0,0,0|2,0,1]=4 61 B11R1.20 CC(=O)Nc1ccc(cn1)O 1774c40981e4bef395b20bb0cec3048d [0,1,0,0,0,0|2,0,1]=4 62 B11R1.20 CC(C)Nc1ccc(=O)[nH]c1 63657213ff6b579908dedea051a64186 [0,1,0,0,0,0|3,0,0]=4 63 B11R1.20 CC(C)Nc1ccc(cc1)Br e5f70783ec71726153c102e5801f7c8a [0,1,0,0,0,0|2,0,0]=3 64 B11R1.20 CC(C)Nc1ccc(cc1)Cl b33a847c825901d9dbcf3f8815c5869c [0,1,0,0,0,0|2,0,0]=3 65 B11R1.20 CC(C)Nc1ccc(cc1)F 689ddbde83a9a9429aa2388668fed19a [0,1,0,0,0,0|2,0,0]=3 66 B11R1.20 CC(C)Nc1ccc(cc1)I fa67ab606e8380aaae6be79fda5faf68 [0,1,0,0,0,0|2,0,0]=3 67 B11R1.20 CC(C)Nc1ccc(cc1)S e681327c1f8eccf785cd674735bc98be [0,1,0,0,0,0|2,0,0]=3 68 B11R1.20 CC(C)Nc1ccc(cn1)Br 9b1d22e0d0da20412cc097462da94620 [0,1,0,0,0,0|1,0,0]=2 69 B11R1.20 CC(C)Nc1ccc(cn1)Cl 5ae73597a5a1fa64ce292b318939abee [0,1,0,0,0,0|1,0,0]=2 70 B11R1.20 CC(C)Nc1ccc(cn1)F 6d484441b7055ef582d9e9fe1a736c28 [0,1,0,0,0,0|1,0,0]=2 71 B11R1.20 CC(C)Nc1ccc(cn1)I d7825663ab6a7ded0de82b19c2a89f36 [0,1,0,0,0,0|1,0,0]=2 72 B11R1.20 CC(C)Nc1ccc(nc1)Br a219ac4b34332eb3738a2d60093d25ca [0,1,0,0,0,0|3,0,0]=4 73 B11R1.20 CC(C)Nc1ccc(nc1)Cl cd874efcc56ef7f4e81f67a347da5256 [0,1,0,0,0,0|3,0,0]=4 74 B11R1.20 CC(C)Nc1ccc(nc1)F e5037e278c2deb1da56d4dd59d5edb3e [0,1,0,0,0,0|3,0,0]=4 75 B11R1.20 CC(C)Nc1ccc(nn1)Br 9300d74efb4bfa8eea46726e009a97ee [0,1,0,0,0,0|2,0,0]=3 76 B11R1.20 CC(C)Nc1ccc(nn1)Cl 5b527c05258f457b8939c2fb6f0c8530 [0,1,0,0,0,0|2,0,0]=3 77 B11R1.20 CC(C)Nc1ccc(nn1)F 03736295aa8a1cb85dc5ef0d9c473b8f [0,1,0,0,0,0|2,0,0]=3 78 B11R1.20 CC(C)Nc1ccc(nn1)I 543520b4c9b56ee98ab74b6573e76295 [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)Nc1ncc(cn1)Br 12ee911187f8f64a45388f2edb291204 [0,1,0,0,0,0|2,0,0]=3 83 B11R1.20 CC(C)Nc1ncc(cn1)Cl 279811957178c51f1fbf7a98c647cf3a [0,1,0,0,0,0|2,0,0]=3 84 B11R1.20 CC(C)Nc1ncc(cn1)F c793bd239da6565cb80351976fd2349e [0,1,0,0,0,0|2,0,0]=3 85 B11R1.20 CC(C)Nc1ncc(cn1)I 8bcfc6647a15e921b507df0db99c2d96 [0,1,0,0,0,0|2,0,0]=3 86 B11R1.20 CC(C)Nc1ncc(nn1)Br 0ef4f4bb2a0f0ac3f95a924756dcfe93 [0,1,0,0,0,0|3,0,0]=4 87 B11R1.20 CC(C)Oc1ccc(cc1)Br c830042d81f1762ab02a381b9eac79a4 [0,1,0,0,0,0|2,0,0]=3 88 B11R1.20 CC(C)Oc1ccc(cc1)Cl 7f20d83f4f9b33a7fd797ee07caaf887 [0,1,0,0,0,0|2,0,0]=3 89 B11R1.20 CC(C)Oc1ccc(cc1)F 4b3257094d99fffc8c1b5f1ead656595 [0,1,0,0,0,0|2,0,0]=3 90 B11R1.20 CC(C)Oc1ccc(cc1)I d09c2b32d485e0c585ea84ecec015274 [0,1,0,0,0,0|2,0,0]=3 91 B11R1.20 CC(C)Oc1ccc(cc1)S bc2b7db7696d219aecddb9042131dcc3 [0,1,0,0,0,0|2,0,0]=3 92 B11R1.20 CC(C)Oc1ccc(cn1)Cl 2d764f542cd850467dceb5ea7856809e [0,1,0,0,0,0|1,0,0]=2 93 B11R1.20 CC(C)Oc1ccc(cn1)F 8b718d6ec6cce88e81ab345ae3477032 [0,1,0,0,0,0|1,0,0]=2 94 B11R1.20 CC(C)Oc1ccc(cn1)I 00aba9b6fb1d651d79b062e296bef87f [0,1,0,0,0,0|1,0,0]=2 95 B11R1.20 CC(C)Oc1ccc(nc1)Br 03387980ed704f1b91f33115fdf148c9 [0,1,0,0,0,0|3,0,0]=4 96 B11R1.20 CC(C)Oc1ccc(nc1)Cl bf70b6eb15a088db8ddeb63733ed08d7 [0,1,0,0,0,0|3,0,0]=4 97 B11R1.20 CC(C)Oc1ccc(nc1)F c1100a1e2d454cfe8c3cbbc5d6e5727d [0,1,0,0,0,0|3,0,0]=4 98 B11R1.20 CC(C)Oc1ccc(nc1)I 86c15c6da9d65de15ebd86f541f4105e [0,1,0,0,0,0|3,0,0]=4 99 B11R1.20 CC(C)Oc1ccc(nn1)Br ca5abe55c45c851e797664bc3617f18c [0,1,0,0,0,0|2,0,0]=3 100 B11R1.20 CC(C)Oc1ccc(nn1)Cl 651b51b62b61604004703dab1d001021 [0,1,0,0,0,0|2,0,0]=3 101 B11R1.20 CC(C)Oc1cnc(cn1)Br 91d4eb535db1ce7bf9be0fa4b9feb81e [0,1,0,0,0,0|2,0,0]=3 102 B11R1.20 CC(C)Oc1cnc(cn1)Cl 8f1446e401eb34f52484f721e9cf817f [0,1,0,0,0,0|2,0,0]=3 103 B11R1.20 CC(C)Oc1cnc(cn1)I 87b70644a91cf51d9b39023634698b9d [0,1,0,0,0,0|2,0,0]=3 104 B11R1.20 CC(C)Oc1ncc(cn1)Br bda2b4cfde30017cfcbde65cd25aa817 [0,1,0,0,0,0|2,0,0]=3 105 B11R1.20 CC(C)Oc1ncc(cn1)F 91d26616bef6d264568230575c0363c5 [0,1,0,0,0,0|2,0,0]=3 106 B11R1.20 CC(C)Oc1ncc(cn1)I 4c4fd8206a747c74b8c8ef71d52dfb1d [0,1,0,0,0,0|2,0,0]=3 107 B11R1.20 Cc1ccc(cc1)NC(C)C bd77af8bd7263855741bad7d9283a59e [0,1,0,0,0,0|2,0,0]=3 108 B11R1.20 Cc1ccc(cc1)OC(C)C afaa4b057d8f12ac5846fcc0accc69e4 [0,1,0,0,0,0|2,0,0]=3 109 B11R1.20 Cc1ccc(cn1)NC(C)C 743454483328eed9afd36a5108a5fde3 [0,1,0,0,0,0|3,0,0]=4 110 B11R1.20 Cc1ccc(cn1)OC(C)C 587bf2eefeb78be461683015f0e1ab8b [0,1,0,0,0,0|3,0,0]=4 111 B11R1.20 Cc1ccc(nc1)NC(C)C 2fd0646075e4e7895badb9a91550ac5c [0,1,0,0,0,0|1,0,0]=2 112 B11R1.20 Cc1ccc(nc1)OC(C)C daaa0dc9632c23fcd00a8fbb104724aa [0,1,0,0,0,0|1,0,0]=2 113 B11R1.20 Cc1ccc(nn1)NC(C)C 6487fd6105f4adae0f068b61d1fd8eca [0,1,0,0,0,0|2,0,0]=3 114 B11R1.20 Cc1ccc(nn1)OC(C)C 3a816d13ac315665579e028ef90ab3f0 [0,1,0,0,0,0|2,0,0]=3 115 B11R1.20 Cc1cnc(cn1)NC(C)C 62da4fafaa97ef8ba9f5acc424d10f86 [0,1,0,0,0,0|2,0,0]=3 116 B11R1.20 Cc1cnc(cn1)OC(C)C 8ea0bf7b568631d6ecb8058cf1ff450a [0,1,0,0,0,0|2,0,0]=3 117 B11R1.20 Cc1cnc(nc1)NC(C)C 34788e49d07ec56b609ea638bc8e626f [0,1,0,0,0,0|2,0,0]=3 118 B11R1.20 Cc1cnc(nc1)OC(C)C ca9c87ebf20545a48f18f263ac13fe07 [0,1,0,0,0,0|2,0,0]=3 119 B11R1.36 CC(=O)N(C)c1ccccn1 3b204f817d8bae885450195e4bca3293 [0,1,0,0,0,0|2,0,1]=4 120 B11R1.36 CC(C)N(C)c1ccncn1 1814a228b6f30adf33e81d31ae0c937c [0,1,0,0,0,0|2,0,0]=3 121 B11R1.36 CC(C)N(C)c1ncccn1 b95ea3b0a873a62391c66078a7a4040a [0,1,0,0,0,0|2,0,0]=3 122 B11R1.36 CC(C)N(C)c1nccnn1 86ce7014ad5046a842638b44b6a6e404 [0,1,0,0,0,0|3,0,0]=4 123 B11R1.40 C#CC(C)Nc1cccnn1 af88c3f898952aa82abf99c938b53096 [0,1,0,0,0,0|2,0,1]=4 124 B11R1.40 C#CC(C)Nc1ccncn1 66605e5e3d7a3ce6b210df40a7766b03 [0,1,0,0,0,0|2,0,1]=4 125 B11R1.40 C#CC(C)Nc1cnccn1 0890d9b24b473fe758e6199edc8a0881 [0,1,0,0,0,0|2,0,1]=4 126 B11R1.40 C=CC(C)Nc1ccccc1 11c4f91eafeb8b3d7c22c97a0ea92d57 [0,1,0,0,0,0|2,0,1]=4 127 B11R1.40 C=CC(C)Nc1ccccn1 02b1b752c7d8a18090185a0c6f05b98f [0,1,0,0,0,0|1,0,1]=3 128 B11R1.40 C=CC(C)Nc1cccnn1 dc6a1aba96fa4e8b75fa66f85b1d807b [0,1,0,0,0,0|2,0,1]=4 129 B11R1.40 C=CC(C)Nc1ccncn1 d1624298bf85670735621b2485831e1a [0,1,0,0,0,0|2,0,1]=4 130 B11R1.40 C=CC(C)Nc1cnccn1 2ce38d7c68482d190f46e4388093ba1c [0,1,0,0,0,0|2,0,1]=4 131 B11R1.40 C=CC(C)Nc1ncccn1 657e7399f93289febc7ec6ab2dd5977a [0,1,0,0,0,0|2,0,1]=4 132 B11R1.40 C=CC(C)Oc1ccccn1 2070ac1050b132c193a90ece39692aa1 [0,1,0,0,0,0|1,0,1]=3 133 B11R1.40 C=CC(C)Oc1cnccn1 08abd798f6ac8d2321e8bf93d641b019 [0,1,0,0,0,0|2,0,1]=4 134 B11R1.40 C=CC(C)Oc1ncccn1 2af6904eef42528d12bdc801f19b631c [0,1,0,0,0,0|2,0,1]=4 135 B11R1.40 CC(C#N)Oc1cnccn1 00507718a19126ce3eaca95e14c1a595 [0,1,0,0,0,0|2,0,1]=4 136 B11R1.40 CC(C=O)Nc1ccccc1 0d04ec44ee6fe8b8d4f3d71cd15333ba [0,1,0,0,0,0|2,0,1]=4 137 B11R1.40 CC(C=O)Nc1ccccn1 f6323f482ea726d65853ab7cc1b45bb4 [0,1,0,0,0,0|1,0,1]=3 138 B11R1.40 CC(C=O)Nc1cccnn1 f41444e7551c51087a4ae36908695441 [0,1,0,0,0,0|2,0,1]=4 139 B11R1.40 CC(C=O)Nc1ccncn1 26c2e0863a19d01d9b92ada5ba0fab0d [0,1,0,0,0,0|2,0,1]=4 140 B11R1.40 CC(C=O)Nc1cnccn1 ca669a34fd29c06e16c362add7ff1bce [0,1,0,0,0,0|2,0,1]=4 141 B11R1.40 CC(C=O)Nc1ncccn1 ff55d7708df6315db61ceb5e53dab0ee [0,1,0,0,0,0|2,0,1]=4 142 B11R1.40 CC(C=O)Oc1ccccn1 6964fdd9e0bc6b530d4dd7a3a2376b4c [0,1,0,0,0,0|1,0,1]=3 143 B11R1.40 CC(C=O)Oc1cnccn1 e77f8a263c09c3973bbf702d318415d9 [0,1,0,0,0,0|2,0,1]=4 144 B11R1.40 CC(C=O)Oc1ncccn1 d2985a95b32127ee0959eb22ec1b27f7 [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|1,0,0]=2 147 B11R1.40 CC(CO)Nc1cccnc1 1993973453fc1c9eb0295a2e45197541 [0,1,0,0,0,0|3,0,0]=4 148 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)Nc1ccncn1 17796906879bf0ae2e98e2bf5752eab1 [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)Nc1ncccn1 4d59a1eb8aab40cf3c337bc82e555d91 [0,1,0,0,0,0|2,0,0]=3 154 B11R1.40 CC(CO)Nc1nccnn1 4056310548b07b1de0ae9d16861121cd [0,1,0,0,0,0|3,0,0]=4 155 B11R1.40 CC(CO)Nc1ncncn1 e5f9189903bdfdd6830693f4fb53e9bd [0,1,0,0,0,0|3,0,0]=4 156 B11R1.40 CCC(=O)Nc1ccccn1 5f642c62afae0a49ab875733e55fde1b [0,1,0,0,0,0|2,0,1]=4 157 B11R1.40 CCC(C)Nc1ccccc1 0d73dedeab1dd8f5149c3124f0b802dc [0,1,0,0,0,0|2,0,0]=3 158 B11R1.40 CCC(C)Nc1ccccn1 bb895d27f1d9ed94ab4cd5f93b01f0bd [0,1,0,0,0,0|1,0,0]=2 159 B11R1.40 CCC(C)Nc1cccnc1 a0e745f4d44915557790daf72381f523 [0,1,0,0,0,0|3,0,0]=4 160 B11R1.40 CCC(C)Nc1cccnn1 ff06696cf74f270fdba143978c62ac27 [0,1,0,0,0,0|2,0,0]=3 161 B11R1.40 CCC(C)Nc1ccncc1 8150e11adca204128a3ae62428597250 [0,1,0,0,0,0|3,0,0]=4 162 B11R1.40 CCC(C)Nc1ccncn1 cdc50b843b9c714cbb9488ee87e2e9f4 [0,1,0,0,0,0|2,0,0]=3 163 B11R1.40 CCC(C)Nc1cnccn1 218f39b97d2fc8b56d7c106256492dff [0,1,0,0,0,0|2,0,0]=3 164 B11R1.40 CCC(C)Nc1cnncn1 b4ae1832d341449951660973d36dd2a7 [0,1,0,0,0,0|3,0,0]=4 165 B11R1.40 CCC(C)Nc1ncccn1 11b2ce1094fd36a470194aa0ea19a19c [0,1,0,0,0,0|2,0,0]=3 166 B11R1.40 CCC(C)Nc1nccnn1 7aafbe768b9876c6c10b1c269bfe3a67 [0,1,0,0,0,0|3,0,0]=4 167 B11R1.40 CCC(C)Nc1ncncn1 f1f17b46f0f43efdb4a73872e91ee8fa [0,1,0,0,0,0|3,0,0]=4 168 B11R1.40 CCC(C)Oc1ccccn1 b8b4a806c6af90298cf0d1454fda0647 [0,1,0,0,0,0|1,0,0]=2 169 B11R1.40 CCC(C)Oc1cccnc1 ea8ea3a935f9f1da0dc64162c872e010 [0,1,0,0,0,0|3,0,0]=4 170 B11R1.40 CCC(C)Oc1ccncc1 0e7c13edf9ed6b6addf466a3a8481e15 [0,1,0,0,0,0|3,0,0]=4 171 B11R1.40 CCC(C)Oc1cnccn1 259d43a94fcc1396cf4ed5279619bad5 [0,1,0,0,0,0|2,0,0]=3 172 B11R1.40 CCC(C)Oc1cncnn1 c022991dbc7528d89b1ea0e28f6ee210 [0,1,0,0,0,0|3,0,0]=4 173 B11R1.40 CCC(C)Oc1ncccn1 2c3f480730b3d8e77d38029021131efd [0,1,0,0,0,0|2,0,0]=3 174 B11R1.40 CCN(C)Cc1ccccc1 c214a7b7c23665abe56278baaf98348b [0,1,0,0,0,0|2,0,0]=3 175 B11R1.40 CCN(C)Cc1ccccn1 e347cf6623c9ce49a1c94570b5d3844c [0,1,0,0,0,0|1,0,0]=2 176 B11R1.40 CCN(C)Cc1cccnc1 69e9bc72fe902e2c097b1bc797c43254 [0,1,0,0,0,0|3,0,0]=4 177 B11R1.40 CCN(C)Cc1cccnn1 ba8363aad2effd2a40895558d9f7d2cc [0,1,0,0,0,0|2,0,0]=3 178 B11R1.40 CCN(C)Cc1ccncc1 ebfb44d53a95f23536771c3c1b41adfd [0,1,0,0,0,0|3,0,0]=4 179 B11R1.40 CCN(C)Cc1ccncn1 83309bdc7d5b3f4e0468e934ea7be25a [0,1,0,0,0,0|2,0,0]=3 180 B11R1.40 CCN(C)Cc1cnccn1 13139f85f2c80541c7a741660f0206e2 [0,1,0,0,0,0|2,0,0]=3 181 B11R1.40 CCN(C)Cc1ncccn1 ebe3e637f0b1e6381a1d390f9229f3e9 [0,1,0,0,0,0|2,0,0]=3 182 B11R1.40 CC[C@@H](C)Nc1ccccc1 405a065880ecff40d5c3aba49f23a60f [0,1,0,0,0,0|2,0,0]=3 183 B11R1.40 CC[C@@H](C)Nc1cccnc1 d5c354fec9aa4824593a6aa370b31f97 [0,1,0,0,0,0|3,0,0]=4 184 B11R1.40 CC[C@H](C)Nc1ccccc1 bdf0fca4eb541010d4b75cf2b0618571 [0,1,0,0,0,0|2,0,0]=3 185 B11R1.40 CC[C@H](C)Nc1cccnc1 a188aeb369243191dc243d4fb98ce075 [0,1,0,0,0,0|3,0,0]=4 186 B11R1.40 CN(C=O)Cc1ccccc1 701ed8237afa851586621908f176512f [0,1,0,0,0,0|2,0,1]=4 187 B11R1.40 CN(C=O)Cc1ccccn1 e1588a36a59add4eaf224b7ea271ab51 [0,1,0,0,0,0|1,0,1]=3 188 B11R1.40 CN(C=O)Cc1cnccn1 b9f2001685a2ed99942d5f26418f6b7e [0,1,0,0,0,0|2,0,1]=4 189 B11R1.40 CN(C=O)Cc1ncccn1 a13744ee7ca7019a2d0a147b73274bbb [0,1,0,0,0,0|2,0,1]=4 190 B11R1.40 CN(CF)Cc1ccccc1 5e57d186c6f316353ffa6c809cb61d75 [0,1,0,0,0,0|2,0,0]=3 191 B11R1.40 CN(CF)Cc1ccccn1 0fb6d4fca1ae3b36d4aab61bd5289947 [0,1,0,0,0,0|1,0,0]=2 192 B11R1.40 CN(CF)Cc1cccnc1 da4d9171379b3361244699d43a3a0472 [0,1,0,0,0,0|3,0,0]=4 193 B11R1.40 CN(CF)Cc1ccncc1 81b0e7813544135aff8022710b2af4c1 [0,1,0,0,0,0|3,0,0]=4 194 B11R1.40 CN(CF)Cc1cnccn1 d828fc4f5274d45411baef854e240efe [0,1,0,0,0,0|2,0,0]=3 195 B11R1.40 CN(CF)Cc1ncccn1 3b8d09b633a054e8ce97b450c942b703 [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|1,0,0]=2 198 B11R1.40 CN(CO)Cc1cccnc1 bdae5dd3c0107b4a15ddef98331c4b4c [0,1,0,0,0,0|3,0,0]=4 199 B11R1.40 CN(CO)Cc1ccncc1 82d474736717cd4ad3b664282e77f89c [0,1,0,0,0,0|3,0,0]=4 200 B11R1.40 CN(CO)Cc1cnccn1 2612be83cbdd1e0199b6ab3c39c473bd [0,1,0,0,0,0|2,0,0]=3 201 B11R1.40 CN(CO)Cc1ncccn1 d2e6cdb99546d030361354de18b50e58 [0,1,0,0,0,0|2,0,0]=3 202 B11R1.40 C[C@@H](CO)Nc1ccccc1 d1a979ebd31c8c47073ae387eaa9c5f8 [0,1,0,0,0,0|2,0,0]=3 203 B11R1.40 C[C@@H](CO)Nc1ccccn1 9ac7427612f5553e5180ee81712e35fd [0,1,0,0,0,0|1,0,0]=2 204 B11R1.40 C[C@@H](CO)Nc1cccnc1 b4b83540aa924934ce25b37024c4f475 [0,1,0,0,0,0|3,0,0]=4 205 B11R1.40 C[C@@H](CO)Nc1cccnn1 9f042c1373662f7bcf04444b6615ba81 [0,1,0,0,0,0|2,0,0]=3 206 B11R1.40 C[C@@H](CO)Nc1ccncc1 495de922b28b07b689b24b08a715b1b6 [0,1,0,0,0,0|3,0,0]=4 207 B11R1.40 C[C@@H](CO)Nc1ccncn1 f1c1e7e380ed6f20077393c2ea15133a [0,1,0,0,0,0|2,0,0]=3 208 B11R1.40 C[C@@H](CO)Nc1cnccn1 54f606e098d7069b6301fbd7ff24023c [0,1,0,0,0,0|2,0,0]=3 209 B11R1.40 C[C@@H](CO)Nc1cnncn1 006c50fa1defe05a5bc68519dbbd528b [0,1,0,0,0,0|3,0,0]=4 210 B11R1.40 C[C@@H](CO)Nc1ncccn1 988a0651b7d8579b146b11e4192aa15f [0,1,0,0,0,0|2,0,0]=3 211 B11R1.40 C[C@@H](CO)Nc1nccnn1 77b9669b58c9059bfaacabc1ccf79acc [0,1,0,0,0,0|3,0,0]=4 212 B11R1.40 C[C@@H](CO)Nc1ncncn1 8fcbf3c7ee2dffbf6cb937419279900c [0,1,0,0,0,0|3,0,0]=4 213 B11R1.40 C[C@H](C=O)Nc1ccccc1 10a4433daba67da13987d6e7cd5b7f0f [0,1,0,0,0,0|2,0,1]=4 214 B11R1.40 C[C@H](C=O)Nc1ccccn1 46e94b05d4e4c715a9e5400c929646b9 [0,1,0,0,0,0|1,0,1]=3 215 B11R1.40 C[C@H](C=O)Nc1cccnn1 d5dc60d8cb88bbcccc9cff59b5cb66c4 [0,1,0,0,0,0|2,0,1]=4 216 B11R1.40 C[C@H](C=O)Nc1ccncn1 df0a1608ea15230c152c7cca4f253959 [0,1,0,0,0,0|2,0,1]=4 217 B11R1.40 C[C@H](C=O)Nc1cnccn1 4c60062904b679381801663797286554 [0,1,0,0,0,0|2,0,1]=4 218 B11R1.40 C[C@H](C=O)Nc1ncccn1 3b4862472080d4ec4f1296ac7ca19f40 [0,1,0,0,0,0|2,0,1]=4 219 B11R1.40 C[C@H](C=O)Oc1ccccn1 0be2b7848388ea049450b4a9fa6678e7 [0,1,0,0,0,0|1,0,1]=3 220 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)Oc1ncccn1 887a50920904afb2227cebb77d3e16b3 [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|1,0,0]=2 224 B11R1.40 C[C@H](CO)Nc1cccnc1 0388d126da012bf4a1e005fb7424e864 [0,1,0,0,0,0|3,0,0]=4 225 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)Nc1ccncn1 954fbcce3b9b09c9016cc6cd2015a51e [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)Nc1ncccn1 96711dc91f089457a6603118d153ab8c [0,1,0,0,0,0|2,0,0]=3 231 B11R1.40 C[C@H](CO)Nc1nccnn1 d226497317c47bb130c42c6cfa0e4b4d [0,1,0,0,0,0|3,0,0]=4 232 B11R1.40 C[C@H](CO)Nc1ncncn1 310da3f1b649788737f3a9979fbe7ecc [0,1,0,0,0,0|3,0,0]=4 233 B11R1.40 O=C(CF)Nc1ccccn1 2ce6af3846508f1cbf20b58b7e69e973 [0,1,0,0,0,0|2,0,1]=4 234 B11R1.40 O=C(CO)Nc1ccccn1 ac93149c4969ed513b19c3eba5f007d7 [0,1,0,0,0,0|2,0,1]=4 235 B11R1.40 O=C(CS)Nc1ccccn1 a5e554850131abc66cd7cf28616b9ec8 [0,1,0,0,0,0|2,0,1]=4 236 B11R1.86 CC(=O)Nc1ncccc1C 3c6d5cf596b0e21248657879e826b561 [0,1,0,0,0,0|2,0,1]=4 237 B11R1.86 CC(=O)Nc1ncccc1Cl 046176b1d66345ef27a31d8dec48e176 [0,1,0,0,0,0|2,0,1]=4 238 B11R1.86 CC(=O)Nc1ncccc1F 538d1f7d9dce9c391c2889dad2906996 [0,1,0,0,0,0|2,0,1]=4 239 B11R1.86 CC(=O)Nc1ncccc1I e16450fdd7c598f0519f5a1ac3923512 [0,1,0,0,0,0|2,0,1]=4 240 B11R1.86 CC(=O)Nc1ncccc1O b5c4643233d4c0cd6f7c1f9da29da199 [0,1,0,0,0,0|2,0,1]=4 241 B11R1.86 CC(C)Nc1cccc[n+]1[O-] 002b21bba3d24ee1645670e08aeceb41 [0,1,0,0,0,0|1,0,1]=3 242 B11R1.86 CC(C)Nc1ccccc1I 3eed1e6c2f407ecc428748af6151fed6 [0,1,0,0,0,0|2,0,0]=3 243 B11R1.86 CC(C)Nc1cccnc1Br a687380e5aa8756bf4d5d1c2e5895a79 [0,1,0,0,0,0|3,0,0]=4 244 B11R1.86 CC(C)Nc1cccnc1Cl 69ea8d619084b1b2778d6c21db2c80fb [0,1,0,0,0,0|3,0,0]=4 245 B11R1.86 CC(C)Nc1cccnc1F 893908ba00122d7cec7a3e9e3be67dd0 [0,1,0,0,0,0|3,0,0]=4 246 B11R1.86 CC(C)Nc1cccnc1I 51a846c9c1560b89c89fa64730a3deb3 [0,1,0,0,0,0|3,0,0]=4 247 B11R1.86 CC(C)Nc1ccncc1Br e596052c6754555b45104840e29c9959 [0,1,0,0,0,0|3,0,0]=4 248 B11R1.86 CC(C)Nc1ccncc1Cl 692462569093beed2014348ff5439bd9 [0,1,0,0,0,0|3,0,0]=4 249 B11R1.86 CC(C)Nc1ccncc1F 802dcf9c8e6305905595b97ec24ca83d [0,1,0,0,0,0|3,0,0]=4 250 B11R1.86 CC(C)Nc1ccncc1I f42128d1b412011706fba5240c2e234a [0,1,0,0,0,0|3,0,0]=4 251 B11R1.86 CC(C)Nc1cnccc1Cl 9286675edb1a06121c1b48201bbd38ab [0,1,0,0,0,0|3,0,0]=4 252 B11R1.86 CC(C)Nc1cnccc1F d36a1ce63436ee8a7fe7bd2f44ea5dbd [0,1,0,0,0,0|3,0,0]=4 253 B11R1.86 CC(C)Nc1cnccc1I ef08c6d9916171418c74e22e8ea78aab [0,1,0,0,0,0|3,0,0]=4 254 B11R1.86 CC(C)Nc1ncccc1F 6f5840dc300786776e2e321fcdb5f56b [0,1,0,0,0,0|1,0,0]=2 255 B11R1.86 CC(C)Nc1ncccc1I 532c9ce1b71264e87c45674524d2fb56 [0,1,0,0,0,0|1,0,0]=2 256 B11R1.86 CC(C)Nc1nccnc1Br 64f273542fcdef7892171fa21df651e1 [0,1,0,0,0,0|2,0,0]=3 257 B11R1.86 CC(C)Nc1nccnc1Cl 0f9c256412e7d20f9195319d8444aeb5 [0,1,0,0,0,0|2,0,0]=3 258 B11R1.86 CC(C)Nc1nccnc1I 13ad7ab334c3ad8089a1f994056eeee3 [0,1,0,0,0,0|2,0,0]=3 259 B11R1.86 CC(C)Nc1ncncc1Br 8555f150c699d29b84b3d8c24ab9187c [0,1,0,0,0,0|2,0,0]=3 260 B11R1.86 CC(C)Nc1ncncc1I 2e29ef086d9d1344563f7de8a5e60f53 [0,1,0,0,0,0|2,0,0]=3 261 B11R1.86 CC(C)Oc1ccc[nH]c1=S af7a587cdb1aeebef35b500fdd4289f5 [0,1,0,0,0,0|3,0,0]=4 262 B11R1.86 CC(C)Oc1cccc[n+]1[O-] 10611fdb1ef3435c39bd2cacbc1b5ed5 [0,1,0,0,0,0|1,0,1]=3 263 B11R1.86 CC(C)Oc1ccccc1Cl c23b66f89632f42c5d307b4af3111d42 [0,1,0,0,0,0|2,0,0]=3 264 B11R1.86 CC(C)Oc1ccccc1F 883d2c1cc9d854cb85fa804d83d6f507 [0,1,0,0,0,0|2,0,0]=3 265 B11R1.86 CC(C)Oc1ccccc1I 5b38c2c613687166fa94711069ce6a86 [0,1,0,0,0,0|2,0,0]=3 266 B11R1.86 CC(C)Oc1ccccc1S 75d24c98473e29b4fc09eb15793f8071 [0,1,0,0,0,0|2,0,0]=3 267 B11R1.86 CC(C)Oc1cccnc1Br 41da9105aa46a4cc5b28d1151f766f7c [0,1,0,0,0,0|3,0,0]=4 268 B11R1.86 CC(C)Oc1cccnc1Cl 5f47c201110ae76c3f20771d30f413ac [0,1,0,0,0,0|3,0,0]=4 269 B11R1.86 CC(C)Oc1cccnc1F 5024034c0e002e24ad11e1d6328a6435 [0,1,0,0,0,0|3,0,0]=4 270 B11R1.86 CC(C)Oc1cccnc1I 452ebdc4006c876f552145b479069297 [0,1,0,0,0,0|3,0,0]=4 271 B11R1.86 CC(C)Oc1cccoc1=O 40032c53cdaa862447e101ae5829df37 [0,1,0,0,0,0|3,0,0]=4 272 B11R1.86 CC(C)Oc1ccncc1Br 19a74c8f130c4f5a2ca0ac00315ac896 [0,1,0,0,0,0|3,0,0]=4 273 B11R1.86 CC(C)Oc1ccncc1Cl e9ec19e818e2bc1fafa3aee746091000 [0,1,0,0,0,0|3,0,0]=4 274 B11R1.86 CC(C)Oc1ccncc1F 2c1131f1cf9aea7ce8b673f2b786cc54 [0,1,0,0,0,0|3,0,0]=4 275 B11R1.86 CC(C)Oc1cnccc1Br d266279798ad748ca463f4d7f3f9adac [0,1,0,0,0,0|3,0,0]=4 276 B11R1.86 CC(C)Oc1cnccc1Cl 8d0804b21d39d2da2453c643a62be877 [0,1,0,0,0,0|3,0,0]=4 277 B11R1.86 CC(C)Oc1cnccc1F 2f3c830875644371b715186f6a3a53d7 [0,1,0,0,0,0|3,0,0]=4 278 B11R1.86 CC(C)Oc1cnccc1I 0e40e93e631b7a656560ba0272883482 [0,1,0,0,0,0|3,0,0]=4 279 B11R1.86 CC(C)Oc1coccc1=O 4d1b0da98e9bb63884871a804e330837 [0,1,0,0,0,0|3,0,0]=4 280 B11R1.86 CC(C)Oc1ncccc1Br 3d4ea0f45df93141b027452ac7d893d8 [0,1,0,0,0,0|1,0,0]=2 281 B11R1.86 CC(C)Oc1ncccc1Cl 9581b31c20e69ea270ecf789bba7b204 [0,1,0,0,0,0|1,0,0]=2 282 B11R1.86 CC(C)Oc1ncccc1F 366877e5493bef2aca6740e317ad0785 [0,1,0,0,0,0|1,0,0]=2 283 B11R1.86 CC(C)Oc1nccnc1Br 08bd2cad7f32b307a8d1015974c10f7a [0,1,0,0,0,0|2,0,0]=3 284 B11R1.86 CC(C)Oc1ncncc1Cl 70242a36e64450b74248f5f9848ef5a0 [0,1,0,0,0,0|2,0,0]=3 285 B11R1.86 CC(C)Oc1ncncc1F a3437a9fc316e118515cccf4edf3e9a2 [0,1,0,0,0,0|2,0,0]=3 286 B11R1.86 CC(C)Oc1ncncc1I 356c0b6f408b575b3e79762064e3c70b [0,1,0,0,0,0|2,0,0]=3 287 B11R1.86 CC(C)Oc1nnccc1Cl adb63b71d2412f1fb781ba602efc104d [0,1,0,0,0,0|2,0,0]=3 288 B11R1.86 CC(C)Oc1nnccc1I 87c834135a2fb55ba301ad1ba16dcc9e [0,1,0,0,0,0|2,0,0]=3 289 B11R1.86 CC(C)On1ccccc1=N 4ae1f304fba835ddd2d4147240ac35fb [0,1,0,0,0,0|3,0,0]=4 290 B11R1.86 CC(C)On1ccccc1=O 22cb614e9cef459cdf1d194311410b8b [0,1,0,0,0,0|3,0,0]=4 291 B11R1.86 CC(C)On1ccccc1=S c35b26e2d1b24665cc8b4412ddcdecc1 [0,1,0,0,0,0|3,0,0]=4 292 B11R1.86 Cc1ccccc1OC(C)C e336697c807367b5d2038eeb2d20cb38 [0,1,0,0,0,0|2,0,0]=3 293 B11R1.86 Cc1cccnc1NC(C)C ca53f8740b6496eebb84463f2bacb5a7 [0,1,0,0,0,0|1,0,0]=2 294 B11R1.86 Cc1cccnc1OC(C)C 2f4605dd9175a92f8b23a3625dc7655c [0,1,0,0,0,0|1,0,0]=2 295 B11R1.86 Cc1ccncc1OC(C)C 6e2f25c7be333db7d06187bc11a46726 [0,1,0,0,0,0|3,0,0]=4 296 B11R1.86 Cc1ccnnc1NC(C)C 4058e84abac9e4c55544fad10c869b2f [0,1,0,0,0,0|2,0,0]=3 297 B11R1.86 Cc1ccnnc1OC(C)C 2d8f76e95dd7a9d99351d31aa0c546e3 [0,1,0,0,0,0|2,0,0]=3 298 B11R1.86 Cc1cnccc1NC(C)C 0b91d986e8b999a69ce7977f721b4bab [0,1,0,0,0,0|3,0,0]=4 299 B11R1.86 Cc1cnccc1OC(C)C 0182e6e6188a5bd0fd92877deb3f0f63 [0,1,0,0,0,0|3,0,0]=4 300 B11R1.86 Cc1ncccc1NC(C)C ab0ea95484d50f8fd20357062d11cc88 [0,1,0,0,0,0|3,0,0]=4 301 B11R1.86 Cc1ncccc1OC(C)C 3bc8395d80b6d7a4cbb4afe4d1590f68 [0,1,0,0,0,0|3,0,0]=4 302 B11R1.86 Cc1nccnc1NC(C)C 487af012b2415642e3b4830cd3838913 [0,1,0,0,0,0|2,0,0]=3 303 B11R1.86 Cc1nccnc1OC(C)C 4c698fd515c5e4f6b0bc546fe95a926a [0,1,0,0,0,0|2,0,0]=3 304 B11R1.157 CC(=O)Nc1cc(ccn1)C 11bb75cefcc8e0053d4aa87066be916d [0,1,0,0,0,0|2,0,1]=4 305 B11R1.157 CC(=O)Nc1cc(ccn1)F 8e862ac7c7b42cf4a874c98f7685acd6 [0,1,0,0,0,0|2,0,1]=4 306 B11R1.157 CC(=O)Nc1cc(ccn1)O a3610b7684ca29dc38fcb0bb43d220bb [0,1,0,0,0,0|2,0,1]=4 307 B11R1.157 CC(=O)Nc1cccc(n1)C 01436216495e07ab1a016d090bd0354d [0,1,0,0,0,0|2,0,1]=4 308 B11R1.157 CC(=O)Nc1cccc(n1)F 5c90ea818058cfdc7008511466203d36 [0,1,0,0,0,0|2,0,1]=4 309 B11R1.157 CC(=O)Nc1cccc(n1)I 5d4e8b430df68bb8d5b9e79c705284bb [0,1,0,0,0,0|2,0,1]=4 310 B11R1.157 CC(=O)Nc1cccc(n1)O 5ecee8ed76a0d083278d7db13fb46dc5 [0,1,0,0,0,0|2,0,1]=4 311 B11R1.157 CC(C)Nc1cc(ccn1)Br ede334b0086465a9e421d24727c4af48 [0,1,0,0,0,0|1,0,0]=2 312 B11R1.157 CC(C)Nc1cc(ccn1)Cl 4657c8906495d89fadc59595bd54c150 [0,1,0,0,0,0|1,0,0]=2 313 B11R1.157 CC(C)Nc1cc(ccn1)F ef287f108744f6c18c5f49d744df2b4a [0,1,0,0,0,0|1,0,0]=2 314 B11R1.157 CC(C)Nc1cc(ccn1)I e2bc63e72569a419f8e6f6c1760decc0 [0,1,0,0,0,0|1,0,0]=2 315 B11R1.157 CC(C)Nc1cc(cnn1)Br d74b2489176d13b13a9d49adabca1305 [0,1,0,0,0,0|2,0,0]=3 316 B11R1.157 CC(C)Nc1cc(cnn1)Cl 159fb4bd07c0e858c6053a03bbd330ef [0,1,0,0,0,0|2,0,0]=3 317 B11R1.157 CC(C)Nc1cc(ncn1)Br 81cbb563ff29eb48249921749f1b19b9 [0,1,0,0,0,0|2,0,0]=3 318 B11R1.157 CC(C)Nc1cc(ncn1)Cl 17252c6bdf23bf16e94c6c01e6660055 [0,1,0,0,0,0|2,0,0]=3 319 B11R1.157 CC(C)Nc1cc(ncn1)F c900b450f9f177133866defabcef474b [0,1,0,0,0,0|2,0,0]=3 320 B11R1.157 CC(C)Nc1cc[nH]c(=O)n1 68808aac8e256a19ad9b13a317c4bd52 [0,1,0,0,0,0|2,0,0]=3 321 B11R1.157 CC(C)Nc1cc[nH]c(=S)c1 943e2f3af2236045092551a8b698d760 [0,1,0,0,0,0|3,0,0]=4 322 B11R1.157 CC(C)Nc1cccc(c1)Br c1a310149209bebd05d401b8d9453768 [0,1,0,0,0,0|2,0,0]=3 323 B11R1.157 CC(C)Nc1cccc(c1)Cl 88b649511dda4c3138b09b24b4cdf85e [0,1,0,0,0,0|2,0,0]=3 324 B11R1.157 CC(C)Nc1cccc(c1)F 2469bb14dda7a11ffa1e171e9579afdb [0,1,0,0,0,0|2,0,0]=3 325 B11R1.157 CC(C)Nc1cccc(c1)I 28c8d38bd4c860795c7f6ab5b08202d3 [0,1,0,0,0,0|2,0,0]=3 326 B11R1.157 CC(C)Nc1cccc(c1)S 4d5403275c38f6ee6364ab78831bae52 [0,1,0,0,0,0|2,0,0]=3 327 B11R1.157 CC(C)Nc1cccc(n1)Br 891f541b9adc7b0ca8f76cb7e39c8b39 [0,1,0,0,0,0|1,0,0]=2 328 B11R1.157 CC(C)Nc1cccc(n1)I 8d2a49a9d3ceb895e3574586ee1c89bf [0,1,0,0,0,0|1,0,0]=2 329 B11R1.157 CC(C)Nc1ccnc(c1)Br 4af3800bff929822af3b4739eff8eddc [0,1,0,0,0,0|3,0,0]=4 330 B11R1.157 CC(C)Nc1ccnc(c1)Cl 766191311591fa4b6d81b2509e2aebbd [0,1,0,0,0,0|3,0,0]=4 331 B11R1.157 CC(C)Nc1ccnc(c1)F f733e1ce2ac4ea46e404373b197b867b [0,1,0,0,0,0|3,0,0]=4 332 B11R1.157 CC(C)Nc1ccnc(c1)I 2df22ebd7dbeb99f813a36b914800a99 [0,1,0,0,0,0|3,0,0]=4 333 B11R1.157 CC(C)Nc1ccnc(n1)Br 88f05f8edee18c1d84d5c09407fba5f6 [0,1,0,0,0,0|2,0,0]=3 334 B11R1.157 CC(C)Nc1ccnc(n1)Cl d7d3867d65b2f1147a28f07d5fdfd916 [0,1,0,0,0,0|2,0,0]=3 335 B11R1.157 CC(C)Nc1ccnc(n1)F 62f67a6f5a4c96bf79f88089a211313a [0,1,0,0,0,0|2,0,0]=3 336 B11R1.157 CC(C)Nc1ccnc(n1)S b4a87a5e6a2beabbf104b5e6db4e4711 [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|3,0,0]=4 339 B11R1.157 CC(C)Nc1cncc(c1)F c0d792196e8876c1a0df52cc6f431e54 [0,1,0,0,0,0|3,0,0]=4 340 B11R1.157 CC(C)Nc1cncc(c1)I 5165104992f08facddd648b36b59a9a8 [0,1,0,0,0,0|3,0,0]=4 341 B11R1.157 CC(C)Nc1cncc(n1)F e065eccf180edd767707b1eb1341d59b [0,1,0,0,0,0|2,0,0]=3 342 B11R1.157 CC(C)Nc1cnnc(n1)Cl 20d3ab6f00a12bb11dac8f7479f06ea2 [0,1,0,0,0,0|3,0,0]=4 343 B11R1.157 CC(C)Nc1nc[nH]c(=O)n1 41e94dac4b83959c606c89db0efe81d2 [0,1,0,0,0,0|3,0,0]=4 344 B11R1.157 CC(C)Nc1nccc(=O)[nH]1 33c5d148bde9c8ce69522282a9232e25 [0,1,0,0,0,0|2,0,0]=3 345 B11R1.157 CC(C)Nc1nccc(n1)Br b25c3ed81a95aee0719f323189eba501 [0,1,0,0,0,0|2,0,0]=3 346 B11R1.157 CC(C)Nc1nccc(n1)Cl c52e132eb266d7a146841488bf52a829 [0,1,0,0,0,0|2,0,0]=3 347 B11R1.157 CC(C)Nc1nccc(n1)F 5cc526b51c779df3b5ffb89f781694e7 [0,1,0,0,0,0|2,0,0]=3 348 B11R1.157 CC(C)Nc1nccc(n1)I 0e26090389ba822cd0b23702b2340587 [0,1,0,0,0,0|2,0,0]=3 349 B11R1.157 CC(C)Nc1nccc(n1)S bf4bb1680e46a94fa5695626d66a296d [0,1,0,0,0,0|2,0,0]=3 350 B11R1.157 CC(C)Nc1ncnc(n1)Cl e73440466f4a11ef4ca8d131a052d486 [0,1,0,0,0,0|3,0,0]=4 351 B11R1.157 CC(C)Oc1cc(ccn1)Br 3480ee35d8ae0d5d11b7aa683499591e [0,1,0,0,0,0|1,0,0]=2 352 B11R1.157 CC(C)Oc1cc(ccn1)Cl d3d971cd1e336a781f870de87e0a3e03 [0,1,0,0,0,0|1,0,0]=2 353 B11R1.157 CC(C)Oc1cc(ccn1)F fb9a7af5c09ecabe8fe4cffddc870db1 [0,1,0,0,0,0|1,0,0]=2 354 B11R1.157 CC(C)Oc1cc(ncn1)Br 56f68cebc4dc46ebb3029de1bdb77297 [0,1,0,0,0,0|2,0,0]=3 355 B11R1.157 CC(C)Oc1cc(ncn1)Cl 7ee720c7ad6ea1ff7b6ecef76e01eb88 [0,1,0,0,0,0|2,0,0]=3 356 B11R1.157 CC(C)Oc1ccc[n+](c1)[O-] b00660a7d3334e38c94bae1aa15bfa44 [0,1,0,0,0,0|3,0,0]=4 357 B11R1.157 CC(C)Oc1cccc(=O)[nH]1 13625ddc45965e087d906cecd50738c3 [0,1,0,0,0,0|1,0,1]=3 358 B11R1.157 CC(C)Oc1cccc(c1)Br 03d6e4f39dc83644234524de153060f8 [0,1,0,0,0,0|2,0,0]=3 359 B11R1.157 CC(C)Oc1cccc(c1)Cl b05958621a80ad10943fb41bda6c4ff4 [0,1,0,0,0,0|2,0,0]=3 360 B11R1.157 CC(C)Oc1cccc(c1)F cc5136a263bfb966a933f5c182f882fd [0,1,0,0,0,0|2,0,0]=3 361 B11R1.157 CC(C)Oc1cccc(c1)I eecf4227dddae0c4ffe51c7d1a2196a6 [0,1,0,0,0,0|2,0,0]=3 362 B11R1.157 CC(C)Oc1cccc(c1)S c0ecc340d31d590be5ee243f9c89bfa6 [0,1,0,0,0,0|2,0,0]=3 363 B11R1.157 CC(C)Oc1cccc(n1)Br a18346d99926fef9a7886c50d31b0717 [0,1,0,0,0,0|1,0,0]=2 364 B11R1.157 CC(C)Oc1cccc(n1)F 4bfa0974aa476b6675e47db0c31b5390 [0,1,0,0,0,0|1,0,0]=2 365 B11R1.157 CC(C)Oc1ccnc(c1)Br 8163155dc9554a826c1579a6cd8b8a53 [0,1,0,0,0,0|3,0,0]=4 366 B11R1.157 CC(C)Oc1ccnc(c1)Cl 65c976867642144996957df346a8a86e [0,1,0,0,0,0|3,0,0]=4 367 B11R1.157 CC(C)Oc1ccnc(c1)F ba6b23e91f130a75063ccfe77ebe581a [0,1,0,0,0,0|3,0,0]=4 368 B11R1.157 CC(C)Oc1ccnc(n1)Cl 9ec2f495b00fb5295661aca31e8b9bce [0,1,0,0,0,0|2,0,0]=3 369 B11R1.157 CC(C)Oc1cncc(c1)Cl 388d88d9e0df30a2ba0e40f8f1524c25 [0,1,0,0,0,0|3,0,0]=4 370 B11R1.157 CC(C)Oc1cncc(c1)F a1defac1377360a458739a468937d592 [0,1,0,0,0,0|3,0,0]=4 371 B11R1.157 CC(C)Oc1cncc(c1)I 277b82df97e12d2b7f27e78d9949ff74 [0,1,0,0,0,0|3,0,0]=4 372 B11R1.157 CC(C)Oc1cncc(n1)Br 728b8a9c26c866a2cb7f1592bf7d3777 [0,1,0,0,0,0|2,0,0]=3 373 B11R1.157 CC(C)Oc1cncc(n1)Cl 3830830eeebaad7249ab139f796ed7e2 [0,1,0,0,0,0|2,0,0]=3 374 B11R1.157 CC(C)Oc1nccc(n1)Cl 7e021af2709750e6fe750ac84620ddf3 [0,1,0,0,0,0|2,0,0]=3 375 B11R1.157 Cc1cc(ccn1)NC(C)C 0a6ae8318e6544f792c3080ec507bf61 [0,1,0,0,0,0|3,0,0]=4 376 B11R1.157 Cc1cc(ccn1)OC(C)C 8187a967c8823cc680c7bbf8143ee8a4 [0,1,0,0,0,0|3,0,0]=4 377 B11R1.157 Cc1cc(ncn1)NC(C)C 72e23a3fb6b65a6cc129528f03fcd603 [0,1,0,0,0,0|2,0,0]=3 378 B11R1.157 Cc1cc(ncn1)OC(C)C 6d994d66521c98d90317b7ba42eba6a1 [0,1,0,0,0,0|2,0,0]=3 379 B11R1.157 Cc1cccc(c1)NC(C)C 6995924353e7f43790a327361636dd3c [0,1,0,0,0,0|2,0,0]=3 380 B11R1.157 Cc1cccc(c1)OC(C)C 768a0b78053567f181c821d541878835 [0,1,0,0,0,0|2,0,0]=3 381 B11R1.157 Cc1cccc(n1)NC(C)C 0fa0e842298c41943400547750aed7ea [0,1,0,0,0,0|1,0,0]=2 382 B11R1.157 Cc1cccc(n1)OC(C)C 791927ccd2fefd725c286781ac8b13c0 [0,1,0,0,0,0|1,0,0]=2 383 B11R1.157 Cc1ccnc(c1)NC(C)C d5f3d252110a2ee12b556e117762673a [0,1,0,0,0,0|1,0,0]=2 384 B11R1.157 Cc1ccnc(c1)OC(C)C 8636d90e36f69158a147da7734120e09 [0,1,0,0,0,0|1,0,0]=2 385 B11R1.157 Cc1ccnc(n1)NC(C)C cfeb44b3d09d5e663991cc0ba8e32892 [0,1,0,0,0,0|2,0,0]=3 386 B11R1.157 Cc1cncc(c1)NC(C)C 16b6df361413b730dd0edaa3dd52fb68 [0,1,0,0,0,0|3,0,0]=4 387 B11R1.157 Cc1cnnc(c1)NC(C)C 5ee18eee53d1232c5f06046abeb5289e [0,1,0,0,0,0|2,0,0]=3 388 B11R1.157 Cc1nccc(n1)NC(C)C 3a9428fcaf13437ef4b5516937990bcd [0,1,0,0,0,0|2,0,0]=3 389 B11R1.157 Cc1nccc(n1)OC(C)C 46a7711b5129a14c339de4512deb786a [0,1,0,0,0,0|2,0,0]=3 390 B11R1.157 Cc1nncc(n1)NC(C)C 76e88ce695d87e407fc4740792c8c56d [0,1,0,0,0,0|3,0,0]=4 391 B11R1.509 CC(C)(C)Nc1ccccc1 820b34717c3d9476c22fcc3db6fccee9 [0,1,0,0,0,0|2,0,0]=3 392 B11R1.509 CC(C)(C)Nc1cccnc1 22afe0912ef2c695ba26155c9d7e4850 [0,1,0,0,0,0|3,0,0]=4 393 B9R0.2 C/C=C/C=C/COC(C)C bec2220b1d6103b70011a64fb32efb70 [0,0,1,0,0,0|2,0,1]=4 394 B9R0.2 C=C/C=C/CCNC(C)C de5ce45d02f7d2cb1e20946ae6389b8e [0,0,1,0,0,0|2,0,1]=4 395 B9R0.2 CC(C)COC/C=C/C=O b3ff38c430c3f3c2547e5bad8ed5ab62 [0,0,1,0,0,0|2,0,1]=4 396 B9R0.2 CC=CC=CCOC(C)C 24b9fa85f55d4731b3b6ca3fc4d4a326 [0,0,1,0,0,0|2,0,1]=4 397 B9R0.14 C=CCC(C=C)OC(C)C 5962b6866e4b02622ec1bfaf5a0c8170 [0,0,1,0,0,0|2,0,1]=4 398 B9R0.14 C=CCN(C=O)CC(C)C 53920279c48c49e840e1e3e20aba9f1b [0,0,1,0,0,0|3,0,0]=4 399 B11R2.238 c1cc(ccn1)NC2CC2 5ad70d53c8f8554348b48da331d79b17 [0,0,0,1,0,0|3,0,0]=4 400 B11R2.238 c1ccc(cc1)NC2CC2 0cca6617983212a2989086e88698db73 [0,0,0,1,0,0|2,0,0]=3 401 B11R2.238 c1ccc(nc1)OC2CC2 05f70841461656fba19d4e6cae35b4c4 [0,0,0,1,0,0|1,0,0]=2 402 B11R2.238 c1cnc(nc1)NC2CC2 18a3c8f8b7f13eb4b818328df7a99401 [0,0,0,1,0,0|2,0,0]=3 403 B11R2.238 c1cnc(nn1)NC2CC2 6fa5c774385a17a538cf31ccbb47b005 [0,0,0,1,0,0|3,0,0]=4 404 B11R2.238 c1cncc(c1)NC2CC2 faca6d2d50c0b4a3e50cda13d58850cf [0,0,0,1,0,0|3,0,0]=4 405 B11R2.238 c1cncc(c1)OC2CC2 e02f03b072be3d2fd90f9a4a8c487a8f [0,0,0,1,0,0|3,0,0]=4 406 B11R2.238 c1ncnc(n1)NC2CC2 f34ba3d797785671a73e0aedd07a916d [0,0,0,1,0,0|3,0,0]=4 407 B9R1.13 CC(C)CN1CC=CC1 0159c45440890eddec53e955480c9179 [0,0,0,0,1,0|1,0,2]=4 408 B9R1.13 CC(C)Nc1cc[nH]n1 be6d410d3568f9605b2c6d8df650a613 [0,0,0,0,1,0|2,0,0]=3 409 B9R1.13 CC(C)Nc1ccno1 2159316ddf4b6c3bfafa9dd18aed231b [0,0,0,0,1,0|3,0,0]=4 410 B9R1.13 CC(C)Nc1ccns1 714dd1d20ea7ef80db82985f3609938e [0,0,0,0,1,0|3,0,0]=4 411 B9R1.13 CC(C)Nc1ccon1 4748af366c19db24727ab88e6ed6e4f0 [0,0,0,0,1,0|2,0,0]=3 412 B9R1.13 CC(C)Nc1ccsc1 15ad6ed6958067724a7a26e61257254b [0,0,0,0,1,0|2,0,0]=3 413 B9R1.13 CC(C)Nc1cn[nH]c1 8000fff5f883ac29b0e3632025d851d7 [0,0,0,0,1,0|3,0,0]=4 414 B9R1.13 CC(C)Nc1cncs1 52121261cabe3794162f74d6b81b293a [0,0,0,0,1,0|3,0,0]=4 415 B9R1.13 CC(C)Nc1cnoc1 c76f946df3b55dc487eb77cf96453f88 [0,0,0,0,1,0|3,0,0]=4 416 B9R1.13 CC(C)Nc1cnon1 c3bfdf318509670fdef611d4a4c0bd77 [0,0,0,0,1,0|3,0,0]=4 417 B9R1.13 CC(C)Nc1cocn1 5323ffea4d50273bd659bd73d5f477ee [0,0,0,0,1,0|2,0,0]=3 418 B9R1.13 CC(C)Nc1cscn1 80c72724b05cb5c849b1b06a3e5845c5 [0,0,0,0,1,0|2,0,0]=3 419 B9R1.13 CC(C)Nc1nc[nH]n1 bcea48efe5f06b8b4165eb24a47629b2 [0,0,0,0,1,0|3,0,0]=4 420 B9R1.13 CC(C)Nc1ncc[nH]1 8d05845695c8fb7502c2af4756268830 [0,0,0,0,1,0|2,0,0]=3 421 B9R1.13 CC(C)Nc1ncco1 fcd0fac8f92d9b0f4549470280738971 [0,0,0,0,1,0|2,0,0]=3 422 B9R1.13 CC(C)Nc1nccs1 a7ef9a363e91d5ff572edca29e81d493 [0,0,0,0,1,0|2,0,0]=3 423 B9R1.13 CC(C)Nc1ncns1 9da3ae4dd3dfc18a9fb390dcfc3ea496 [0,0,0,0,1,0|3,0,0]=4 424 B9R1.13 CC(C)Nc1ncon1 a0925a01294faa5143daa11b75a96f9b [0,0,0,0,1,0|3,0,0]=4 425 B9R1.13 CC(C)Nc1nncs1 f3607a1b97a69a72d891bb767eb26076 [0,0,0,0,1,0|3,0,0]=4 426 B9R1.13 CC(C)Oc1c[nH]cn1 1008314a7152167f871b01e8884baa4b [0,0,0,0,1,0|2,0,0]=3 427 B9R1.13 CC(C)Oc1ccco1 6706bc489021fd5e63c9cd08f454e9c6 [0,0,0,0,1,0|2,0,0]=3 428 B9R1.13 CC(C)Oc1cccs1 21794e900987f3d432b829048842efca [0,0,0,0,1,0|2,0,0]=3 429 B9R1.13 CC(C)Oc1ccn[nH]1 53c884ecb33b778652e01026b1e95972 [0,0,0,0,1,0|2,0,1]=4 430 B9R1.13 CC(C)Oc1ccsc1 6ccbd5cefe1aa53d8fe97e89f11c7215 [0,0,0,0,1,0|2,0,0]=3 431 B9R1.13 CC(C)Oc1cn[nH]c1 b05e8f4a5a4064c84eeb176794b31171 [0,0,0,0,1,0|3,0,0]=4 432 B9R1.13 CC(C)Oc1cnoc1 c46dc47e1623205835d17626dd014a3e [0,0,0,0,1,0|3,0,0]=4 433 B9R1.13 CC(C)Oc1cnsn1 55a7cb9a0990006b20f470f57b106ea7 [0,0,0,0,1,0|3,0,0]=4 434 B9R1.13 CC(C)Oc1nccs1 6b7fdf51a80ea2ae8353cabc54ee22f1 [0,0,0,0,1,0|2,0,0]=3 435 B9R1.13 CC(C)Oc1nncs1 5dd301398ca8ba4a5a46998ed07cdebf [0,0,0,0,1,0|3,0,0]=4 436 B9R1.13 CC(C)On1cccn1 485d56731527e6acaf37f4f9b0b2879e [0,0,0,0,1,0|2,0,0]=3 437 B9R1.13 CC(C)On1ccnc1 609be73781b0bdaf0862a61bf16d2c28 [0,0,0,0,1,0|3,0,0]=4 438 B11R1.91 C=C(Br)CNc1ccccn1 34727c54f341f78908ce976a14a84e14 [0,0,0,0,0,1|1,0,2]=4 439 B11R1.91 C=C(Br)COc1ccccn1 3d43ccaa4ce2255a33b2e5780563974e [0,0,0,0,0,1|1,0,2]=4 440 B11R1.91 C=C(C)CNc1ccccc1 9ff030153dc2dcaf07d1da3f9e6a073f [0,0,0,0,0,1|1,0,2]=4 441 B11R1.91 C=C(C)CNc1ccccn1 296f6d3c9e71203263ef4c60889651d0 [0,0,0,0,0,1|0,0,2]=3 442 B11R1.91 C=C(C)CNc1cccnn1 cf29f02fc2b1b06fbdfb1d6447888724 [0,0,0,0,0,1|1,0,2]=4 443 B11R1.91 C=C(C)CNc1ccncn1 d678c289e16121199b985729b050bce7 [0,0,0,0,0,1|1,0,2]=4 444 B11R1.91 C=C(C)CNc1cnccn1 d0a9ee6c6179d7f99dc86f8b5699859d [0,0,0,0,0,1|1,0,2]=4 445 B11R1.91 C=C(C)CNc1ncccn1 93e927b202233f4c87a4f9f2f20aec82 [0,0,0,0,0,1|1,0,2]=4 446 B11R1.91 C=C(C)COc1ccccn1 53d55f6223fd317f454a145f4adf39b2 [0,0,0,0,0,1|0,0,2]=3 447 B11R1.91 C=C(C)COc1cnccn1 75b8877c41b529e2d05c6c78734c83aa [0,0,0,0,0,1|1,0,2]=4 448 B11R1.91 C=C(C)COc1ncccn1 ed648ca8b2961174af51dd01de2dbb5a [0,0,0,0,0,1|1,0,2]=4 449 B11R1.91 C=C(Cl)CNc1ccccn1 8d57e9dfb8949b1985c884615fb6a8b4 [0,0,0,0,0,1|1,0,2]=4 450 B11R1.91 C=C(Cl)COc1ccccn1 d5b0ea3883b4108c18193d64e67163e7 [0,0,0,0,0,1|1,0,2]=4 451 B11R1.91 C=C(F)CNc1ccccn1 157c3ace5c43f0c3bdc0e522c3645f44 [0,0,0,0,0,1|1,0,2]=4 452 B11R1.91 C=C(F)COc1ccccn1 6bd6afe8502615849ff3c9b533c90f28 [0,0,0,0,0,1|1,0,2]=4 453 B11R1.91 CC(=O)CNc1ccccc1 71a2fb3da6b0e889c13cfd81e73bd182 [0,0,0,0,0,1|2,0,1]=4 454 B11R1.91 CC(=O)CNc1ccccn1 9ef5867d6e28a360f3e560522ae4c545 [0,0,0,0,0,1|1,0,1]=3 455 B11R1.91 CC(=O)CNc1cccnn1 bd224fe4d75fd6299636314b2659cf40 [0,0,0,0,0,1|2,0,1]=4 456 B11R1.91 CC(=O)CNc1ccncn1 4f817587489a7d067dc5afdf25fc5852 [0,0,0,0,0,1|2,0,1]=4 457 B11R1.91 CC(=O)CNc1cnccn1 f505fd1e568103e89908ef11d0b9c40c [0,0,0,0,0,1|2,0,1]=4 458 B11R1.91 CC(=O)CNc1ncccn1 f18694e3a51e6ffd47e70f441daa4c05 [0,0,0,0,0,1|2,0,1]=4 459 B11R1.91 CC(=O)NCc1ccccc1 29a87354e4243d3817f046f8152f971d [0,0,0,0,0,1|2,0,1]=4 460 B11R1.91 CC(=O)NCc1ccccn1 4a5e0ad0f6fb64ba7eb4726872bef1d0 [0,0,0,0,0,1|1,0,1]=3 461 B11R1.91 CC(=O)NCc1cccnn1 8df4f95b0595f5061ab86d0c6899ec2c [0,0,0,0,0,1|2,0,1]=4 462 B11R1.91 CC(=O)NCc1ccncn1 bb4e634dd2d2ac1df6c40895aef3c1f0 [0,0,0,0,0,1|2,0,1]=4 463 B11R1.91 CC(=O)NCc1cnccn1 3bc7c046654e0b52f0e8fd5e1c64219d [0,0,0,0,0,1|2,0,1]=4 464 B11R1.91 CC(=O)NCc1ncccn1 7e583fa87c299d4a4eb199dfcfdc7c5d [0,0,0,0,0,1|2,0,1]=4 465 B11R1.91 CC(C)CNc1ccccc1 408d8a64ab70f9eca096d81d546b6049 [0,0,0,0,0,1|1,0,0]=2 466 B11R1.91 CC(C)CNc1ccccn1 7b009ca04377ecc13f70ec3cf4ebfeda [0,0,0,0,0,1|0,0,0]=1 467 B11R1.91 CC(C)CNc1cccnc1 872c17275baf8dfc3e3fcfc1c6e8b0aa [0,0,0,0,0,1|2,0,0]=3 468 B11R1.91 CC(C)CNc1cccnn1 6e0a186ee92f69845b1d1e2faa4b9d99 [0,0,0,0,0,1|1,0,0]=2 469 B11R1.91 CC(C)CNc1ccncc1 25b00c7dc1cdd402497940b3c77292de [0,0,0,0,0,1|2,0,0]=3 470 B11R1.91 CC(C)CNc1ccncn1 f3aaf01b8fb4390cec4d8d0c307de117 [0,0,0,0,0,1|1,0,0]=2 471 B11R1.91 CC(C)CNc1ccnnc1 a8df0e4f94a9188832304de39fa0752f [0,0,0,0,0,1|3,0,0]=4 472 B11R1.91 CC(C)CNc1cnccn1 95ddfe6d68910c614f0cbdfaa85d0133 [0,0,0,0,0,1|1,0,0]=2 473 B11R1.91 CC(C)CNc1cncnc1 cb16d6f63363d23c43e0f4ee19155631 [0,0,0,0,0,1|3,0,0]=4 474 B11R1.91 CC(C)CNc1cnncn1 077dd4520b9c00d9ebe6adb526b19946 [0,0,0,0,0,1|2,0,0]=3 475 B11R1.91 CC(C)CNc1ncccn1 fb6ae2e310931ddbda6cf67796620c38 [0,0,0,0,0,1|1,0,0]=2 476 B11R1.91 CC(C)CNc1nccnn1 4d09253906936b3597d33f009e5aae20 [0,0,0,0,0,1|2,0,0]=3 477 B11R1.91 CC(C)CNc1ncncn1 3251af9da21438ab89ba2cdc32b8291b [0,0,0,0,0,1|2,0,0]=3 478 B11R1.91 CC(C)COc1ccccn1 7b0823f232ca75667ab72b773cf2055c [0,0,0,0,0,1|0,0,0]=1 479 B11R1.91 CC(C)COc1cccnc1 639764ab0bac28311f80a0c1092bb51e [0,0,0,0,0,1|2,0,0]=3 480 B11R1.91 CC(C)COc1ccncc1 f219312091f37b23472c98e305cf03a6 [0,0,0,0,0,1|2,0,0]=3 481 B11R1.91 CC(C)COc1ccnnc1 505d9a49f2cac632fe0c68cb941cb98c [0,0,0,0,0,1|3,0,0]=4 482 B11R1.91 CC(C)COc1cnccn1 fca5516fc8fc749e126db826ec1364f8 [0,0,0,0,0,1|1,0,0]=2 483 B11R1.91 CC(C)COc1cncnc1 b99958e2d254a4ae75237cf3e69e1130 [0,0,0,0,0,1|3,0,0]=4 484 B11R1.91 CC(C)COc1cncnn1 a6933c9df608223011362944059fe81f [0,0,0,0,0,1|2,0,0]=3 485 B11R1.91 CC(C)COc1ncccn1 1f457fce7df81ae19e8aadca0db78537 [0,0,0,0,0,1|1,0,0]=2 486 B11R1.91 CC(C)NCc1ccccc1 60272e3c9303882f29d21331dcab1491 [0,0,0,0,0,1|1,0,0]=2 487 B11R1.91 CC(C)NCc1ccccn1 856545f5d02de0038284fed0716bf52b [0,0,0,0,0,1|0,0,0]=1 488 B11R1.91 CC(C)NCc1cccnc1 f83c1668bc1a0795e6062eecd9dab4fd [0,0,0,0,0,1|2,0,0]=3 489 B11R1.91 CC(C)NCc1cccnn1 cccaf60f16873524c6ada28e623ee50e [0,0,0,0,0,1|1,0,0]=2 490 B11R1.91 CC(C)NCc1ccncc1 6f1dfa66543bb67ac78a3a333bf46a66 [0,0,0,0,0,1|2,0,0]=3 491 B11R1.91 CC(C)NCc1ccncn1 36ee71268b7fc037f6d2456244279a98 [0,0,0,0,0,1|1,0,0]=2 492 B11R1.91 CC(C)NCc1ccnnc1 98a9968a20acdc964ac10c028e00eec7 [0,0,0,0,0,1|3,0,0]=4 493 B11R1.91 CC(C)NCc1cnccn1 320d7f2d7b3c9da90f951a37d43af864 [0,0,0,0,0,1|1,0,0]=2 494 B11R1.91 CC(C)NCc1ncccn1 248c6dc0e3f7cb9e6cb68053e65f796a [0,0,0,0,0,1|1,0,0]=2 495 B11R1.91 CC(C)OCc1ccccc1 7aa508df1117d05227b589ad5630d192 [0,0,0,0,0,1|1,0,0]=2 496 B11R1.91 CC(C)OCc1ccccn1 0763eb944dcd10bf40a6049a3281f0fa [0,0,0,0,0,1|0,0,0]=1 497 B11R1.91 CC(C)OCc1cccnc1 15bee2bbdfea4851383d51503cc56958 [0,0,0,0,0,1|2,0,0]=3 498 B11R1.91 CC(C)OCc1cccnn1 9e75df7bf42bec5daa46f121cb3b2fee [0,0,0,0,0,1|1,0,0]=2 499 B11R1.91 CC(C)OCc1ccncc1 6b799cfffcfa8445d7523666b8d1a250 [0,0,0,0,0,1|2,0,0]=3 500 B11R1.91 CC(C)OCc1ccncn1 8ca6a7835eff3f310e3286485f2bc8a3 [0,0,0,0,0,1|1,0,0]=2 501 B11R1.91 CC(C)OCc1ccnnc1 9f4405a184896ebf514498f5e77701bf [0,0,0,0,0,1|3,0,0]=4 502 B11R1.91 CC(C)OCc1cnccn1 e68303144f36400499d51e9b07ed6d5f [0,0,0,0,0,1|1,0,0]=2 503 B11R1.91 CC(C)OCc1cncnc1 0b9844eb4d847bf9172813d1bb5440e6 [0,0,0,0,0,1|3,0,0]=4 504 B11R1.91 CC(C)OCc1ncccn1 38d74e076887ffaed244a2918ea05836 [0,0,0,0,0,1|1,0,0]=2 505 B11R1.91 CC(O)CNc1ccccc1 bad1b8ce4c3d0d43f36328d30e7f1e89 [0,0,0,0,0,1|2,0,0]=3 506 B11R1.91 CC(O)CNc1ccccn1 0b02a9fc805d3fdc80aa58b252d76fac [0,0,0,0,0,1|1,0,0]=2 507 B11R1.91 CC(O)CNc1cccnc1 be948b4ea22210c06fa11f5ff0c44d9b [0,0,0,0,0,1|3,0,0]=4 508 B11R1.91 CC(O)CNc1cccnn1 e8550c43b60b9bd9029917d25ea6398c [0,0,0,0,0,1|2,0,0]=3 509 B11R1.91 CC(O)CNc1ccncc1 58a36af31ee3d9178a47f4e2f681d20e [0,0,0,0,0,1|3,0,0]=4 510 B11R1.91 CC(O)CNc1ccncn1 87e78bbdc595709f51d9a8bdf7f2897c [0,0,0,0,0,1|2,0,0]=3 511 B11R1.91 CC(O)CNc1cnccn1 f991222b12e39f41fc4f22d1360207a1 [0,0,0,0,0,1|2,0,0]=3 512 B11R1.91 CC(O)CNc1cnncn1 e9d744d012cb875341a25fa1c5edb17d [0,0,0,0,0,1|3,0,0]=4 513 B11R1.91 CC(O)CNc1ncccn1 b6f7059776643b68745371242f2eebca [0,0,0,0,0,1|2,0,0]=3 514 B11R1.91 CC(O)CNc1nccnn1 079966ed897e1488fdb5a48945dead87 [0,0,0,0,0,1|3,0,0]=4 515 B11R1.91 CC(O)CNc1ncncn1 8378777ea0b6c602b3848430a6c1368f [0,0,0,0,0,1|3,0,0]=4 516 B11R1.91 CN(C)CNc1ccccc1 6ea2b21a530eb73fceed274bf1825a42 [0,0,0,0,0,1|2,0,0]=3 517 B11R1.91 CN(C)CNc1ccccn1 7dd3487cd8d87b9dce82d3b1e66d4dfe [0,0,0,0,0,1|1,0,0]=2 518 B11R1.91 CN(C)CNc1cccnc1 06dc729fa11ea9023ada541fc670b33d [0,0,0,0,0,1|3,0,0]=4 519 B11R1.91 CN(C)CNc1cccnn1 10ca1fff045b7a15c678bcb00a4606ad [0,0,0,0,0,1|2,0,0]=3 520 B11R1.91 CN(C)CNc1ccncc1 06f2faf99e2f9062dfe4af47bfbbee1d [0,0,0,0,0,1|3,0,0]=4 521 B11R1.91 CN(C)CNc1ccncn1 2127304849110c53d620fd112788e80e [0,0,0,0,0,1|2,0,0]=3 522 B11R1.91 CN(C)CNc1cnccn1 b2e8bec18797b7bb28e6e20f5edf5e23 [0,0,0,0,0,1|2,0,0]=3 523 B11R1.91 CN(C)CNc1cnncn1 f2d6968a4d7140b64770c86473eb86ef [0,0,0,0,0,1|3,0,0]=4 524 B11R1.91 CN(C)CNc1ncccn1 209025fb0608518b8dbf538cd1dcf0a6 [0,0,0,0,0,1|2,0,0]=3 525 B11R1.91 CN(C)CNc1nccnn1 41f4df293c547a6d207ab0888103373d [0,0,0,0,0,1|3,0,0]=4 526 B11R1.91 CN(C)CNc1ncncn1 70cb1e1ab5578ece828e424de140c923 [0,0,0,0,0,1|3,0,0]=4 527 B11R1.91 CN(C)COc1ccccn1 0d00edbce2a52e0b3d43150d9124361f [0,0,0,0,0,1|1,0,0]=2 528 B11R1.91 CN(C)COc1cccnc1 ba3cfa03500b005052d6345515b92103 [0,0,0,0,0,1|3,0,0]=4 529 B11R1.91 CN(C)COc1ccncc1 24dcd02da3008257944139a724552f1d [0,0,0,0,0,1|3,0,0]=4 530 B11R1.91 CN(C)COc1cnccn1 0bc79da095c240b1e1f95a99c0285d93 [0,0,0,0,0,1|2,0,0]=3 531 B11R1.91 CN(C)COc1cncnn1 513262afbbf286f41be61d9104779955 [0,0,0,0,0,1|3,0,0]=4 532 B11R1.91 CN(C)COc1ncccn1 26f1ea1f326cdb3fe0d7d7e20aa14964 [0,0,0,0,0,1|2,0,0]=3 533 B11R1.91 C[C@@H](O)CNc1ccccc1 3364bd989574177eabc4c47575206f02 [0,0,0,0,0,1|2,0,0]=3 534 B11R1.91 C[C@@H](O)CNc1ccccn1 2f50c5c35f8b03d00f3a417683f2e1c8 [0,0,0,0,0,1|1,0,0]=2 535 B11R1.91 C[C@@H](O)CNc1cccnc1 0269da8e8da5f2bc75323d1a7b31953c [0,0,0,0,0,1|3,0,0]=4 536 B11R1.91 C[C@@H](O)CNc1cccnn1 6d7b3599ec55158b05cb5aa4687b61f0 [0,0,0,0,0,1|2,0,0]=3 537 B11R1.91 C[C@@H](O)CNc1ccncc1 a759ad58b644a21887782ccec01db51a [0,0,0,0,0,1|3,0,0]=4 538 B11R1.91 C[C@@H](O)CNc1ccncn1 b017b3dcb881e43eb2f919cb0bf0d312 [0,0,0,0,0,1|2,0,0]=3 539 B11R1.91 C[C@@H](O)CNc1cnccn1 eefedac70fb9e61b84978ca5f31e1024 [0,0,0,0,0,1|2,0,0]=3 540 B11R1.91 C[C@@H](O)CNc1cnncn1 ec8f16affeeb15fca88b483b81b727bd [0,0,0,0,0,1|3,0,0]=4 541 B11R1.91 C[C@@H](O)CNc1ncccn1 ec34d1470851807c1662c266c1187822 [0,0,0,0,0,1|2,0,0]=3 542 B11R1.91 C[C@@H](O)CNc1nccnn1 97fdbd1b5c4939a91b3631c209d843d4 [0,0,0,0,0,1|3,0,0]=4 543 B11R1.91 C[C@@H](O)CNc1ncncn1 4a9bcbd957cdb1adcc86639f07423516 [0,0,0,0,0,1|3,0,0]=4 544 B11R1.91 C[C@H](O)CNc1ccccc1 72a253baaf381f6699a10e01b0f0ab34 [0,0,0,0,0,1|2,0,0]=3 545 B11R1.91 C[C@H](O)CNc1ccccn1 b5e1e178b39afd2578578a870577034a [0,0,0,0,0,1|1,0,0]=2 546 B11R1.91 C[C@H](O)CNc1cccnc1 13f963f21a32ff7cb405ad7d76f40567 [0,0,0,0,0,1|3,0,0]=4 547 B11R1.91 C[C@H](O)CNc1cccnn1 d1cbd42116d6dcb71e4b9c0be7e6b4b4 [0,0,0,0,0,1|2,0,0]=3 548 B11R1.91 C[C@H](O)CNc1ccncc1 40e1cfcf68d3fb31f8ea23f4fe31cf2f [0,0,0,0,0,1|3,0,0]=4 549 B11R1.91 C[C@H](O)CNc1ccncn1 d98c0c85670dd7a9571673306a8a7bbe [0,0,0,0,0,1|2,0,0]=3 550 B11R1.91 C[C@H](O)CNc1cnccn1 8436b233d47376aa6994f036c7608979 [0,0,0,0,0,1|2,0,0]=3 551 B11R1.91 C[C@H](O)CNc1cnncn1 70a6f470a69e2478a941d74a578a283f [0,0,0,0,0,1|3,0,0]=4 552 B11R1.91 C[C@H](O)CNc1ncccn1 b8c9593e9f50f526bf52c6b1059528a2 [0,0,0,0,0,1|2,0,0]=3 553 B11R1.91 C[C@H](O)CNc1nccnn1 4aeacf9a97ea5933405c1b517f46e8ff [0,0,0,0,0,1|3,0,0]=4 554 B11R1.91 C[C@H](O)CNc1ncncn1 dfe662c9d366e87300e75de3cfa1ce4f [0,0,0,0,0,1|3,0,0]=4 555 B11R1.91 FC(F)CNc1ccccc1 84c83ea792636e350c2a00840c340dda [0,0,0,0,0,1|3,0,0]=4 556 B11R1.91 FC(F)CNc1ccccn1 3e6bbc18fb170dbd99c0771b3f20bde4 [0,0,0,0,0,1|2,0,0]=3 557 B11R1.91 FC(F)CNc1cccnn1 6a0fb75be4f7a3d785cb3a714e06079d [0,0,0,0,0,1|3,0,0]=4 558 B11R1.91 FC(F)CNc1ccncn1 31d9c1d1983b12cbebd6d6765f16a8e7 [0,0,0,0,0,1|3,0,0]=4 559 B11R1.91 FC(F)CNc1cnccn1 044391ced47c9eaa868f2d3136bc246e [0,0,0,0,0,1|3,0,0]=4 560 B11R1.91 FC(F)CNc1ncccn1 1c8c85f97164eca0335a4ee10863d1ea [0,0,0,0,0,1|3,0,0]=4 561 B11R1.91 FC(F)COc1ccccn1 5e0a1a0fa35c804046b8ebf535a7456b [0,0,0,0,0,1|2,0,0]=3 562 B11R1.91 FC(F)COc1cnccn1 a08431a794976ce612934d8b1139152d [0,0,0,0,0,1|3,0,0]=4 563 B11R1.91 FC(F)COc1ncccn1 b6ec9857ed8329542027d0d3df7e6821 [0,0,0,0,0,1|3,0,0]=4 564 B11R1.91 NC(=O)CNc1ccccn1 034e479579804be1d3ad81d994fdfe8a [0,0,0,0,0,1|2,0,1]=4 565 B11R1.91 NC(=O)COc1ccccn1 d34b1e4c40fb1accb7eddd79d84f9d95 [0,0,0,0,0,1|2,0,1]=4 566 B11R1.91 O=C(O)CNc1ccccn1 83bad72d96578f6ee29657bf854abc17 [0,0,0,0,0,1|2,0,1]=4 567 B11R1.91 O=C(O)COc1ccccn1 d10c5c7e1100e6f68973343e5e477bed [0,0,0,0,0,1|2,0,1]=4 568 B11R1.91 O=[N+]([O-])CNc1ccccn1 fa3791afd87223e91ea86dad5a58a542 [0,0,0,0,0,1|3,0,0]=4 569 B11R1.91 O=[N+]([O-])COc1ccccn1 49e72bdbc6a0e888db2e191c73149f9f [0,0,0,0,0,1|3,0,0]=4 570 B8R0.16 C=CC(C=C)OC(C)C d52270769618bbb9ffdd6080fb107203 [1,0,1,0,0,0|1,0,1]=4 571 B10R0.4 C/C=C/C=C/COCC(C)C bb914ccb0b11afff65e287f17c04748c [0,1,1,0,0,0|1,0,1]=4 572 B10R0.4 C=C/C=C/CCNCC(C)C cc92e8e5f3006727f2efffe2aa46ace8 [0,1,1,0,0,0|1,0,1]=4 573 B10R0.4 CC=CC=CCOCC(C)C 7814727135fdb8691dd30a42ea8e97a1 [0,1,1,0,0,0|1,0,1]=4 574 B10R0.78 C=C/C=C/C(=O)NCC(C)C a3844a0ec5abaf6eda8ca48c5fdbfdb4 [0,1,1,0,0,0|2,0,0]=4 575 B10R0.78 C=C/C=C\C(=O)NCC(C)C 1dd9352c50ac5e6f8f3809df03aeda40 [0,1,1,0,0,0|2,0,0]=4 576 B10R0.78 C=CC=CC(=O)NCC(C)C 9ee529ef15651cf2b8b82a031e37bc05 [0,1,1,0,0,0|2,0,0]=4 577 B10R0.18 C=C/C=C/C(=O)NC(C)CC f7929a6f188b8b0b87e78ad5b9b6db05 [0,1,1,0,0,0|2,0,0]=4 578 B10R0.18 C=C/C=C/C(=O)NC(C)CO 71b3fb1eba3886a8772e91c4741e895f [0,1,1,0,0,0|2,0,0]=4 579 B10R0.18 C=C/C=C/C(=O)N[C@@H](C)CC 677627fd6e113406be86334259255312 [0,1,1,0,0,0|2,0,0]=4 580 B10R0.18 C=C/C=C/C(=O)N[C@@H](C)CO 750a0c06d9553b6b9cbc0b4b778eee81 [0,1,1,0,0,0|2,0,0]=4 581 B10R0.18 C=C/C=C/C(=O)N[C@H](C)CC fd7352e1618c6c30c92fb832128b37f8 [0,1,1,0,0,0|2,0,0]=4 582 B10R0.18 C=C/C=C/C(=O)N[C@H](C)CO 70bc13920c5c6b3b335ef7f8949365eb [0,1,1,0,0,0|2,0,0]=4 583 B10R0.18 C=C/C=C\C(=O)NC(C)CC abb6e6ba56b03eccd78540b41633f63a [0,1,1,0,0,0|2,0,0]=4 584 B10R0.18 C=C/C=C\C(=O)NC(C)CO 8e693ba09cd7100b887b6dd9e9476638 [0,1,1,0,0,0|2,0,0]=4 585 B10R0.18 C=C/C=C\C(=O)N[C@@H](C)CC fe07a6299cdd4599d8010c083c580eec [0,1,1,0,0,0|2,0,0]=4 586 B10R0.18 C=C/C=C\C(=O)N[C@@H](C)CO 3ea0365a52c7af13891058596e4727d5 [0,1,1,0,0,0|2,0,0]=4 587 B10R0.18 C=C/C=C\C(=O)N[C@H](C)CC 54afe1e4d1a7dc74f6ca4a5c5ec6fc32 [0,1,1,0,0,0|2,0,0]=4 588 B10R0.18 C=C/C=C\C(=O)N[C@H](C)CO 1122fe1be6c9e40038ea3b75c2c1d843 [0,1,1,0,0,0|2,0,0]=4 589 B10R0.18 C=CC=CC(=O)NC(C)CC eaa6f791176d36dce23515637c416706 [0,1,1,0,0,0|2,0,0]=4 590 B10R0.18 C=CC=CC(=O)NC(C)CO 0439602b84c5f914ffd3481573ead334 [0,1,1,0,0,0|2,0,0]=4 591 B10R0.18 C=CC=CC(=O)N[C@@H](C)CC 52594acbdd583ca757ce6c003e947412 [0,1,1,0,0,0|2,0,0]=4 592 B10R0.18 C=CC=CC(=O)N[C@@H](C)CO ef5febfdb9edfd35bc008191ad8b5be8 [0,1,1,0,0,0|2,0,0]=4 593 B10R0.18 C=CC=CC(=O)N[C@H](C)CC 9bbe7467ddaebdcd48b827ccba4ff8e6 [0,1,1,0,0,0|2,0,0]=4 594 B10R0.18 C=CC=CC(=O)N[C@H](C)CO c1f8e8aa5885ea9985cac21ce3e208bc [0,1,1,0,0,0|2,0,0]=4 595 B10R0.28 C=C/C=C/C(=O)NC(C)(C)C e3321ca8932a77a161c4f28b52cbba44 [0,1,1,0,0,0|2,0,0]=4 596 B10R0.28 C=C/C=C\C(=O)NC(C)(C)C 8453e53ab53785aa6962e8858fc5c20b [0,1,1,0,0,0|2,0,0]=4 597 B10R0.28 C=CC=CC(=O)NC(C)(C)C f8e5309cfc8230df3899da09c3eff094 [0,1,1,0,0,0|2,0,0]=4 598 B10R0.81 C=C/C=C/C(=O)N(C)C(C)C c98b5e9e90c47a4cb616bcbfee9fdb79 [0,1,1,0,0,0|2,0,0]=4 599 B10R0.81 C=C/C=C\C(=O)N(C)C(C)C 7d7b3d09180f6411eca2a19617626e25 [0,1,1,0,0,0|2,0,0]=4 600 B10R0.81 C=CC=CC(=O)N(C)C(C)C 4f0ff269d620d06dd852934d7547ac38 [0,1,1,0,0,0|2,0,0]=4 601 B10R0.79 C=CCN(CC=C)CC(C)C 9f1394da3f4de1dd2320e628b100575c [0,1,1,0,0,0|2,0,0]=4 602 B10R1.1 CCNc1ccc(cc1)Br e7368b650d842df07f1a9668bf0b4031 [1,1,0,0,0,0|2,0,0]=4 603 B10R1.1 CCNc1ccc(cc1)C 5bd280a2c0e051bd626f67ade06cc665 [1,1,0,0,0,0|2,0,0]=4 604 B10R1.1 CCNc1ccc(cc1)Cl 78a77ff2de1029463881d0096e3c40b4 [1,1,0,0,0,0|2,0,0]=4 605 B10R1.1 CCNc1ccc(cc1)F 7245e23faec7214139cc638d5d7041df [1,1,0,0,0,0|2,0,0]=4 606 B10R1.1 CCNc1ccc(cc1)I 08dbf719260fe2b9101a362dcb5b3f5c [1,1,0,0,0,0|2,0,0]=4 607 B10R1.1 CCNc1ccc(cc1)S d391e984cf82ddd3585ab73e3af8af78 [1,1,0,0,0,0|2,0,0]=4 608 B10R1.1 CCNc1ccc(cn1)Br 639f883e838120d440c275f266387630 [1,1,0,0,0,0|1,0,0]=3 609 B10R1.1 CCNc1ccc(cn1)C fb256d19526c3e4e7db09097bf1226ae [1,1,0,0,0,0|1,0,0]=3 610 B10R1.1 CCNc1ccc(cn1)Cl 86942235d68fec688c4d98a640636bda [1,1,0,0,0,0|1,0,0]=3 611 B10R1.1 CCNc1ccc(cn1)F bc6bc6f1cc565acba301cdb52762e02f [1,1,0,0,0,0|1,0,0]=3 612 B10R1.1 CCNc1ccc(cn1)I 52b76d004d4ec36a1450a88eb15ee235 [1,1,0,0,0,0|1,0,0]=3 613 B10R1.1 CCNc1ccc(nn1)Br e192cd044ddddfa30a2da65dc4d391b6 [1,1,0,0,0,0|2,0,0]=4 614 B10R1.1 CCNc1ccc(nn1)C 2df667a473be0707f8096766eec8d6da [1,1,0,0,0,0|2,0,0]=4 615 B10R1.1 CCNc1ccc(nn1)Cl 81d466b3654e06d0322942354b3ac055 [1,1,0,0,0,0|2,0,0]=4 616 B10R1.1 CCNc1ccc(nn1)F 243b43310d3eb40fd9cb6fb51a1e8a34 [1,1,0,0,0,0|2,0,0]=4 617 B10R1.1 CCNc1ccc(nn1)I e6168a360292a5203c1c39b76c0832e4 [1,1,0,0,0,0|2,0,0]=4 618 B10R1.1 CCNc1cnc(cn1)Br 6193fdd09c4d7196a3aa4cf36704c96a [1,1,0,0,0,0|2,0,0]=4 619 B10R1.1 CCNc1cnc(cn1)C 941166f6068049435314cb9c37d7492a [1,1,0,0,0,0|2,0,0]=4 620 B10R1.1 CCNc1cnc(cn1)Cl f988f1cb66650f066f78da27c7a3b727 [1,1,0,0,0,0|2,0,0]=4 621 B10R1.1 CCNc1cnc(cn1)I 35cfe6dab3f2769a734da88f1f6d579b [1,1,0,0,0,0|2,0,0]=4 622 B10R1.1 CCNc1ncc(cn1)Br 4040526de2d7248a48865f56df2270db [1,1,0,0,0,0|2,0,0]=4 623 B10R1.1 CCNc1ncc(cn1)C 3f4bd72477650785097ae0cf22dff716 [1,1,0,0,0,0|2,0,0]=4 624 B10R1.1 CCNc1ncc(cn1)Cl 7a344d98a883fab6d3d95f928bcbca24 [1,1,0,0,0,0|2,0,0]=4 625 B10R1.1 CCNc1ncc(cn1)F df61d530f9c9fb699cc17117f69a840b [1,1,0,0,0,0|2,0,0]=4 626 B10R1.1 CCNc1ncc(cn1)I cdbf0f62cbf43ba882cafeec94b25aea [1,1,0,0,0,0|2,0,0]=4 627 B10R1.1 CCOc1ccc(cc1)Br 0e76a95a836dd2981a43d0b194227fd8 [1,1,0,0,0,0|2,0,0]=4 628 B10R1.1 CCOc1ccc(cc1)C 26efd14f9e8649940b64cdf1b3738f1b [1,1,0,0,0,0|2,0,0]=4 629 B10R1.1 CCOc1ccc(cc1)Cl 945eb2c259d4cb8905c1789c25d510a9 [1,1,0,0,0,0|2,0,0]=4 630 B10R1.1 CCOc1ccc(cc1)F 5faab7d15ff0cf2f779560e4d5e7448c [1,1,0,0,0,0|2,0,0]=4 631 B10R1.1 CCOc1ccc(cc1)I 53aa34317b2540d22d9ec7de628cac3d [1,1,0,0,0,0|2,0,0]=4 632 B10R1.1 CCOc1ccc(cc1)S 99269a211e814d9abbdc09864e525389 [1,1,0,0,0,0|2,0,0]=4 633 B10R1.1 CCOc1ccc(cn1)C f777259bf4373954cda4bbb8405a47a2 [1,1,0,0,0,0|1,0,0]=3 634 B10R1.1 CCOc1ccc(cn1)Cl cd4f070a79f4939e7eca32fa7a8d0e7f [1,1,0,0,0,0|1,0,0]=3 635 B10R1.1 CCOc1ccc(cn1)F b50f8cb60dc9806fa9d9175eac7405e9 [1,1,0,0,0,0|1,0,0]=3 636 B10R1.1 CCOc1ccc(cn1)I 134eef0ef437844eb5a79430a3f4f022 [1,1,0,0,0,0|1,0,0]=3 637 B10R1.1 CCOc1ccc(nn1)Br aa3efeb23c5d2c39f110d43a02a7d163 [1,1,0,0,0,0|2,0,0]=4 638 B10R1.1 CCOc1ccc(nn1)C ee9fd1014ff64a75b92c11dd9cb2cc10 [1,1,0,0,0,0|2,0,0]=4 639 B10R1.1 CCOc1ccc(nn1)Cl e6c7617f85409e01211416488dbdaaeb [1,1,0,0,0,0|2,0,0]=4 640 B10R1.1 CCOc1cnc(cn1)Br 83cb7a09f1f3b33c9793e617c55d72e4 [1,1,0,0,0,0|2,0,0]=4 641 B10R1.1 CCOc1cnc(cn1)C a6786d3b21f17a52c07e0a7cd8d71436 [1,1,0,0,0,0|2,0,0]=4 642 B10R1.1 CCOc1cnc(cn1)Cl 76caff5da4dacc7bb582efd551ad366e [1,1,0,0,0,0|2,0,0]=4 643 B10R1.1 CCOc1cnc(cn1)I 974b9f18a3a0669671ad64bfebfa9c92 [1,1,0,0,0,0|2,0,0]=4 644 B10R1.1 CCOc1ncc(cn1)Br f2af67c3da219d39304c6a9d51d28848 [1,1,0,0,0,0|2,0,0]=4 645 B10R1.1 CCOc1ncc(cn1)C 56af84268e29eb3d38823688824a5b11 [1,1,0,0,0,0|2,0,0]=4 646 B10R1.1 CCOc1ncc(cn1)F 6348467aae55545bc3c0f026dd5f71d7 [1,1,0,0,0,0|2,0,0]=4 647 B10R1.1 CCOc1ncc(cn1)I a18941d69d14d35a42d1ea0119275f85 [1,1,0,0,0,0|2,0,0]=4 648 B10R1.1 Cc1ccc(nc1)NCF fe6e1acd0e3bc2d9ee7e6564901f4999 [1,1,0,0,0,0|2,0,0]=4 649 B10R1.1 Cc1ccc(nc1)NCO a3d787a21cbcad7f0f8fd58a7dfe7945 [1,1,0,0,0,0|2,0,0]=4 650 B10R1.1 Cc1ccc(nc1)OCF 17072532157ece6c6315bad9dab956ea [1,1,0,0,0,0|2,0,0]=4 651 B10R1.1 FCNc1ccc(cn1)Br 97dbb7cffe38663e2c1630b63da1c21e [1,1,0,0,0,0|2,0,0]=4 652 B10R1.1 FCNc1ccc(cn1)Cl de79e5aad07722b1392cd20e0aa769b4 [1,1,0,0,0,0|2,0,0]=4 653 B10R1.1 FCNc1ccc(cn1)F a351d2df87c785e9f4b7093ddad55a10 [1,1,0,0,0,0|2,0,0]=4 654 B10R1.1 FCNc1ccc(cn1)I cffdbc36eae146d283a876d0c15de813 [1,1,0,0,0,0|2,0,0]=4 655 B10R1.1 FCOc1ccc(cn1)Cl 61f6fd78e0abeeb2eb97b4aa2b12a9c9 [1,1,0,0,0,0|2,0,0]=4 656 B10R1.1 FCOc1ccc(cn1)F b1e868aec0faffebe89225e907274205 [1,1,0,0,0,0|2,0,0]=4 657 B10R1.1 FCOc1ccc(cn1)I 00c1ef2fd48be5d55550cc9694fd8f08 [1,1,0,0,0,0|2,0,0]=4 658 B10R1.1 OCNc1ccc(cn1)Br df4ffeb7d3426fa3f30c970836be5a07 [1,1,0,0,0,0|2,0,0]=4 659 B10R1.1 OCNc1ccc(cn1)Cl d8643f93dc56c4026f45d75600865cf1 [1,1,0,0,0,0|2,0,0]=4 660 B10R1.1 OCNc1ccc(cn1)F c678380a06127762dfcfe4f997000000 [1,1,0,0,0,0|2,0,0]=4 661 B10R1.1 OCNc1ccc(cn1)I 4da26305a3e4c2d76ed4b2a820524344 [1,1,0,0,0,0|2,0,0]=4 662 B10R1.4 CCNc1cccc[n+]1[O-] 02091f95b7d222da69935edad316aa89 [1,1,0,0,0,0|1,0,1]=4 663 B10R1.4 CCNc1ccccc1Cl 2dfb513d252d373232906f5030075d40 [1,1,0,0,0,0|2,0,0]=4 664 B10R1.4 CCNc1ccccc1F 7ab2c72548cf5934972f59a05bcf3b98 [1,1,0,0,0,0|2,0,0]=4 665 B10R1.4 CCNc1ccccc1I a15e1e777d9cb3c3c67c713eae1f152f [1,1,0,0,0,0|2,0,0]=4 666 B10R1.4 CCNc1ncccc1Br c725f87792bbf69d61dad0e1008718dc [1,1,0,0,0,0|1,0,0]=3 667 B10R1.4 CCNc1ncccc1C a7fd36b27f175706adc74e2aac7526d2 [1,1,0,0,0,0|1,0,0]=3 668 B10R1.4 CCNc1ncccc1Cl 38db51258030951890daf204f7ed0b90 [1,1,0,0,0,0|1,0,0]=3 669 B10R1.4 CCNc1ncccc1F 708bbe73960ac127c7a4adb5124c7937 [1,1,0,0,0,0|1,0,0]=3 670 B10R1.4 CCNc1ncccc1I 816a15b4e18519781f24dc419625ba99 [1,1,0,0,0,0|1,0,0]=3 671 B10R1.4 CCNc1nccnc1Br 2d907f4bd6f02c9cef277fbcf41c453b [1,1,0,0,0,0|2,0,0]=4 672 B10R1.4 CCNc1nccnc1C 3a642966a1abe913b5ad08a3a9152c71 [1,1,0,0,0,0|2,0,0]=4 673 B10R1.4 CCNc1nccnc1Cl e6a9b6e484a84024d5e12240604a943c [1,1,0,0,0,0|2,0,0]=4 674 B10R1.4 CCNc1nccnc1I 4c45ef2dd2308c7078fb2cb28ca195b4 [1,1,0,0,0,0|2,0,0]=4 675 B10R1.4 CCNc1ncncc1Br 776190b60a7f3a91d5da2318056a2d31 [1,1,0,0,0,0|2,0,0]=4 676 B10R1.4 CCNc1ncncc1C 43473af78e8552e155b26029efd11eef [1,1,0,0,0,0|2,0,0]=4 677 B10R1.4 CCNc1ncncc1Cl f68368affea4d6fac57dca77e3361620 [1,1,0,0,0,0|2,0,0]=4 678 B10R1.4 CCNc1ncncc1F 212860f0bf0a1c43582a34701793fdce [1,1,0,0,0,0|2,0,0]=4 679 B10R1.4 CCNc1ncncc1I cf9da49e717641bfa7a2176d08cf0b57 [1,1,0,0,0,0|2,0,0]=4 680 B10R1.4 CCNc1nnccc1C 691f3c86375c4bbd77548a51226e95ba [1,1,0,0,0,0|2,0,0]=4 681 B10R1.4 CCOc1cccc[n+]1[O-] 5e2e6a3eb33be14884bc8c1831a174ad [1,1,0,0,0,0|1,0,1]=4 682 B10R1.4 CCOc1ccccc1C dc9ee1b6b8a241cf6f51757c9fedb385 [1,1,0,0,0,0|2,0,0]=4 683 B10R1.4 CCOc1ccccc1Cl 9b9ed61fe6629f2df6b1eaddc9ec2e8a [1,1,0,0,0,0|2,0,0]=4 684 B10R1.4 CCOc1ccccc1F 41f85306b1c4b7c4daecba5a00d66cce [1,1,0,0,0,0|2,0,0]=4 685 B10R1.4 CCOc1ccccc1I 3bfd90529c85539df6076f624de1f80d [1,1,0,0,0,0|2,0,0]=4 686 B10R1.4 CCOc1ncccc1Br f4383148a14f49cafea4eeb34cba2f7d [1,1,0,0,0,0|1,0,0]=3 687 B10R1.4 CCOc1ncccc1C e8543da7a575b70db65e7933cc01e850 [1,1,0,0,0,0|1,0,0]=3 688 B10R1.4 CCOc1ncccc1Cl 4590ed1a2376b9070dd9165912ca6275 [1,1,0,0,0,0|1,0,0]=3 689 B10R1.4 CCOc1ncccc1F a8635691cfd51eb96b174213d32b56ee [1,1,0,0,0,0|1,0,0]=3 690 B10R1.4 CCOc1nccnc1Br e4d444716c2ebf53c1141d98c73fd09e [1,1,0,0,0,0|2,0,0]=4 691 B10R1.4 CCOc1nccnc1C 51150a087141b1b997c624a726b47861 [1,1,0,0,0,0|2,0,0]=4 692 B10R1.4 CCOc1ncncc1C a024efe8fb00db7ba69958a60fccd3f1 [1,1,0,0,0,0|2,0,0]=4 693 B10R1.4 CCOc1ncncc1Cl baf3074e160d95af14877f098ce4c454 [1,1,0,0,0,0|2,0,0]=4 694 B10R1.4 CCOc1ncncc1F 728e85916adb62f618f1aa3e58b782a8 [1,1,0,0,0,0|2,0,0]=4 695 B10R1.4 CCOc1ncncc1I 411da86833c2ea37cd365410f2cc6b30 [1,1,0,0,0,0|2,0,0]=4 696 B10R1.4 CCOc1nnccc1C c18a8624109f039b80ba9ad6e855516b [1,1,0,0,0,0|2,0,0]=4 697 B10R1.4 CCOc1nnccc1Cl d603eca91d68438f9f871d8ac5a608c2 [1,1,0,0,0,0|2,0,0]=4 698 B10R1.4 CCOc1nnccc1I 2a8322b50ab03b887bc90327d5ab3a23 [1,1,0,0,0,0|2,0,0]=4 699 B10R1.4 Cc1cccnc1NCF a50507f84ba24efa08f9b480ecf323d7 [1,1,0,0,0,0|2,0,0]=4 700 B10R1.4 Cc1cccnc1NCO b9826d2a8449ec373392c9bb98cfc60e [1,1,0,0,0,0|2,0,0]=4 701 B10R1.4 Cc1cccnc1OCF 5dd471f10667f5296180df2f634c17da [1,1,0,0,0,0|2,0,0]=4 702 B10R1.4 FCNc1ncccc1Br ff127c6c3b6cc03a6158a26130c7ceb9 [1,1,0,0,0,0|2,0,0]=4 703 B10R1.4 FCNc1ncccc1Cl ee7f62322d6173d33104d3a3ad3410de [1,1,0,0,0,0|2,0,0]=4 704 B10R1.4 FCNc1ncccc1F dd1e716905807c717718076244f092d6 [1,1,0,0,0,0|2,0,0]=4 705 B10R1.4 FCNc1ncccc1I a562e497b86b300b35ecae48de722972 [1,1,0,0,0,0|2,0,0]=4 706 B10R1.4 FCOc1ncccc1Br 3158c5616a8a0c4303904be077035407 [1,1,0,0,0,0|2,0,0]=4 707 B10R1.4 FCOc1ncccc1Cl 2c7f9a4204d7a10bfe25c8e8ac38c90d [1,1,0,0,0,0|2,0,0]=4 708 B10R1.4 FCOc1ncccc1F 7486a90e33b2c0d774a0bcb0fd24b075 [1,1,0,0,0,0|2,0,0]=4 709 B10R1.4 OCNc1ncccc1Br 77f1d94fff1c3354e71f7578b9db6e71 [1,1,0,0,0,0|2,0,0]=4 710 B10R1.4 OCNc1ncccc1Cl 256af2a4e5339bf92fd701c592729960 [1,1,0,0,0,0|2,0,0]=4 711 B10R1.4 OCNc1ncccc1F dba34b55d72c76512ea1914953015207 [1,1,0,0,0,0|2,0,0]=4 712 B10R1.4 OCNc1ncccc1I f23791fb28fbf315ed36948d7065f414 [1,1,0,0,0,0|2,0,0]=4 713 B10R1.10 CCNc1cc(ccn1)Br d059085370442a13584ded71a5ddc9b8 [1,1,0,0,0,0|1,0,0]=3 714 B10R1.10 CCNc1cc(ccn1)C ead6e66bc426bd20a03df23491bb9b54 [1,1,0,0,0,0|1,0,0]=3 715 B10R1.10 CCNc1cc(ccn1)Cl b2a45afedb1a2c06b6d2ed398b1b9fd7 [1,1,0,0,0,0|1,0,0]=3 716 B10R1.10 CCNc1cc(ccn1)F fbdfc8a9a414de8ffb419ecbd943de26 [1,1,0,0,0,0|1,0,0]=3 717 B10R1.10 CCNc1cc(ccn1)I d53a5d370716816198e976ed0d538017 [1,1,0,0,0,0|1,0,0]=3 718 B10R1.10 CCNc1cc(cnn1)Br 130f90fa291f924963953a2617e18d74 [1,1,0,0,0,0|2,0,0]=4 719 B10R1.10 CCNc1cc(cnn1)C df853daeb5beb8e11e5de6535edde9e0 [1,1,0,0,0,0|2,0,0]=4 720 B10R1.10 CCNc1cc(cnn1)Cl 7f86a4c17d3afab280cee5584f6c9186 [1,1,0,0,0,0|2,0,0]=4 721 B10R1.10 CCNc1cc(ncn1)Br 697814c9cbc9020b63a5753161ff4203 [1,1,0,0,0,0|2,0,0]=4 722 B10R1.10 CCNc1cc(ncn1)C b1c6d3b0277aa9e6703ce1ebdf90b7a8 [1,1,0,0,0,0|2,0,0]=4 723 B10R1.10 CCNc1cc(ncn1)Cl 239d70edd51b7cabd71ee9f51e9168e1 [1,1,0,0,0,0|2,0,0]=4 724 B10R1.10 CCNc1cc(ncn1)F 63c6e5d5591a8b901f5b07e2aee5ee2a [1,1,0,0,0,0|2,0,0]=4 725 B10R1.10 CCNc1cc(ncn1)I 53bfc57cd09616ab42770ff3469a11d0 [1,1,0,0,0,0|2,0,0]=4 726 B10R1.10 CCNc1cc[nH]c(=O)n1 0a6dc2f14b0bb3b0c497c7ffbd955247 [1,1,0,0,0,0|2,0,0]=4 727 B10R1.10 CCNc1cccc(c1)Br 3559ffa0b462d1bd714cf3ca993ed95e [1,1,0,0,0,0|2,0,0]=4 728 B10R1.10 CCNc1cccc(c1)C 7e90094bdff0d2ffec0927834a6a088a [1,1,0,0,0,0|2,0,0]=4 729 B10R1.10 CCNc1cccc(c1)Cl e86c6a0dbdc5ec7691435dfb2bf0caac [1,1,0,0,0,0|2,0,0]=4 730 B10R1.10 CCNc1cccc(c1)F fb10d26ad355d9adf069631a680226b5 [1,1,0,0,0,0|2,0,0]=4 731 B10R1.10 CCNc1cccc(c1)I 9531fa5d8f78367f3126484c4e782fa9 [1,1,0,0,0,0|2,0,0]=4 732 B10R1.10 CCNc1cccc(c1)S a44d310b6eb926e6cc396b05b3cff23a [1,1,0,0,0,0|2,0,0]=4 733 B10R1.10 CCNc1cccc(n1)Br bdf3c98d55e3185cc2a435a8a4fbf30b [1,1,0,0,0,0|1,0,0]=3 734 B10R1.10 CCNc1cccc(n1)C a6d43cd595c5eb0b178fe2416f91b131 [1,1,0,0,0,0|1,0,0]=3 735 B10R1.10 CCNc1cccc(n1)Cl 5a7a857b9ff459dab8398e6aa9d75650 [1,1,0,0,0,0|1,0,0]=3 736 B10R1.10 CCNc1cccc(n1)F 5b24b54d716d9dced5c7bc536933db9c [1,1,0,0,0,0|1,0,0]=3 737 B10R1.10 CCNc1cccc(n1)I 5bd2f7aa302878c630f540d50c1902a7 [1,1,0,0,0,0|1,0,0]=3 738 B10R1.10 CCNc1ccnc(n1)Br a585973a8c919a7b09f709aed55cacdf [1,1,0,0,0,0|2,0,0]=4 739 B10R1.10 CCNc1ccnc(n1)C d168f3526a84c167c0cca101bf3886ab [1,1,0,0,0,0|2,0,0]=4 740 B10R1.10 CCNc1ccnc(n1)Cl 1dd9b7b7cc179cf8d98edf94a1fa1f77 [1,1,0,0,0,0|2,0,0]=4 741 B10R1.10 CCNc1ccnc(n1)F 3fe489000a1e48ed5042647c862eca0b [1,1,0,0,0,0|2,0,0]=4 742 B10R1.10 CCNc1ccnc(n1)S 803d5de29daf1b488485ba113a2fcec2 [1,1,0,0,0,0|2,0,0]=4 743 B10R1.10 CCNc1cncc(n1)Br 770b397851bc6547edd2c903a2ac898f [1,1,0,0,0,0|2,0,0]=4 744 B10R1.10 CCNc1cncc(n1)C c6553f13dc26f5036471e9acc89e9094 [1,1,0,0,0,0|2,0,0]=4 745 B10R1.10 CCNc1cncc(n1)Cl 19802d29a0366658b0d20a1b222f5acc [1,1,0,0,0,0|2,0,0]=4 746 B10R1.10 CCNc1cncc(n1)F dc25744462a94011d6172cb1be08948d [1,1,0,0,0,0|2,0,0]=4 747 B10R1.10 CCNc1nccc(=O)[nH]1 6d85a47f7605b912a336f23a28650da0 [1,1,0,0,0,0|2,0,0]=4 748 B10R1.10 CCNc1nccc(n1)Br f9b0ae4f74bc1fd78659809b425a8797 [1,1,0,0,0,0|2,0,0]=4 749 B10R1.10 CCNc1nccc(n1)C c29d6d41a98fdca8c64782e06e12e5ad [1,1,0,0,0,0|2,0,0]=4 750 B10R1.10 CCNc1nccc(n1)Cl b743ba9c2005c35f72ee7928b1b4c582 [1,1,0,0,0,0|2,0,0]=4 751 B10R1.10 CCNc1nccc(n1)F 38420ada048620d972464def5477629d [1,1,0,0,0,0|2,0,0]=4 752 B10R1.10 CCNc1nccc(n1)I 37c9f8f03180ae8a91bea10d30015ac4 [1,1,0,0,0,0|2,0,0]=4 753 B10R1.10 CCNc1nccc(n1)S fec9a5b819c1f8b69a1d63f9926bfa8a [1,1,0,0,0,0|2,0,0]=4 754 B10R1.10 CCOc1cc(ccn1)Br 47baa3e649bbd6c09eab191c6164e915 [1,1,0,0,0,0|1,0,0]=3 755 B10R1.10 CCOc1cc(ccn1)C 2da9c0524b55cd9ee02f9192b348218b [1,1,0,0,0,0|1,0,0]=3 756 B10R1.10 CCOc1cc(ccn1)Cl f1569f953b6ce89dfd8a230ba1b746f0 [1,1,0,0,0,0|1,0,0]=3 757 B10R1.10 CCOc1cc(ccn1)F b1acf79f5addc912dd21fb19cb9afccc [1,1,0,0,0,0|1,0,0]=3 758 B10R1.10 CCOc1cc(ncn1)Br 8308b802e0724f252d8e17e7f74e23d0 [1,1,0,0,0,0|2,0,0]=4 759 B10R1.10 CCOc1cc(ncn1)C 32aed1e82b8f4aa7523f5f5a34fcd17b [1,1,0,0,0,0|2,0,0]=4 760 B10R1.10 CCOc1cc(ncn1)Cl 7974f5f31331a9eaf074175333c9c7fd [1,1,0,0,0,0|2,0,0]=4 761 B10R1.10 CCOc1cccc(=O)[nH]1 c94839f401af37d9f4dfdf393db93386 [1,1,0,0,0,0|1,0,1]=4 762 B10R1.10 CCOc1cccc(c1)Br 59b0f5cf1b6eeed19f09ca4b10ff10f6 [1,1,0,0,0,0|2,0,0]=4 763 B10R1.10 CCOc1cccc(c1)C c484b8098bb494764323b4d807c3d871 [1,1,0,0,0,0|2,0,0]=4 764 B10R1.10 CCOc1cccc(c1)Cl 0302a2b3778df08595f07cb1f730b10b [1,1,0,0,0,0|2,0,0]=4 765 B10R1.10 CCOc1cccc(c1)F e3c752114bd9c3d3cb33513b156f9036 [1,1,0,0,0,0|2,0,0]=4 766 B10R1.10 CCOc1cccc(c1)I 0d8a8a4223f2d3d3697a5720204df0bd [1,1,0,0,0,0|2,0,0]=4 767 B10R1.10 CCOc1cccc(c1)S 0a6998f5983825c4343bcc0ed4a9090c [1,1,0,0,0,0|2,0,0]=4 768 B10R1.10 CCOc1cccc(n1)Br 7baff524721e41ab6ff879a1139b25ea [1,1,0,0,0,0|1,0,0]=3 769 B10R1.10 CCOc1cccc(n1)C 8886c898bef83c4de5a441ddd5f1e8cd [1,1,0,0,0,0|1,0,0]=3 770 B10R1.10 CCOc1cccc(n1)F d128ec09e8d7b22b6dee7bd24841de35 [1,1,0,0,0,0|1,0,0]=3 771 B10R1.10 CCOc1ccnc(n1)C 75a439f9f8e7946ad9bf1fd305e7c9d8 [1,1,0,0,0,0|2,0,0]=4 772 B10R1.10 CCOc1ccnc(n1)Cl 91a4e1ace2a0e123093d0ccfd945c9d9 [1,1,0,0,0,0|2,0,0]=4 773 B10R1.10 CCOc1cncc(n1)Br ac72de76110949789a848aac900ff2b7 [1,1,0,0,0,0|2,0,0]=4 774 B10R1.10 CCOc1cncc(n1)Cl 3eb84960d06478c872d1ba605fcc4563 [1,1,0,0,0,0|2,0,0]=4 775 B10R1.10 CCOc1nccc(n1)Cl e6b0e530d0990adcd4b6e76784df0d52 [1,1,0,0,0,0|2,0,0]=4 776 B10R1.10 CCOc1nccc(n1)S ad371522117e8d52ec5db09f3ab288f8 [1,1,0,0,0,0|2,0,0]=4 777 B10R1.10 Cc1cccc(n1)NCF 1e3f9809b31f3fc5fab147106f55298b [1,1,0,0,0,0|2,0,0]=4 778 B10R1.10 Cc1cccc(n1)NCO 14b645ff6dbf83910f77237887d6e3d4 [1,1,0,0,0,0|2,0,0]=4 779 B10R1.10 Cc1cccc(n1)OCF b3498809d07b593ac65fa8366a60fc47 [1,1,0,0,0,0|2,0,0]=4 780 B10R1.10 Cc1ccnc(c1)NCF 31c400343bde1442590da391836b32b7 [1,1,0,0,0,0|2,0,0]=4 781 B10R1.10 Cc1ccnc(c1)NCO 65994d174363031ffa8868b3de8821ab [1,1,0,0,0,0|2,0,0]=4 782 B10R1.10 Cc1ccnc(c1)OCF a855573c2f3977bb1d8ad14a559749a4 [1,1,0,0,0,0|2,0,0]=4 783 B10R1.10 FCNc1cc(ccn1)Br b875b2ceb1778c666a0eae60b4c64154 [1,1,0,0,0,0|2,0,0]=4 784 B10R1.10 FCNc1cc(ccn1)Cl 6e1ef5aefe35b04968d6d6570fa47896 [1,1,0,0,0,0|2,0,0]=4 785 B10R1.10 FCNc1cc(ccn1)F 5304591a47bc9baf3a0ec5df6f072d32 [1,1,0,0,0,0|2,0,0]=4 786 B10R1.10 FCNc1cc(ccn1)I ae0fae2b6a90a1e2f8e5db6c84dc6a7f [1,1,0,0,0,0|2,0,0]=4 787 B10R1.10 FCNc1cccc(n1)Br 02249079fae79daf1e8b7b0e8da7d52a [1,1,0,0,0,0|2,0,0]=4 788 B10R1.10 FCNc1cccc(n1)Cl 5191693eba12ac9445ac0f2f90d86dc4 [1,1,0,0,0,0|2,0,0]=4 789 B10R1.10 FCNc1cccc(n1)F 250fd56b349c92386037a78111222027 [1,1,0,0,0,0|2,0,0]=4 790 B10R1.10 FCNc1cccc(n1)I 2b53b9176940ed73f17ffe5e8b871f36 [1,1,0,0,0,0|2,0,0]=4 791 B10R1.10 FCOc1cc(ccn1)Br 155790c32b511ef5a26b3849c8943a50 [1,1,0,0,0,0|2,0,0]=4 792 B10R1.10 FCOc1cc(ccn1)Cl 851f11d9ae8e8cbf8991b7e4955929f7 [1,1,0,0,0,0|2,0,0]=4 793 B10R1.10 FCOc1cc(ccn1)F f3d7e1041b5fea8a9efda57c7d01725f [1,1,0,0,0,0|2,0,0]=4 794 B10R1.10 FCOc1cccc(n1)Br 4cc930fa65bc5ab943bdbf8f8ea3c9b1 [1,1,0,0,0,0|2,0,0]=4 795 B10R1.10 FCOc1cccc(n1)F 10dab638079e2da06e38259839bd6105 [1,1,0,0,0,0|2,0,0]=4 796 B10R1.10 OCNc1cc(ccn1)Br 16aad26f9e609d5d8d2a1c7fb05ca65b [1,1,0,0,0,0|2,0,0]=4 797 B10R1.10 OCNc1cc(ccn1)Cl 2b06f0190859c78504d004a8e6534b2d [1,1,0,0,0,0|2,0,0]=4 798 B10R1.10 OCNc1cc(ccn1)F c7590a86957b6cff19c24517f150f55d [1,1,0,0,0,0|2,0,0]=4 799 B10R1.10 OCNc1cc(ccn1)I fe68574e126dc1d2ad8fea565fb194e5 [1,1,0,0,0,0|2,0,0]=4 800 B10R1.10 OCNc1cccc(n1)Br ec23cf0a73dbcad5ea46c52481edfe7e [1,1,0,0,0,0|2,0,0]=4 801 B10R1.10 OCNc1cccc(n1)Cl 9e37454f7ddda321db943a2776f00577 [1,1,0,0,0,0|2,0,0]=4 802 B10R1.10 OCNc1cccc(n1)F 8cbd1461b9b16d73df43b4022a07d4b9 [1,1,0,0,0,0|2,0,0]=4 803 B10R1.10 OCNc1cccc(n1)I 3dfc93003bb9b64fea97872de444ea1b [1,1,0,0,0,0|2,0,0]=4 804 B10R1.15 CCN(C)c1ccccc1 9cc6568b1f30abe04427bdea858da30e [1,1,0,0,0,0|2,0,0]=4 805 B10R1.15 CCN(C)c1ccncn1 d3188d994a55f552daffb246c4de2ff9 [1,1,0,0,0,0|2,0,0]=4 806 B10R1.15 CCN(C)c1cnccn1 a8ffa0df115721fdc6dd2269b8097d32 [1,1,0,0,0,0|2,0,0]=4 807 B10R1.15 CCN(C)c1ncccn1 2190b05b172124b2ca945163c4e222f5 [1,1,0,0,0,0|2,0,0]=4 808 B10R1.15 CN(CF)c1ccccn1 1bdd19ff0d205b3af825ce3149dae35a [1,1,0,0,0,0|2,0,0]=4 809 B10R1.15 CN(CO)c1ccccn1 a93cc933fdb4d1c91563e07701d40cda [1,1,0,0,0,0|2,0,0]=4 810 B10R1.17 BrCCNc1ccccc1 08c39138e90dcc3ad4c25fdba0569b67 [1,1,0,0,0,0|2,0,0]=4 811 B10R1.17 BrCCNc1ccccn1 3e3884def368abe14a8394ce1a1093e4 [1,1,0,0,0,0|1,0,0]=3 812 B10R1.17 BrCCNc1cccnn1 8bb1d2166673e66012e04a5297d759dc [1,1,0,0,0,0|2,0,0]=4 813 B10R1.17 BrCCNc1ccncn1 009ea89d37668eca0fd908b13fadca96 [1,1,0,0,0,0|2,0,0]=4 814 B10R1.17 C#CCNc1ccccn1 d6e1769cae1c3272157b84417d737e93 [1,1,0,0,0,0|0,0,2]=4 815 B10R1.17 C#CCOc1ccccn1 ed1d9c134ad2cbb060972098b462edbb [1,1,0,0,0,0|0,0,2]=4 816 B10R1.17 C=CCNc1ccccn1 a09a0780182f6d8fa8752ca3713a2f3e [1,1,0,0,0,0|0,0,2]=4 817 B10R1.17 C=CCOc1ccccn1 eb9f74f9d52407e143455993efad096c [1,1,0,0,0,0|0,0,2]=4 818 B10R1.17 CCCNc1ccccc1 b539dcf8361adb43cc5ffbb8617222f9 [1,1,0,0,0,0|1,0,0]=3 819 B10R1.17 CCCNc1ccccn1 d0e3424364e1c8a55b80e6e83d3696ba [1,1,0,0,0,0|0,0,0]=2 820 B10R1.17 CCCNc1cccnc1 54f0ece250e78709faf1eb2fd4dc869b [1,1,0,0,0,0|2,0,0]=4 821 B10R1.17 CCCNc1cccnn1 563334c6dadea743653cde03719d759b [1,1,0,0,0,0|1,0,0]=3 822 B10R1.17 CCCNc1ccncc1 d6095b2a5c05617a6cec49b81fb053c5 [1,1,0,0,0,0|2,0,0]=4 823 B10R1.17 CCCNc1ccncn1 b9fcfeaf51b4e3f06d605d771d307526 [1,1,0,0,0,0|1,0,0]=3 824 B10R1.17 CCCNc1cnccn1 21846cbecedbe2640cf1187c9cb12883 [1,1,0,0,0,0|1,0,0]=3 825 B10R1.17 CCCNc1cnncn1 ae485abbfb53ff29b4abc600381cf9a2 [1,1,0,0,0,0|2,0,0]=4 826 B10R1.17 CCCNc1ncccn1 75419027ddb25105c51dd1506820ccba [1,1,0,0,0,0|1,0,0]=3 827 B10R1.17 CCCNc1nccnn1 ba977de7796519a7c9234ce6324979fd [1,1,0,0,0,0|2,0,0]=4 828 B10R1.17 CCCNc1ncncn1 50d248fa06f762f479fc5160c627bfd9 [1,1,0,0,0,0|2,0,0]=4 829 B10R1.17 CCCOc1ccccn1 6e04423b9fd777130a88eaa9fd38fe0c [1,1,0,0,0,0|0,0,0]=2 830 B10R1.17 CCCOc1cccnc1 a97f517fc793a805aaab3ac7468bbd26 [1,1,0,0,0,0|2,0,0]=4 831 B10R1.17 CCCOc1ccncc1 f349ca52270425380eacc7a2a158cca4 [1,1,0,0,0,0|2,0,0]=4 832 B10R1.17 CCCOc1cnccn1 63621ef82dd8a608febe84451551c55a [1,1,0,0,0,0|1,0,0]=3 833 B10R1.17 CCCOc1cncnn1 bc5670d65c0c36d3b12443fc4957fbb6 [1,1,0,0,0,0|2,0,0]=4 834 B10R1.17 CCCOc1ncccn1 5c5a6b9b9ac104a48d6c4b0d32992f0c [1,1,0,0,0,0|1,0,0]=3 835 B10R1.17 CCNCc1ccccc1 b1285c6596ffdf0473a3780bf23df272 [1,1,0,0,0,0|1,0,0]=3 836 B10R1.17 CCNCc1ccccn1 18cfef8413e038075fdfe85720c8bb60 [1,1,0,0,0,0|0,0,0]=2 837 B10R1.17 CCNCc1cccnc1 ef83bfb13d2744bc293d6f1d68f67b86 [1,1,0,0,0,0|2,0,0]=4 838 B10R1.17 CCNCc1cccnn1 d81bd9bf1bc516576c473bbc4cf064a6 [1,1,0,0,0,0|1,0,0]=3 839 B10R1.17 CCNCc1ccncc1 2e26d8de78e71e06bcd28df387653244 [1,1,0,0,0,0|2,0,0]=4 840 B10R1.17 CCNCc1ccncn1 ae6a093ba5aef71c0ed8d67651e0dd26 [1,1,0,0,0,0|1,0,0]=3 841 B10R1.17 CCNCc1cnccn1 e42a4917d2a6a9dffed5bdafd4c5a5d6 [1,1,0,0,0,0|1,0,0]=3 842 B10R1.17 CCNCc1ncccn1 7e64da8f6dedc74d9803d8b0ac5afe0e [1,1,0,0,0,0|1,0,0]=3 843 B10R1.17 CCOCc1ccccc1 551a24ad73c54bc42b4e27015fdb411f [1,1,0,0,0,0|1,0,0]=3 844 B10R1.17 CCOCc1ccccn1 0c63694580ac3136b3801886d248907b [1,1,0,0,0,0|0,0,0]=2 845 B10R1.17 CCOCc1cccnc1 5f09f824e7a9d5177841898d80553992 [1,1,0,0,0,0|2,0,0]=4 846 B10R1.17 CCOCc1cccnn1 a18ecdaafc84bd92138525fb2f4ad399 [1,1,0,0,0,0|1,0,0]=3 847 B10R1.17 CCOCc1ccncc1 1d1afe04b02325a5cf955e686c22ba10 [1,1,0,0,0,0|2,0,0]=4 848 B10R1.17 CCOCc1ccncn1 d55d0b80fa8d405bad8866668c0f9fa7 [1,1,0,0,0,0|1,0,0]=3 849 B10R1.17 CCOCc1cnccn1 7fb271123056acc990d03d3767398eec [1,1,0,0,0,0|1,0,0]=3 850 B10R1.17 CCOCc1ncccn1 ba95357c7224be2db8f523f6aa6f9bb0 [1,1,0,0,0,0|1,0,0]=3 851 B10R1.17 COCNc1ccccc1 6c62c6b48b6ce69fe29d4b52e03d5674 [1,1,0,0,0,0|2,0,0]=4 852 B10R1.17 COCNc1ccccn1 a7abef3468bc69aa80ea510854a664da [1,1,0,0,0,0|1,0,0]=3 853 B10R1.17 COCNc1cccnn1 81506436050659ef73117567fa6791d8 [1,1,0,0,0,0|2,0,0]=4 854 B10R1.17 COCNc1ccncn1 0121271d6ad38ca03fde203df163daca [1,1,0,0,0,0|2,0,0]=4 855 B10R1.17 COCNc1cnccn1 e1b86a322d65d71968ad3b0b53c14350 [1,1,0,0,0,0|2,0,0]=4 856 B10R1.17 COCNc1ncccn1 3760316947979d077818f7dd79f44e4b [1,1,0,0,0,0|2,0,0]=4 857 B10R1.17 COCOc1ccccn1 20cd252a71a5a01c3e93af63053a4326 [1,1,0,0,0,0|1,0,0]=3 858 B10R1.17 COCOc1cnccn1 91692ef16c539c2f51ce9f654d4e167a [1,1,0,0,0,0|2,0,0]=4 859 B10R1.17 COCOc1ncccn1 2bd9fff082f7aee48935ad67be70ba10 [1,1,0,0,0,0|2,0,0]=4 860 B10R1.17 CSCNc1ccccc1 7a27a5c68b132b0ae36908396631930e [1,1,0,0,0,0|2,0,0]=4 861 B10R1.17 CSCNc1ccccn1 cc0ec9b3c5cc0b5eddbb2cfb429d6e35 [1,1,0,0,0,0|1,0,0]=3 862 B10R1.17 CSCNc1cccnn1 25ab19c91bfa446099e97e2e9884abac [1,1,0,0,0,0|2,0,0]=4 863 B10R1.17 CSCNc1ccncn1 c8f5e25272793ac1621ccdc638520744 [1,1,0,0,0,0|2,0,0]=4 864 B10R1.17 CSCNc1cnccn1 930f16f0ffaab42f985807a52dc0c6d1 [1,1,0,0,0,0|2,0,0]=4 865 B10R1.17 CSCNc1ncccn1 c2922d243c5be83b9b56350e712309ad [1,1,0,0,0,0|2,0,0]=4 866 B10R1.17 CSCOc1ccccn1 af78560ad465f4d707ca132fa83d0e3a [1,1,0,0,0,0|1,0,0]=3 867 B10R1.17 CSCOc1cnccn1 52ffcd2be78a9b2f46dfb44270cb610f [1,1,0,0,0,0|2,0,0]=4 868 B10R1.17 CSCOc1ncccn1 f123fda50715e79ccef9ccaf5caca47e [1,1,0,0,0,0|2,0,0]=4 869 B10R1.17 FCCNc1ccccc1 f275d2eb426a2818882d3c7dcacca572 [1,1,0,0,0,0|2,0,0]=4 870 B10R1.17 FCCNc1ccccn1 6ab197fb6cbd8dea7ad6d85c80356b58 [1,1,0,0,0,0|1,0,0]=3 871 B10R1.17 FCCNc1cccnn1 50662e1b5530675bc8d8d1093a0bcb88 [1,1,0,0,0,0|2,0,0]=4 872 B10R1.17 FCCNc1ccncn1 28287bfb6cdbc721436daf6264c17c69 [1,1,0,0,0,0|2,0,0]=4 873 B10R1.17 FCCNc1cnccn1 dd60db3af5d33017b5272adbacfa821e [1,1,0,0,0,0|2,0,0]=4 874 B10R1.17 FCCNc1ncccn1 b6a3f35367c076e0e2eb0138e0781769 [1,1,0,0,0,0|2,0,0]=4 875 B10R1.17 FCCOc1ccccn1 06b65dfb48082d4779fc37c34dadb476 [1,1,0,0,0,0|1,0,0]=3 876 B10R1.17 FCCOc1cnccn1 a0c148fc7e01278295d3fef98ce5f3d8 [1,1,0,0,0,0|2,0,0]=4 877 B10R1.17 FCCOc1ncccn1 20e83a8a3be70e78ea887ddb53a9464b [1,1,0,0,0,0|2,0,0]=4 878 B10R1.17 FCNCc1ccccc1 0dcd541b35f2d813e3bd4529f13aa61b [1,1,0,0,0,0|2,0,0]=4 879 B10R1.17 FCNCc1ccccn1 14327276004818c05fc55a3ce987673c [1,1,0,0,0,0|1,0,0]=3 880 B10R1.17 FCNCc1cccnn1 bce279edad5329c009e9b508fb1aee5b [1,1,0,0,0,0|2,0,0]=4 881 B10R1.17 FCNCc1ccncn1 86997bd0980cabeeea4fdf8cfb1980d9 [1,1,0,0,0,0|2,0,0]=4 882 B10R1.17 FCNCc1cnccn1 b6859870939f07ca1816c457c1ced744 [1,1,0,0,0,0|2,0,0]=4 883 B10R1.17 FCNCc1ncccn1 631804a848c2f7581758f33d98025650 [1,1,0,0,0,0|2,0,0]=4 884 B10R1.17 FCOCc1ccccc1 602c85a0828834d1798ab6d91c5aa92b [1,1,0,0,0,0|2,0,0]=4 885 B10R1.17 FCOCc1ccccn1 52de5aacdb8cde16edb0cbea31183c40 [1,1,0,0,0,0|1,0,0]=3 886 B10R1.17 FCOCc1cccnn1 be211298f0d8017761d0379df43db85c [1,1,0,0,0,0|2,0,0]=4 887 B10R1.17 FCOCc1ccncn1 095b77e062a0a54a0c13c35fafab8dee [1,1,0,0,0,0|2,0,0]=4 888 B10R1.17 FCOCc1cnccn1 a11466f76fde0f26dadf75b6a45d47be [1,1,0,0,0,0|2,0,0]=4 889 B10R1.17 FCOCc1ncccn1 01a146b5b6805692958b2312a16de3b5 [1,1,0,0,0,0|2,0,0]=4 890 B10R1.17 ICCNc1ccccc1 2e8d29f41a7952c3a309dd8ce57744b3 [1,1,0,0,0,0|2,0,0]=4 891 B10R1.17 ICCNc1cccnn1 25a4665350da72721cd932013095093a [1,1,0,0,0,0|2,0,0]=4 892 B10R1.17 N#CCNc1ccccn1 49c7d19f4d4a23e5bd1952f105c61103 [1,1,0,0,0,0|1,0,1]=4 893 B10R1.17 N#CCOc1ccccn1 34a3895b8030e0f5731db636d99745cf [1,1,0,0,0,0|1,0,1]=4 894 B10R1.17 N#CNCc1ccccn1 73d970ffa881cb91d14134c59642f4f6 [1,1,0,0,0,0|1,0,1]=4 895 B10R1.17 O=CCNc1ccccn1 b00390cf782e1a66064d84fbb4455a3c [1,1,0,0,0,0|1,0,1]=4 896 B10R1.17 O=CCOc1ccccn1 78f53edacda55ffdc5004f3168d63b47 [1,1,0,0,0,0|1,0,1]=4 897 B10R1.17 O=CNCc1ccccn1 2a4bd7c465ac0ab8804867d1eeb7fd18 [1,1,0,0,0,0|1,0,1]=4 898 B10R1.17 OCCNc1ccccc1 39a30f826fab6ed2b66a9ec4a9dddbdb [1,1,0,0,0,0|2,0,0]=4 899 B10R1.17 OCCNc1ccccn1 14d1f9671b0391e7cf5b318b74673aa8 [1,1,0,0,0,0|1,0,0]=3 900 B10R1.17 OCCNc1cccnn1 904669d1e67b66fbedf39e30d8f01302 [1,1,0,0,0,0|2,0,0]=4 901 B10R1.17 OCCNc1ccncn1 16630884411af81ebaafd51b9ece01ce [1,1,0,0,0,0|2,0,0]=4 902 B10R1.17 OCCNc1cnccn1 b8c8b329bec75a99372dd1b5fe38a887 [1,1,0,0,0,0|2,0,0]=4 903 B10R1.17 OCCNc1ncccn1 f239abfea1ae338c0c6b2d47a465751c [1,1,0,0,0,0|2,0,0]=4 904 B10R1.17 OCNCc1ccccc1 c4aaeb48f32c090af3c65531a6e27cd4 [1,1,0,0,0,0|2,0,0]=4 905 B10R1.17 OCNCc1ccccn1 9488b9a65408dc593594baac432012ff [1,1,0,0,0,0|1,0,0]=3 906 B10R1.17 OCNCc1cccnn1 ab22a6b6bf709ff19959feb80ebef395 [1,1,0,0,0,0|2,0,0]=4 907 B10R1.17 OCNCc1ccncn1 e1601b835614d257d03e1a317c6e849b [1,1,0,0,0,0|2,0,0]=4 908 B10R1.17 OCNCc1cnccn1 2e97e3c7cc39869beec41193ed233122 [1,1,0,0,0,0|2,0,0]=4 909 B10R1.17 OCNCc1ncccn1 c2a1de97786ff8120b7277138f237b3a [1,1,0,0,0,0|2,0,0]=4 910 B10R1.17 SCCNc1ccccc1 9bbad99372906cf90d9dd5df1e41681f [1,1,0,0,0,0|2,0,0]=4 911 B10R1.17 SCCNc1ccccn1 de2447df01f4514b4267a28db291424f [1,1,0,0,0,0|1,0,0]=3 912 B10R1.17 SCCNc1cccnn1 ea4f3403b14ed9358eb50c9965b8278f [1,1,0,0,0,0|2,0,0]=4 913 B10R1.17 SCCNc1ccncn1 2bfdb9a116c43f44649ab3d9243c2a49 [1,1,0,0,0,0|2,0,0]=4 914 B10R1.17 SCCNc1cnccn1 7a532bee0aa009efe26ced5e1fd07b4c [1,1,0,0,0,0|2,0,0]=4 915 B10R1.17 SCCNc1ncccn1 d101d1cc4fdf91fde35f39137b9892aa [1,1,0,0,0,0|2,0,0]=4 916 B10R1.17 SCCOc1ccccn1 80884e7103538d273738856f1f9d4222 [1,1,0,0,0,0|1,0,0]=3 917 B10R1.17 SCCOc1cnccn1 9ed631421fd79ea9b405fc40aac58272 [1,1,0,0,0,0|2,0,0]=4 918 B10R1.17 SCCOc1ncccn1 9ee0a1056d21851b24aff1da7da6461b [1,1,0,0,0,0|2,0,0]=4 919 B10R1.23 CC(C)N(C)c1cc[nH]n1 b361212e8717080c4b031123f4db3743 [0,1,0,0,1,0|2,0,0]=4 920 B10R1.23 CC(C)N(C)c1ccon1 354658eeef5c34df18131c4a519c898d [0,1,0,0,1,0|2,0,0]=4 921 B10R1.23 CC(C)N(C)c1ccsc1 cbe8ee114cc19a994a50bf9953012f36 [0,1,0,0,1,0|2,0,0]=4 922 B10R1.23 CC(C)N(C)c1ncc[nH]1 e996d76195205f3f8762c434c29d54b3 [0,1,0,0,1,0|2,0,0]=4 923 B10R1.23 CC(C)N(C)c1ncco1 032eaac749afe91f9dd6a126785485bb [0,1,0,0,1,0|2,0,0]=4 924 B10R1.23 CC(C)N(C)c1nccs1 0da716d314b46282d1113d22534674ca [0,1,0,0,1,0|2,0,0]=4 925 B10R1.27 CC(CO)Nc1c[nH]cn1 6eb72fdd51dd6b72bb521d8dfb245acb [0,1,0,0,1,0|2,0,0]=4 926 B10R1.27 CC(CO)Nc1cc[nH]n1 0ffd55994cce1a1b0cbcd9395752b322 [0,1,0,0,1,0|2,0,0]=4 927 B10R1.27 CC(CO)Nc1ccon1 f90964f8106751aa4c76d39a330214fd [0,1,0,0,1,0|2,0,0]=4 928 B10R1.27 CC(CO)Nc1ccsc1 d4ef7cd17bf5b12d95fcbd94ec641690 [0,1,0,0,1,0|2,0,0]=4 929 B10R1.27 CC(CO)Nc1cscn1 d0420bafbc963c287a91fad21e61ad63 [0,1,0,0,1,0|2,0,0]=4 930 B10R1.27 CC(CO)Nc1ncc[nH]1 dc65cc129b4d6607a3f16b77105f4174 [0,1,0,0,1,0|2,0,0]=4 931 B10R1.27 CC(CO)Nc1ncco1 476e20dc977ed373fbd6582477a12781 [0,1,0,0,1,0|2,0,0]=4 932 B10R1.27 CC(CO)Nc1nccs1 3af8aa6c51a5e4ace65bcef7b413dad9 [0,1,0,0,1,0|2,0,0]=4 933 B10R1.27 CCC(C)Nc1cc[nH]n1 09de7dfeb6644aa25d1b7ef6ff214ab5 [0,1,0,0,1,0|2,0,0]=4 934 B10R1.27 CCC(C)Nc1ccon1 414589f6fc16ca502b791f63f083c906 [0,1,0,0,1,0|2,0,0]=4 935 B10R1.27 CCC(C)Nc1ccsc1 7eaab02a416c25d5815b6ff6d36cc092 [0,1,0,0,1,0|2,0,0]=4 936 B10R1.27 CCC(C)Nc1cocn1 8b972e2f9ba535494feb0aec3203f3ae [0,1,0,0,1,0|2,0,0]=4 937 B10R1.27 CCC(C)Nc1cscn1 90fc9e14235e73feb81b47279a0cf0ea [0,1,0,0,1,0|2,0,0]=4 938 B10R1.27 CCC(C)Nc1ncc[nH]1 955376107bc7153bb56fe54fc04de2cf [0,1,0,0,1,0|2,0,0]=4 939 B10R1.27 CCC(C)Nc1ncco1 dd1a41bdc7d3616e95ccaa3968dfc430 [0,1,0,0,1,0|2,0,0]=4 940 B10R1.27 CCC(C)Nc1nccs1 14d585ec4dbfab69000ae73fa3ea4f85 [0,1,0,0,1,0|2,0,0]=4 941 B10R1.27 CCC(C)Oc1c[nH]cn1 14c44c5bc000242eb7c714fd3f30d115 [0,1,0,0,1,0|2,0,0]=4 942 B10R1.27 CCC(C)Oc1ccco1 d0beb7fde6d54ae64363161825c47c35 [0,1,0,0,1,0|2,0,0]=4 943 B10R1.27 CCC(C)Oc1cccs1 3541fcdf455861cca5d3a82e83b56fc2 [0,1,0,0,1,0|2,0,0]=4 944 B10R1.27 CCC(C)Oc1ccsc1 f6e91691f71a98584aafe2fd8c513359 [0,1,0,0,1,0|2,0,0]=4 945 B10R1.27 CCC(C)Oc1nccs1 552d81292af32750494a1fa49e5bd981 [0,1,0,0,1,0|2,0,0]=4 946 B10R1.27 CCC(C)On1cccn1 2390f189d726e5ed12116795d0aa5b0c [0,1,0,0,1,0|2,0,0]=4 947 B10R1.27 CCN(C)Cc1ccc[nH]1 e347aa0aab5f8b91131036b76761899f [0,1,0,0,1,0|1,0,1]=4 948 B10R1.27 CCN(C)Cc1ccco1 76ba84af7af62748e537e57011bb5102 [0,1,0,0,1,0|2,0,0]=4 949 B10R1.27 CCN(C)Cc1cccs1 5856368746510a7217772fc0f20fa2c2 [0,1,0,0,1,0|2,0,0]=4 950 B10R1.27 CCN(C)Cc1ccon1 c90d9e708af50f84c1e50522b4b05519 [0,1,0,0,1,0|2,0,0]=4 951 B10R1.27 CCN(C)Cc1ccsc1 ca9741e2c34ae2b58839e0376b12d3da [0,1,0,0,1,0|2,0,0]=4 952 B10R1.27 CCN(C)Cc1cocn1 cc520ad18a02391d9294dc6a870d4277 [0,1,0,0,1,0|2,0,0]=4 953 B10R1.27 CCN(C)Cc1cscn1 06b0ef73797210f2d8dd9715ba27cbeb [0,1,0,0,1,0|2,0,0]=4 954 B10R1.27 CCN(C)Cc1ncc[nH]1 51576a26cf23285268fc6a43ae44df8c [0,1,0,0,1,0|2,0,0]=4 955 B10R1.27 CCN(C)Cc1ncco1 fbd451ad928ae1f8a9b5356432adeaee [0,1,0,0,1,0|2,0,0]=4 956 B10R1.27 CCN(C)Cc1nccs1 83da24133995872d4de5fd709f9e84fb [0,1,0,0,1,0|2,0,0]=4 957 B10R1.27 CC[C@@H](C)Nc1nccs1 bd90c5ea462b27161ef27a60e27ab6aa [0,1,0,0,1,0|2,0,0]=4 958 B10R1.27 CC[C@H](C)Nc1nccs1 438f0d8e3c7d2f6718abcfb5a0246117 [0,1,0,0,1,0|2,0,0]=4 959 B10R1.27 CN(CF)Cc1ccc[nH]1 5acb32a101efb0b989c02eb95cb384e2 [0,1,0,0,1,0|1,0,1]=4 960 B10R1.27 CN(CF)Cc1ccco1 a8a8f0beb1fa78278a0baf9423982cd2 [0,1,0,0,1,0|2,0,0]=4 961 B10R1.27 CN(CF)Cc1ccoc1 decbe8b035ce5785d111d38c9def188e [0,1,0,0,1,0|2,0,0]=4 962 B10R1.27 CN(CF)Cc1ccsc1 9141582d3e3fae00d7a9bc1b13896e49 [0,1,0,0,1,0|2,0,0]=4 963 B10R1.27 CN(CF)Cc1ncc[nH]1 4e9c458f5ea3d2214ca9f7706459c7e4 [0,1,0,0,1,0|2,0,0]=4 964 B10R1.27 CN(CF)Cc1ncco1 1f4cfd94c4573d62c0a91fe2a7a54ada [0,1,0,0,1,0|2,0,0]=4 965 B10R1.27 CN(CF)Cc1nccs1 76b81ecc461bfd98c8cd773e6baa9fa4 [0,1,0,0,1,0|2,0,0]=4 966 B10R1.27 CN(CO)Cc1ccc[nH]1 c72aaf1507d6728f270abf1c4e66a3a9 [0,1,0,0,1,0|1,0,1]=4 967 B10R1.27 CN(CO)Cc1ccco1 e35a02611f613e4c724702badf0f544d [0,1,0,0,1,0|2,0,0]=4 968 B10R1.27 CN(CO)Cc1cccs1 a40c7fb2047d4e6a583417f484ade9f5 [0,1,0,0,1,0|2,0,0]=4 969 B10R1.27 CN(CO)Cc1ccoc1 618417c7a8474ba729bd3a7f7154463b [0,1,0,0,1,0|2,0,0]=4 970 B10R1.27 CN(CO)Cc1ccsc1 39352de0e71af3ee4958607fae092fa0 [0,1,0,0,1,0|2,0,0]=4 971 B10R1.27 CN(CO)Cc1ncc[nH]1 870d2e3d7bd3e228151c9a4447081ff6 [0,1,0,0,1,0|2,0,0]=4 972 B10R1.27 CN(CO)Cc1ncco1 18a5a35534ae83cc3936672ca18cdcd7 [0,1,0,0,1,0|2,0,0]=4 973 B10R1.27 CN(CO)Cc1nccs1 d06950d5c93aa4efb61588c7e01d60dc [0,1,0,0,1,0|2,0,0]=4 974 B10R1.27 C[C@@H](CO)Nc1c[nH]cn1 4d37ea81516d8b3a5ad800d13f38c6fc [0,1,0,0,1,0|2,0,0]=4 975 B10R1.27 C[C@@H](CO)Nc1cc[nH]n1 bd5e87838b6fa04965268423835b08a2 [0,1,0,0,1,0|2,0,0]=4 976 B10R1.27 C[C@@H](CO)Nc1ccsc1 0886900d68aecc92d8e1a439fbe53380 [0,1,0,0,1,0|2,0,0]=4 977 B10R1.27 C[C@@H](CO)Nc1cscn1 22be2db7c9adea2c3985a07cff732a41 [0,1,0,0,1,0|2,0,0]=4 978 B10R1.27 C[C@@H](CO)Nc1ncc[nH]1 cb8c1a0c0a3a444b7a97e5d80643c1f9 [0,1,0,0,1,0|2,0,0]=4 979 B10R1.27 C[C@@H](CO)Nc1ncco1 d4704a7540aa2361b2782f41f8ef8798 [0,1,0,0,1,0|2,0,0]=4 980 B10R1.27 C[C@@H](CO)Nc1nccs1 0bcb7a0b35e1463326ec7c2359e6f1cc [0,1,0,0,1,0|2,0,0]=4 981 B10R1.27 C[C@H](CO)Nc1c[nH]cn1 a9db3affd03815e8461b33aca9cef864 [0,1,0,0,1,0|2,0,0]=4 982 B10R1.27 C[C@H](CO)Nc1cc[nH]n1 06133ea0c7b0418e8486885775236cea [0,1,0,0,1,0|2,0,0]=4 983 B10R1.27 C[C@H](CO)Nc1ccsc1 a6f626205a030254be17ae1998a6bbac [0,1,0,0,1,0|2,0,0]=4 984 B10R1.27 C[C@H](CO)Nc1cscn1 769919f81796fd5fc01a621e09132665 [0,1,0,0,1,0|2,0,0]=4 985 B10R1.27 C[C@H](CO)Nc1ncc[nH]1 e959c8adf326dfc6c3beedbc3728b254 [0,1,0,0,1,0|2,0,0]=4 986 B10R1.27 C[C@H](CO)Nc1ncco1 b40b86c99c3d96039154be111d41b3a2 [0,1,0,0,1,0|2,0,0]=4 987 B10R1.27 C[C@H](CO)Nc1nccs1 50b88dc633b43e9b1ba1c862b8a07226 [0,1,0,0,1,0|2,0,0]=4 988 B10R1.54 CC(C)Nc1cc([nH]n1)Br 0ffc1a68c141762e97527be37bdbf679 [0,1,0,0,1,0|2,0,0]=4 989 B10R1.54 CC(C)Nc1cc([nH]n1)F fc4d0a89d2f55b6af53694a1243ccec6 [0,1,0,0,1,0|2,0,0]=4 990 B10R1.54 CC(C)Nc1ccn(n1)C a5b30ff65ff9ff1b84c75c4c9ad9d4ef [0,1,0,0,1,0|2,0,0]=4 991 B10R1.54 CC(C)Nc1cn(cn1)C f37a89307b25afe6cd397311b169c90e [0,1,0,0,1,0|2,0,0]=4 992 B10R1.54 CC(C)Nc1csc(n1)Br 2b73bd439788163c78c72759a5360207 [0,1,0,0,1,0|2,0,0]=4 993 B10R1.54 CC(C)Nc1nc(c[nH]1)Br b4c6b3201b8b30dc9018e3a39ff8b124 [0,1,0,0,1,0|2,0,0]=4 994 B10R1.54 CC(C)Nc1nc(cs1)Br 9f69873932eef12da6cb8297656acf07 [0,1,0,0,1,0|2,0,0]=4 995 B10R1.54 CC(C)Nc1nc(cs1)Cl 49fc32cb4238fbf101cabb009b43efbb [0,1,0,0,1,0|2,0,0]=4 996 B10R1.54 CC(C)Nc1ncc(s1)Cl 77ea293bc313ff699c37d37dca7802f2 [0,1,0,0,1,0|2,0,0]=4 997 B10R1.54 CC(C)Oc1cc(sn1)Cl c4601e2235d8564be85bd39d62d2a804 [0,1,0,0,1,0|2,0,0]=4 998 B10R1.54 CC(C)Oc1ccc(s1)Br f84299d81806a400101a9bd6e19aec9d [0,1,0,0,1,0|2,0,0]=4 999 B10R1.54 CC(C)Oc1ccn(n1)C e9d16db7474fc77811ecb6b1f259ab87 [0,1,0,0,1,0|2,0,0]=4 1000 B10R1.54 CC(C)Oc1nc(cs1)Br 538b9e89099c28c159cbe48ccf0c6ebd [0,1,0,0,1,0|2,0,0]=4 1001 B10R1.54 CC(C)On1cc(cn1)I 6e53c3adb6215d99b0b20ed15bb234b7 [0,1,0,0,1,0|2,0,0]=4 1002 B10R1.54 Cc1cc(n[nH]1)NC(C)C ead29f4ffad31f8adb23ee15dbb81676 [0,1,0,0,1,0|2,0,0]=4 1003 B10R1.54 Cc1cc(no1)NC(C)C 97d8cb8293e204bba8710064fc6e3cbf [0,1,0,0,1,0|2,0,0]=4 1004 B10R1.54 Cc1ccc(s1)NC(C)C 93bce7f187df330d71af93b5236b129c [0,1,0,0,1,0|2,0,0]=4 1005 B10R1.54 Cc1cnc([nH]1)NC(C)C c2f48ff478affffc86d99c32eac814e1 [0,1,0,0,1,0|2,0,0]=4 1006 B10R1.54 Cc1cnc(o1)NC(C)C 7e60d7afe3ab30d3ca96d7e5e37416d0 [0,1,0,0,1,0|2,0,0]=4 1007 B10R1.54 Cc1csc(c1)OC(C)C 373df1ff305189a72f1df4dff69c5fc9 [0,1,0,0,1,0|2,0,0]=4 1008 B10R1.54 Cc1csc(n1)NC(C)C 0b6dc34e13a21d1f67a396b31b538351 [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 Cc1c[nH]nc1NC(C)C 7c45d8168e95d90ca97c431c020d1fa5 [0,1,0,0,1,0|2,0,0]=4 1016 B10R1.64 Cc1c[nH]nc1OC(C)C 0e5c0597228ff1edf17f8ab72bdbde30 [0,1,0,0,1,0|2,0,0]=4 1017 B10R1.64 Cc1conc1NC(C)C a36a85dc743c4f7dbcc01d1b1f5f5f94 [0,1,0,0,1,0|2,0,0]=4 1018 B10R1.64 Cc1cscc1NC(C)C 11e8c8bc4103f1e121c35b28e2433683 [0,1,0,0,1,0|2,0,0]=4 1019 B10R1.64 Cc1sccc1NC(C)C 1c62e31d7906034669197c2462aece94 [0,1,0,0,1,0|2,0,0]=4 1020 B10R1.281 CC(C)(C)Nc1ccoc1 4e80022f7e43d707dd110162ffc0041c [0,1,0,0,1,0|2,0,0]=4 1021 B10R1.281 CC(C)(C)Nc1nccs1 935d300f1b1edb11b3bb58e7d6495434 [0,1,0,0,1,0|2,0,0]=4 1022 B12R1.21 C=C(C)CNc1ccc(cn1)Br 8fa314932172ff1748a16016ff8fb5bc [0,1,0,0,0,1|0,0,2]=4 1023 B12R1.21 C=C(C)CNc1ccc(cn1)C 2751c85b38999e12e111839a1e83e585 [0,1,0,0,0,1|0,0,2]=4 1024 B12R1.21 C=C(C)CNc1ccc(cn1)Cl ed112c72010f7ed2bde126f396549a94 [0,1,0,0,0,1|0,0,2]=4 1025 B12R1.21 C=C(C)CNc1ccc(cn1)F c17d556609b8b29c58c7cdecb0a35b25 [0,1,0,0,0,1|0,0,2]=4 1026 B12R1.21 C=C(C)CNc1ccc(cn1)I b3cb6b7178194f6b583b2b4c9a85b6fb [0,1,0,0,0,1|0,0,2]=4 1027 B12R1.21 C=C(C)COc1ccc(cn1)C 25be0804536d4e29e095269d235ade58 [0,1,0,0,0,1|0,0,2]=4 1028 B12R1.21 C=C(C)COc1ccc(cn1)Cl 66c90250d4577c529c6ba018d9aa4c4b [0,1,0,0,0,1|0,0,2]=4 1029 B12R1.21 C=C(C)COc1ccc(cn1)F ed9c4ad7fb4178bebb21d0ae13d9adb6 [0,1,0,0,0,1|0,0,2]=4 1030 B12R1.21 C=C(C)COc1ccc(cn1)I 0d213945f6233db9dd2ef32afc5e7c56 [0,1,0,0,0,1|0,0,2]=4 1031 B12R1.21 CC(=O)CNc1ccc(cn1)C bc36513c065be4bead67c38b364207e3 [0,1,0,0,0,1|1,0,1]=4 1032 B12R1.21 CC(=O)CNc1ccc(cn1)F 9e8a5506e8b30241e94f21f5b7f9a99b [0,1,0,0,0,1|1,0,1]=4 1033 B12R1.21 CC(=O)NCc1ccc(cn1)Br fb8f8537a7bbf570a19dea4d0aa6d18d [0,1,0,0,0,1|1,0,1]=4 1034 B12R1.21 CC(=O)NCc1ccc(cn1)C f38c03df8524acc05ebff836b6a5b5af [0,1,0,0,0,1|1,0,1]=4 1035 B12R1.21 CC(=O)NCc1ccc(cn1)Cl 6a011978ddf38308f5a5156573588194 [0,1,0,0,0,1|1,0,1]=4 1036 B12R1.21 CC(=O)NCc1ccc(cn1)F d40665011432ddf8f16403b67189332a [0,1,0,0,0,1|1,0,1]=4 1037 B12R1.21 CC(=O)NCc1ccc(cn1)O 7406aaf103c654960018dd961b73cac8 [0,1,0,0,0,1|1,0,1]=4 1038 B12R1.21 CC(C)CNc1ccc(=O)[nH]c1 3970684279a6ee0105700d3d18cb6e83 [0,1,0,0,0,1|2,0,0]=4 1039 B12R1.21 CC(C)CNc1ccc(cc1)Br aafc6d7f6bffefff521c174b2e36cf47 [0,1,0,0,0,1|1,0,0]=3 1040 B12R1.21 CC(C)CNc1ccc(cc1)Cl b590bea18aa2be2fe9530b5825b6b83d [0,1,0,0,0,1|1,0,0]=3 1041 B12R1.21 CC(C)CNc1ccc(cc1)F f869f8ebca9e23d7a314cca58e04355a [0,1,0,0,0,1|1,0,0]=3 1042 B12R1.21 CC(C)CNc1ccc(cc1)I f5ed240cfb530eb638c88433537d6bc6 [0,1,0,0,0,1|1,0,0]=3 1043 B12R1.21 CC(C)CNc1ccc(cc1)S 5aebae70a565a4395c9f06d404e49e19 [0,1,0,0,0,1|1,0,0]=3 1044 B12R1.21 CC(C)CNc1ccc(cn1)Br bde6ddc1f63f60284fa6607640a728d9 [0,1,0,0,0,1|0,0,0]=2 1045 B12R1.21 CC(C)CNc1ccc(cn1)Cl 0ae5375a5e4c82cbd22b2ab085684d82 [0,1,0,0,0,1|0,0,0]=2 1046 B12R1.21 CC(C)CNc1ccc(cn1)F 8b43a1cc0e501ca0d0605ad14f0df209 [0,1,0,0,0,1|0,0,0]=2 1047 B12R1.21 CC(C)CNc1ccc(cn1)I 23fefd3376fbc7b4befdabe310bb0dda [0,1,0,0,0,1|0,0,0]=2 1048 B12R1.21 CC(C)CNc1ccc(nc1)Br f97d236c26c6d2f7293dba68c7c4b075 [0,1,0,0,0,1|2,0,0]=4 1049 B12R1.21 CC(C)CNc1ccc(nc1)Cl 35dd1dae0c5db16264d559782cfce889 [0,1,0,0,0,1|2,0,0]=4 1050 B12R1.21 CC(C)CNc1ccc(nc1)F 47051ae2555eee9d12ed92095481c029 [0,1,0,0,0,1|2,0,0]=4 1051 B12R1.21 CC(C)CNc1ccc(nc1)I 7597ad1c53bebc44f0a198afe4e3c158 [0,1,0,0,0,1|2,0,0]=4 1052 B12R1.21 CC(C)CNc1ccc(nn1)Br 71d4b9d60307ddee8d072332bb2aa953 [0,1,0,0,0,1|1,0,0]=3 1053 B12R1.21 CC(C)CNc1ccc(nn1)Cl 759852d1e6ccb4e13f8bc7c4ce058a3d [0,1,0,0,0,1|1,0,0]=3 1054 B12R1.21 CC(C)CNc1ccc(nn1)F 903d6c8bbcad05a64ea9083188cfbde6 [0,1,0,0,0,1|1,0,0]=3 1055 B12R1.21 CC(C)CNc1ccc(nn1)I 9f20ca964503267e732a79392bb16af5 [0,1,0,0,0,1|1,0,0]=3 1056 B12R1.21 CC(C)CNc1cnc(cn1)Br 786fa56ac56c18c17ef7ff60ce5620dd [0,1,0,0,0,1|1,0,0]=3 1057 B12R1.21 CC(C)CNc1cnc(cn1)Cl 8f8b918edbaca811d4c134389bca115b [0,1,0,0,0,1|1,0,0]=3 1058 B12R1.21 CC(C)CNc1cnc(cn1)I 5dfb3a45e9a521d1c7e6b60d37ac18a6 [0,1,0,0,0,1|1,0,0]=3 1059 B12R1.21 CC(C)CNc1ncc(cn1)Br 311559457afe73973a82db1f8bb241f9 [0,1,0,0,0,1|1,0,0]=3 1060 B12R1.21 CC(C)CNc1ncc(cn1)Cl 8b7347a02d1108b2edca382bc0f82d23 [0,1,0,0,0,1|1,0,0]=3 1061 B12R1.21 CC(C)CNc1ncc(cn1)F ffba20b417fb193f0d5286ccfa9cec03 [0,1,0,0,0,1|1,0,0]=3 1062 B12R1.21 CC(C)CNc1ncc(cn1)I f733221eaeea7c45f841ce839ea4557c [0,1,0,0,0,1|1,0,0]=3 1063 B12R1.21 CC(C)CNc1ncc(nn1)Br c0fde167026aaea3dd2200e141453c41 [0,1,0,0,0,1|2,0,0]=4 1064 B12R1.21 CC(C)COc1ccc(cc1)Br 688e322571e772c33ef9f7f1b70011c4 [0,1,0,0,0,1|1,0,0]=3 1065 B12R1.21 CC(C)COc1ccc(cc1)Cl f021a9169c3057630072da40a25929d0 [0,1,0,0,0,1|1,0,0]=3 1066 B12R1.21 CC(C)COc1ccc(cc1)F 041d5d9f7bc26d03338ae74cc974acbe [0,1,0,0,0,1|1,0,0]=3 1067 B12R1.21 CC(C)COc1ccc(cc1)I c8700cb8e6ceb84be023f81a6b63abe0 [0,1,0,0,0,1|1,0,0]=3 1068 B12R1.21 CC(C)COc1ccc(cc1)S 93dc663c86ffdc9dd467a4fa1c50d8c7 [0,1,0,0,0,1|1,0,0]=3 1069 B12R1.21 CC(C)COc1ccc(cn1)Cl 7644f0b62ceae011d9bc3001c519b209 [0,1,0,0,0,1|0,0,0]=2 1070 B12R1.21 CC(C)COc1ccc(cn1)F d8047addd92359ec92c2a0f4a9db82e5 [0,1,0,0,0,1|0,0,0]=2 1071 B12R1.21 CC(C)COc1ccc(cn1)I 13cb687e6b43dbc8c66a5b339f34fae3 [0,1,0,0,0,1|0,0,0]=2 1072 B12R1.21 CC(C)COc1ccc(nc1)Br 6cab0d3607c8822f4e69470f0506e296 [0,1,0,0,0,1|2,0,0]=4 1073 B12R1.21 CC(C)COc1ccc(nc1)Cl 10704f4ae7612096859276a99ef4643b [0,1,0,0,0,1|2,0,0]=4 1074 B12R1.21 CC(C)COc1ccc(nc1)F fe25916c3c5d8a0c73f1742e4890c4b4 [0,1,0,0,0,1|2,0,0]=4 1075 B12R1.21 CC(C)COc1ccc(nc1)I f8c7ca358dc5afbf7199c955088be042 [0,1,0,0,0,1|2,0,0]=4 1076 B12R1.21 CC(C)COc1ccc(nn1)Br 799c729e80d47f7d3d32d1afe87f05c0 [0,1,0,0,0,1|1,0,0]=3 1077 B12R1.21 CC(C)COc1ccc(nn1)Cl 3e4728701f30e1aa83e4a90da81c6b1c [0,1,0,0,0,1|1,0,0]=3 1078 B12R1.21 CC(C)COc1cnc(cn1)Br e92ebf9486df5d151f1c7be494efd94e [0,1,0,0,0,1|1,0,0]=3 1079 B12R1.21 CC(C)COc1cnc(cn1)Cl a85fadd95373c67946c552f45276c3e7 [0,1,0,0,0,1|1,0,0]=3 1080 B12R1.21 CC(C)COc1cnc(cn1)I 4afc5550dc517fb69cb3d37c65622e1d [0,1,0,0,0,1|1,0,0]=3 1081 B12R1.21 CC(C)COc1ncc(cn1)Br e032bce34cd4b093ecd7e076271123f8 [0,1,0,0,0,1|1,0,0]=3 1082 B12R1.21 CC(C)COc1ncc(cn1)F fbfab44b5939c52fe35ac5e050d1b8ed [0,1,0,0,0,1|1,0,0]=3 1083 B12R1.21 CC(C)COc1ncc(cn1)I 25f8543921a08cf9cb857eb78351900c [0,1,0,0,0,1|1,0,0]=3 1084 B12R1.21 CC(C)NCc1ccc(=O)[nH]c1 f5fff734176dc5499671c9909abad5b3 [0,1,0,0,0,1|2,0,0]=4 1085 B12R1.21 CC(C)NCc1ccc(cc1)Br 37c09d76c90c7ae49ec6a65ce3a6a041 [0,1,0,0,0,1|1,0,0]=3 1086 B12R1.21 CC(C)NCc1ccc(cc1)Cl 19728114897127fa755988490a2025d5 [0,1,0,0,0,1|1,0,0]=3 1087 B12R1.21 CC(C)NCc1ccc(cc1)F 76a0754a7751d3d66ff80ab158c9f2b0 [0,1,0,0,0,1|1,0,0]=3 1088 B12R1.21 CC(C)NCc1ccc(cc1)I 49ceb1852914812d45311ac4b38b1f31 [0,1,0,0,0,1|1,0,0]=3 1089 B12R1.21 CC(C)NCc1ccc(cn1)Cl c4f69fa6d84754b6825b9b1c6de7fed8 [0,1,0,0,0,1|0,0,0]=2 1090 B12R1.21 CC(C)NCc1ccc(cn1)F c4865c3c8142a2d416d4be6ac231c6e4 [0,1,0,0,0,1|0,0,0]=2 1091 B12R1.21 CC(C)NCc1ccc(nc1)Br 66c358003a2aeaecd114c0fca0aabd06 [0,1,0,0,0,1|2,0,0]=4 1092 B12R1.21 CC(C)NCc1ccc(nc1)Cl b141e36d256d8ba46ce47c529972ed91 [0,1,0,0,0,1|2,0,0]=4 1093 B12R1.21 CC(C)NCc1ccc(nc1)F c68d5f2c5bc0cadc3f885e96b8ce170e [0,1,0,0,0,1|2,0,0]=4 1094 B12R1.21 CC(C)NCc1ccc(nn1)Cl 61cebff1ea99f09b41702993f7dabfd6 [0,1,0,0,0,1|1,0,0]=3 1095 B12R1.21 CC(C)NCc1cnc(cn1)Cl 50d27bdd6b7849aceb40b85497d36e1e [0,1,0,0,0,1|1,0,0]=3 1096 B12R1.21 CC(C)NCc1ncc(cn1)Br 6543968e4b9079ddff46cd3aa4374fd3 [0,1,0,0,0,1|1,0,0]=3 1097 B12R1.21 CC(C)NCc1ncc(cn1)Cl 051fcb678545424d5afdd0ad2b149539 [0,1,0,0,0,1|1,0,0]=3 1098 B12R1.21 CC(C)NCc1ncc(cn1)F 4244dcb2b446981f6525a5933fc2fc2d [0,1,0,0,0,1|1,0,0]=3 1099 B12R1.21 CC(C)OCc1cc[n+](cc1)[O-] ad48718861e57a0359d9b9f53b66d92f [0,1,0,0,0,1|2,0,0]=4 1100 B12R1.21 CC(C)OCc1ccc(cc1)Br bb4176ce0b9ad4d7fb8568832a43e29a [0,1,0,0,0,1|1,0,0]=3 1101 B12R1.21 CC(C)OCc1ccc(cc1)Cl abfc8ca1cd1171daf8ae63ae6bec02b0 [0,1,0,0,0,1|1,0,0]=3 1102 B12R1.21 CC(C)OCc1ccc(cc1)F ac9a18f3d487a18e76f77222965a393f [0,1,0,0,0,1|1,0,0]=3 1103 B12R1.21 CC(C)OCc1ccc(cc1)I a45cec946311a49c5890d06f9a04aef0 [0,1,0,0,0,1|1,0,0]=3 1104 B12R1.21 CC(C)OCc1ccc(cc1)S 8bebaeb2cc5402024d06e9416cbf6988 [0,1,0,0,0,1|1,0,0]=3 1105 B12R1.21 CC(C)OCc1ccc(cn1)Cl e6b6d6a6b704e48f9bad6d91e44552d4 [0,1,0,0,0,1|0,0,0]=2 1106 B12R1.21 CC(C)OCc1ccc(cn1)F cb42a6ce37282edad9aea9a5be279e31 [0,1,0,0,0,1|0,0,0]=2 1107 B12R1.21 CC(C)OCc1ccc(cn1)I d91e2bc09c51ae21ccaab7c4ab76b331 [0,1,0,0,0,1|0,0,0]=2 1108 B12R1.21 CC(C)OCc1ccc(nc1)Br af871ec452ce610ac0391d6007c2df16 [0,1,0,0,0,1|2,0,0]=4 1109 B12R1.21 CC(C)OCc1ccc(nc1)Cl 410f08f8c81d19a105b5a2a9721c4558 [0,1,0,0,0,1|2,0,0]=4 1110 B12R1.21 CC(C)OCc1ccc(nc1)F ba373ea2643bfa56519dd6f4851e18e6 [0,1,0,0,0,1|2,0,0]=4 1111 B12R1.21 CC(C)OCc1ccc(nn1)Cl 1325213318013ac65d7a1be01e77aa3e [0,1,0,0,0,1|1,0,0]=3 1112 B12R1.21 CC(C)OCc1cnc(cn1)Cl 9ac6314172687d4058364b44cd8d251a [0,1,0,0,0,1|1,0,0]=3 1113 B12R1.21 CC(C)OCc1ncc(cn1)Br 7b56cb7e14f5328e2ba153dcc6cef46b [0,1,0,0,0,1|1,0,0]=3 1114 B12R1.21 CC(C)OCc1ncc(cn1)Cl e6976f230a6990d0c977eeb2b0b4e893 [0,1,0,0,0,1|1,0,0]=3 1115 B12R1.21 CC(C)OCc1ncc(cn1)F 31c1d9f6a980edb99bd82ed550ee57c3 [0,1,0,0,0,1|1,0,0]=3 1116 B12R1.21 CC(O)CNc1ccc(cc1)Br 6cc2dd3906a998fe7a5d4e2a8d208d21 [0,1,0,0,0,1|2,0,0]=4 1117 B12R1.21 CC(O)CNc1ccc(cc1)Cl 30612ac8d45eff6171f59f16b2492f67 [0,1,0,0,0,1|2,0,0]=4 1118 B12R1.21 CC(O)CNc1ccc(cc1)F 44764ce23148993885c02e8cea63902c [0,1,0,0,0,1|2,0,0]=4 1119 B12R1.21 CC(O)CNc1ccc(cc1)I 8fb5974b6715edad9e8863320d6bae04 [0,1,0,0,0,1|2,0,0]=4 1120 B12R1.21 CC(O)CNc1ccc(cc1)S 6ef936aebb7976c5c92d176540ed67f0 [0,1,0,0,0,1|2,0,0]=4 1121 B12R1.21 CC(O)CNc1ccc(cn1)Br 3bb705e8b8882ecbcb75e3aafb5cb397 [0,1,0,0,0,1|1,0,0]=3 1122 B12R1.21 CC(O)CNc1ccc(cn1)Cl a0461b6c7f6ad9724e717a03872b2b92 [0,1,0,0,0,1|1,0,0]=3 1123 B12R1.21 CC(O)CNc1ccc(cn1)F 709e9c446a73da6a4e03b61a673f02f3 [0,1,0,0,0,1|1,0,0]=3 1124 B12R1.21 CC(O)CNc1ccc(cn1)I f0d6e74c59cf163dd0d30a8e9491e2e6 [0,1,0,0,0,1|1,0,0]=3 1125 B12R1.21 CC(O)CNc1ccc(nn1)Br 586f2fe0961d8185422997160e94b9f6 [0,1,0,0,0,1|2,0,0]=4 1126 B12R1.21 CC(O)CNc1ccc(nn1)Cl edabaeddbd0fb712f6c063614ab5b671 [0,1,0,0,0,1|2,0,0]=4 1127 B12R1.21 CC(O)CNc1ccc(nn1)F 88dab1a5ad7268069190af9fd1a1ca1a [0,1,0,0,0,1|2,0,0]=4 1128 B12R1.21 CC(O)CNc1ccc(nn1)I f77600c9a3df2886c46799568bcaeb2a [0,1,0,0,0,1|2,0,0]=4 1129 B12R1.21 CC(O)CNc1cnc(cn1)Br 51025a49aafe58a598530ae7d929f721 [0,1,0,0,0,1|2,0,0]=4 1130 B12R1.21 CC(O)CNc1cnc(cn1)Cl 2abdfa449c14107463c52a053b1f5793 [0,1,0,0,0,1|2,0,0]=4 1131 B12R1.21 CC(O)CNc1cnc(cn1)I cfa39ae31309ddd5fab610ca39761e5b [0,1,0,0,0,1|2,0,0]=4 1132 B12R1.21 CC(O)CNc1ncc(cn1)Br 45381c68b3b9dcfaa637d02141c5483c [0,1,0,0,0,1|2,0,0]=4 1133 B12R1.21 CC(O)CNc1ncc(cn1)Cl 0574726ad4b8ecfe8b9304b8c76c11ba [0,1,0,0,0,1|2,0,0]=4 1134 B12R1.21 CC(O)CNc1ncc(cn1)F afff94111ea2397293333db015a1af80 [0,1,0,0,0,1|2,0,0]=4 1135 B12R1.21 CC(O)CNc1ncc(cn1)I e77f8e326f7a33cd6904df7c65f6b9b2 [0,1,0,0,0,1|2,0,0]=4 1136 B12R1.21 CN(C)CNc1ccc(cc1)Br d70bd3e201d4e3984a2cbe371116b356 [0,1,0,0,0,1|2,0,0]=4 1137 B12R1.21 CN(C)CNc1ccc(cc1)Cl 84d82794d22fd2615e84d614fa4d76e4 [0,1,0,0,0,1|2,0,0]=4 1138 B12R1.21 CN(C)CNc1ccc(cc1)F c53489144a229a82a42fe108426a5611 [0,1,0,0,0,1|2,0,0]=4 1139 B12R1.21 CN(C)CNc1ccc(cc1)I 9ce69571ab45326b30512a54a577d9b1 [0,1,0,0,0,1|2,0,0]=4 1140 B12R1.21 CN(C)CNc1ccc(cc1)S 5aa5c6e46c584a58cd79277c7decaaf0 [0,1,0,0,0,1|2,0,0]=4 1141 B12R1.21 CN(C)CNc1ccc(cn1)Br dac506bb2022419025c434627af0aaa5 [0,1,0,0,0,1|1,0,0]=3 1142 B12R1.21 CN(C)CNc1ccc(cn1)Cl ae70f0340b7e7f2ad81212b7849cd568 [0,1,0,0,0,1|1,0,0]=3 1143 B12R1.21 CN(C)CNc1ccc(cn1)F 89ba845ef5d10da1d0dee820f2972093 [0,1,0,0,0,1|1,0,0]=3 1144 B12R1.21 CN(C)CNc1ccc(cn1)I 417716aa1e7caeed5ed6cb96b3f82db5 [0,1,0,0,0,1|1,0,0]=3 1145 B12R1.21 CN(C)CNc1ccc(nn1)Br a8e548dc650717cbf8ef3fdb7e815316 [0,1,0,0,0,1|2,0,0]=4 1146 B12R1.21 CN(C)CNc1ccc(nn1)Cl cb76bfd00e2d406e0f904c9f78a7b1fe [0,1,0,0,0,1|2,0,0]=4 1147 B12R1.21 CN(C)CNc1ccc(nn1)F d98ff55ea363d0981bc007bf7819da4d [0,1,0,0,0,1|2,0,0]=4 1148 B12R1.21 CN(C)CNc1ccc(nn1)I 559a892589b7f317e2fd983ee7829144 [0,1,0,0,0,1|2,0,0]=4 1149 B12R1.21 CN(C)CNc1cnc(cn1)Br e72066dedccfb140afc7fa7f50a83f60 [0,1,0,0,0,1|2,0,0]=4 1150 B12R1.21 CN(C)CNc1cnc(cn1)Cl 05ec1f351f91e01206e2d9de9e55a300 [0,1,0,0,0,1|2,0,0]=4 1151 B12R1.21 CN(C)CNc1cnc(cn1)I 89aeb5845a96fc2da089bd90782fcd95 [0,1,0,0,0,1|2,0,0]=4 1152 B12R1.21 CN(C)CNc1ncc(cn1)Br f47fffa841322515d6a851742a66891d [0,1,0,0,0,1|2,0,0]=4 1153 B12R1.21 CN(C)CNc1ncc(cn1)Cl 0c39c491ec3f4eb87f7e7ef06892615c [0,1,0,0,0,1|2,0,0]=4 1154 B12R1.21 CN(C)CNc1ncc(cn1)F 0d586b43d2a365c24276f5cc4f8239e0 [0,1,0,0,0,1|2,0,0]=4 1155 B12R1.21 CN(C)CNc1ncc(cn1)I 787aa8acfd41993aec46bcfb0c11c2f6 [0,1,0,0,0,1|2,0,0]=4 1156 B12R1.21 CN(C)COc1ccc(cc1)Br 1ae60d05f401b4677bf02579aec9f4e3 [0,1,0,0,0,1|2,0,0]=4 1157 B12R1.21 CN(C)COc1ccc(cc1)Cl 31a0679c78f3b12cc66bbe20f49b9a4e [0,1,0,0,0,1|2,0,0]=4 1158 B12R1.21 CN(C)COc1ccc(cc1)F 47f9c488aaff7ce417b7673dfdc64bd4 [0,1,0,0,0,1|2,0,0]=4 1159 B12R1.21 CN(C)COc1ccc(cc1)I 2c421eec61bc06e369712388216897f9 [0,1,0,0,0,1|2,0,0]=4 1160 B12R1.21 CN(C)COc1ccc(cc1)S 90858c38fd8e55792e84d69d8884b1c6 [0,1,0,0,0,1|2,0,0]=4 1161 B12R1.21 CN(C)COc1ccc(cn1)Cl 88d8c139c3819be888e637f9213dae8b [0,1,0,0,0,1|1,0,0]=3 1162 B12R1.21 CN(C)COc1ccc(cn1)F 140576160640d51c1174020f84a77514 [0,1,0,0,0,1|1,0,0]=3 1163 B12R1.21 CN(C)COc1ccc(cn1)I af5036eaf2b6f08465288c2871088ddd [0,1,0,0,0,1|1,0,0]=3 1164 B12R1.21 CN(C)COc1ccc(nn1)Br 7f6d26a83756ea65979fac1407990cc0 [0,1,0,0,0,1|2,0,0]=4 1165 B12R1.21 CN(C)COc1ccc(nn1)Cl c67c8990d1d4f999742a586d6900db52 [0,1,0,0,0,1|2,0,0]=4 1166 B12R1.21 CN(C)COc1cnc(cn1)Br de00a9b7d18d5143d8371c3dfa63a4a6 [0,1,0,0,0,1|2,0,0]=4 1167 B12R1.21 CN(C)COc1cnc(cn1)Cl f88676f2238d968501475108cd4c43a2 [0,1,0,0,0,1|2,0,0]=4 1168 B12R1.21 CN(C)COc1cnc(cn1)I dcfed3e9582de601e18a9128e7baac19 [0,1,0,0,0,1|2,0,0]=4 1169 B12R1.21 CN(C)COc1ncc(cn1)Br c5ce164f444259a211476a45e1046fee [0,1,0,0,0,1|2,0,0]=4 1170 B12R1.21 CN(C)COc1ncc(cn1)F cb9001670d74ef2851288bdb7d42500a [0,1,0,0,0,1|2,0,0]=4 1171 B12R1.21 CN(C)COc1ncc(cn1)I 6567a16495ed9a15e7633f8dab36e28f [0,1,0,0,0,1|2,0,0]=4 1172 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Br 2ad4df23c69dfa44e26a216951079c17 [0,1,0,0,0,1|2,0,0]=4 1173 B12R1.21 C[C@@H](O)CNc1ccc(cc1)F d13032a00d782f9fd58bde9b7b7e5b40 [0,1,0,0,0,1|2,0,0]=4 1174 B12R1.21 C[C@@H](O)CNc1ccc(cc1)I fcafc0398c9f6631b1e264180519d9a5 [0,1,0,0,0,1|2,0,0]=4 1175 B12R1.21 C[C@@H](O)CNc1ccc(cc1)S c5036038618daf9d110f2837b38cc7f0 [0,1,0,0,0,1|2,0,0]=4 1176 B12R1.21 C[C@@H](O)CNc1ccc(cn1)I 4372f82851e4ac2d780523c3cb2e9aaf [0,1,0,0,0,1|1,0,0]=3 1177 B12R1.21 C[C@@H](O)CNc1ccc(nn1)Br ba31c84ceed4cf6fceeb521bdb3f8e03 [0,1,0,0,0,1|2,0,0]=4 1178 B12R1.21 C[C@@H](O)CNc1ccc(nn1)F 745008f42c8807e75983fedffc366bd7 [0,1,0,0,0,1|2,0,0]=4 1179 B12R1.21 C[C@@H](O)CNc1ccc(nn1)I 525d816b6f5ec382eea5d1032b0bf906 [0,1,0,0,0,1|2,0,0]=4 1180 B12R1.21 C[C@@H](O)CNc1ncc(cn1)F 7db25f7a82abfa82005b79050deff146 [0,1,0,0,0,1|2,0,0]=4 1181 B12R1.21 C[C@@H](O)CNc1ncc(cn1)I 5873000aff9cd25f339fe6f28ccd09c5 [0,1,0,0,0,1|2,0,0]=4 1182 B12R1.21 C[C@H](O)CNc1ccc(cc1)Br dfc814dc76baf36262caaec8d25f4215 [0,1,0,0,0,1|2,0,0]=4 1183 B12R1.21 C[C@H](O)CNc1ccc(cc1)Cl 8fb7f0b55d9fe9f1cdafd45ef42c2de4 [0,1,0,0,0,1|2,0,0]=4 1184 B12R1.21 C[C@H](O)CNc1ccc(cc1)F 4385cb997d0b526c90619c1645b8b1ad [0,1,0,0,0,1|2,0,0]=4 1185 B12R1.21 C[C@H](O)CNc1ccc(cc1)I 7222c72737ac92de3960850b939145d2 [0,1,0,0,0,1|2,0,0]=4 1186 B12R1.21 C[C@H](O)CNc1ccc(cc1)S 638aabe1512824e4dc38e2389b85f596 [0,1,0,0,0,1|2,0,0]=4 1187 B12R1.21 C[C@H](O)CNc1ccc(cn1)Br 1a24c54c176cbcb49489e48c1efa3a9b [0,1,0,0,0,1|1,0,0]=3 1188 B12R1.21 C[C@H](O)CNc1ccc(cn1)Cl d098040213df0bdb930eb14d21e66802 [0,1,0,0,0,1|1,0,0]=3 1189 B12R1.21 C[C@H](O)CNc1ccc(cn1)F e81983c3e4747cd69b645e7ae3c93b33 [0,1,0,0,0,1|1,0,0]=3 1190 B12R1.21 C[C@H](O)CNc1ccc(cn1)I 767c705e53bfc23b58214ff37510f109 [0,1,0,0,0,1|1,0,0]=3 1191 B12R1.21 C[C@H](O)CNc1ccc(nn1)Br b3c8a78413d52d41f729656da28364ca [0,1,0,0,0,1|2,0,0]=4 1192 B12R1.21 C[C@H](O)CNc1ccc(nn1)Cl 91f1a141d7161749c729eb312e06f7c5 [0,1,0,0,0,1|2,0,0]=4 1193 B12R1.21 C[C@H](O)CNc1ccc(nn1)F 0b055e081d93599a27805dd351d4d8cc [0,1,0,0,0,1|2,0,0]=4 1194 B12R1.21 C[C@H](O)CNc1ccc(nn1)I c8d7fb2dd5211b68660e13415dee2ad5 [0,1,0,0,0,1|2,0,0]=4 1195 B12R1.21 C[C@H](O)CNc1cnc(cn1)Br 4662bea4670ab2397559aadc8dddb0ff [0,1,0,0,0,1|2,0,0]=4 1196 B12R1.21 C[C@H](O)CNc1cnc(cn1)Cl 1a915ee9a47c0dcbcfcbc9f6ece66da2 [0,1,0,0,0,1|2,0,0]=4 1197 B12R1.21 C[C@H](O)CNc1cnc(cn1)I c9e4835e94db2f5a60f06cabb8d0f951 [0,1,0,0,0,1|2,0,0]=4 1198 B12R1.21 C[C@H](O)CNc1ncc(cn1)Br 770bbcc89558b243261079f47a4ae065 [0,1,0,0,0,1|2,0,0]=4 1199 B12R1.21 C[C@H](O)CNc1ncc(cn1)Cl 57ef48a03aaa23bece1937adffe5f117 [0,1,0,0,0,1|2,0,0]=4 1200 B12R1.21 C[C@H](O)CNc1ncc(cn1)F 24d4d5789e724c0504f3f9efb058d69c [0,1,0,0,0,1|2,0,0]=4 1201 B12R1.21 C[C@H](O)CNc1ncc(cn1)I e6368770d11ad2028e2a0e76e947dc5e [0,1,0,0,0,1|2,0,0]=4 1202 B12R1.21 Cc1ccc(cc1)CNC(C)C 9f3293af5f5347150ac2434f1c0f5ea3 [0,1,0,0,0,1|1,0,0]=3 1203 B12R1.21 Cc1ccc(cc1)COC(C)C 7eda3a9e7a3c4601d0edf3097f1c1fb1 [0,1,0,0,0,1|1,0,0]=3 1204 B12R1.21 Cc1ccc(cc1)NCC(C)C d33fe3d6c1e672a348e9fedb377a9185 [0,1,0,0,0,1|1,0,0]=3 1205 B12R1.21 Cc1ccc(cc1)NCC(C)O 8379462492ffae9a9aea5a1dcd1f96eb [0,1,0,0,0,1|2,0,0]=4 1206 B12R1.21 Cc1ccc(cc1)NCN(C)C f410d4238a7fc65021317765c852db2f [0,1,0,0,0,1|2,0,0]=4 1207 B12R1.21 Cc1ccc(cc1)NC[C@@H](C)O a5239ddc3731748474623fb5c2811c3d [0,1,0,0,0,1|2,0,0]=4 1208 B12R1.21 Cc1ccc(cc1)NC[C@H](C)O 07456d37e9494f0c908a5c4ac8161df3 [0,1,0,0,0,1|2,0,0]=4 1209 B12R1.21 Cc1ccc(cc1)OCC(C)C c1aa096b3782800b4571efa5c0f498bc [0,1,0,0,0,1|1,0,0]=3 1210 B12R1.21 Cc1ccc(cc1)OCN(C)C 8df4da1e8ff5f1a2a333a699e01425b0 [0,1,0,0,0,1|2,0,0]=4 1211 B12R1.21 Cc1ccc(cn1)CNC(C)C dcca654450af647880d19bcbcad782d0 [0,1,0,0,0,1|2,0,0]=4 1212 B12R1.21 Cc1ccc(cn1)COC(C)C c818a7f0551a9b355b44729de8a8ae60 [0,1,0,0,0,1|2,0,0]=4 1213 B12R1.21 Cc1ccc(cn1)NCC(C)C 4aba7b7e95dd3d9152b31c769536eac4 [0,1,0,0,0,1|2,0,0]=4 1214 B12R1.21 Cc1ccc(cn1)OCC(C)C 69c2bcf05b8548d6cd0c9b6f80a2281a [0,1,0,0,0,1|2,0,0]=4 1215 B12R1.21 Cc1ccc(nc1)CNC(C)C 1873ba9dced7d99c6e146a54f65349ff [0,1,0,0,0,1|0,0,0]=2 1216 B12R1.21 Cc1ccc(nc1)COC(C)C 268c71dd25830b86e2dc9d4896798456 [0,1,0,0,0,1|0,0,0]=2 1217 B12R1.21 Cc1ccc(nc1)NCC(C)C b0a45bd99f228701345f0b0569d4055c [0,1,0,0,0,1|0,0,0]=2 1218 B12R1.21 Cc1ccc(nc1)NCC(C)O 55cf6d0ffbcf3e2dad324ab76d9d53e3 [0,1,0,0,0,1|1,0,0]=3 1219 B12R1.21 Cc1ccc(nc1)NCC(F)F 7a28659951fb66f2ff69885cc773c938 [0,1,0,0,0,1|2,0,0]=4 1220 B12R1.21 Cc1ccc(nc1)NCN(C)C 8faa260ecfe2417a7fec6255cf4a6da4 [0,1,0,0,0,1|1,0,0]=3 1221 B12R1.21 Cc1ccc(nc1)NC[C@@H](C)O 20c469c17324998b728338dc116c2199 [0,1,0,0,0,1|1,0,0]=3 1222 B12R1.21 Cc1ccc(nc1)NC[C@H](C)O 6cacad85bc513bc56640526407b45f29 [0,1,0,0,0,1|1,0,0]=3 1223 B12R1.21 Cc1ccc(nc1)OCC(C)C 3690188a26d66aaddf7d44e6d0ccd16a [0,1,0,0,0,1|0,0,0]=2 1224 B12R1.21 Cc1ccc(nc1)OCC(F)F 683ddbf03cd224c8004f3ed55e0fdc77 [0,1,0,0,0,1|2,0,0]=4 1225 B12R1.21 Cc1ccc(nc1)OCN(C)C fbd366f353fdf12dcea3fc8d890ad7ce [0,1,0,0,0,1|1,0,0]=3 1226 B12R1.21 Cc1ccc(nn1)CNC(C)C 321370b256caf366dadc3d338d91b1c7 [0,1,0,0,0,1|1,0,0]=3 1227 B12R1.21 Cc1ccc(nn1)COC(C)C 8b493afbef8c2102fe84accacf26686a [0,1,0,0,0,1|1,0,0]=3 1228 B12R1.21 Cc1ccc(nn1)NCC(C)C 8dee1a05cbd61fe013e731897888fa3d [0,1,0,0,0,1|1,0,0]=3 1229 B12R1.21 Cc1ccc(nn1)NCC(C)O 8edbf5597162a7b21ef866c17baca375 [0,1,0,0,0,1|2,0,0]=4 1230 B12R1.21 Cc1ccc(nn1)NCN(C)C 4cebfd876150633698ccace49646ea50 [0,1,0,0,0,1|2,0,0]=4 1231 B12R1.21 Cc1ccc(nn1)NC[C@@H](C)O b52a906c547c3d90ae483e437ee26c46 [0,1,0,0,0,1|2,0,0]=4 1232 B12R1.21 Cc1ccc(nn1)NC[C@H](C)O ab1ef6848ae542f9e5fb1d1de8fc1e3c [0,1,0,0,0,1|2,0,0]=4 1233 B12R1.21 Cc1ccc(nn1)OCC(C)C 6da9de78424c17e7a3e462263fa4b283 [0,1,0,0,0,1|1,0,0]=3 1234 B12R1.21 Cc1ccc(nn1)OCN(C)C f664b8fe315d931efdef9e17897b2900 [0,1,0,0,0,1|2,0,0]=4 1235 B12R1.21 Cc1cnc(cn1)CNC(C)C ccca1b65d279b844db896923386ce7b2 [0,1,0,0,0,1|1,0,0]=3 1236 B12R1.21 Cc1cnc(cn1)NCC(C)C 0febfa82e01feed731d1f72b471f6762 [0,1,0,0,0,1|1,0,0]=3 1237 B12R1.21 Cc1cnc(cn1)NCC(C)O 8618f6965d727cdcfe628a18be90efe0 [0,1,0,0,0,1|2,0,0]=4 1238 B12R1.21 Cc1cnc(cn1)NCN(C)C 407728238c32770c25c89fd4c51f1050 [0,1,0,0,0,1|2,0,0]=4 1239 B12R1.21 Cc1cnc(cn1)NC[C@H](C)O dbd6a6042d91e71d77707bdf7b65b5dd [0,1,0,0,0,1|2,0,0]=4 1240 B12R1.21 Cc1cnc(cn1)OCC(C)C 77b6a8c369b2a96f1b584d8f2a0088fd [0,1,0,0,0,1|1,0,0]=3 1241 B12R1.21 Cc1cnc(cn1)OCN(C)C d40d1618bdc917c2e20bcd6039b03a1b [0,1,0,0,0,1|2,0,0]=4 1242 B12R1.21 Cc1cnc(nc1)CNC(C)C 4791cd1f80a42dfbe36297eee311355d [0,1,0,0,0,1|1,0,0]=3 1243 B12R1.21 Cc1cnc(nc1)COC(C)C 51e09f1748f001ce8e6f721be680530b [0,1,0,0,0,1|1,0,0]=3 1244 B12R1.21 Cc1cnc(nc1)NCC(C)C 9a3c40de9eff0fa0b7be9ef135b514f6 [0,1,0,0,0,1|1,0,0]=3 1245 B12R1.21 Cc1cnc(nc1)NCC(C)O ae5027171aae2f9922dab9439e418235 [0,1,0,0,0,1|2,0,0]=4 1246 B12R1.21 Cc1cnc(nc1)NCN(C)C 854cf25f0cc9308610589af564f48b77 [0,1,0,0,0,1|2,0,0]=4 1247 B12R1.21 Cc1cnc(nc1)NC[C@H](C)O 48479903fd092a7c9cf7bf7f03fe2424 [0,1,0,0,0,1|2,0,0]=4 1248 B12R1.21 Cc1cnc(nc1)OCC(C)C 9f44b2e98269e0362d21ab155a696f04 [0,1,0,0,0,1|1,0,0]=3 1249 B12R1.21 Cc1cnc(nc1)OCN(C)C 6d3f1161e6fc268b5b7a14c9eb0ac61a [0,1,0,0,0,1|2,0,0]=4 1250 B12R1.21 FC(F)CNc1ccc(cn1)Br 5cfb86769b432222bc2725b12bf9c58b [0,1,0,0,0,1|2,0,0]=4 1251 B12R1.21 FC(F)CNc1ccc(cn1)Cl 9f9fa360a08f09aea9c50bdadd199b80 [0,1,0,0,0,1|2,0,0]=4 1252 B12R1.21 FC(F)CNc1ccc(cn1)I 117815b1d99c4620f0123987f45e521e [0,1,0,0,0,1|2,0,0]=4 1253 B12R1.21 FC(F)COc1ccc(cn1)Cl 53d8212d6cf3fea6a9e3632f2a53d426 [0,1,0,0,0,1|2,0,0]=4 1254 B12R1.21 FC(F)COc1ccc(cn1)I 423e56076b5154aab1d29b8005c7bbf1 [0,1,0,0,0,1|2,0,0]=4 1255 B12R1.21 Fc1ccc(nc1)NCC(F)F f6281542d58bbde052a85c0bc6aa8696 [0,1,0,0,0,1|2,0,0]=4 1256 B12R1.21 Fc1ccc(nc1)OCC(F)F d76796c2c68c4d8afb2c11c5cf4191a7 [0,1,0,0,0,1|2,0,0]=4 1257 B12R1.27 BrCC(Br)CNc1ccccc1 e7e12b5e4c30a5d2720e1014017ec37c [0,1,0,0,0,1|2,0,0]=4 1258 B12R1.27 BrCC(Br)CNc1ccccn1 f6cf2089bf10aa602d3cdacac7c9d312 [0,1,0,0,0,1|1,0,0]=3 1259 B12R1.27 BrCC(Br)CNc1cccnn1 056ad6b7cf3fc14ad663c6de04924ee3 [0,1,0,0,0,1|2,0,0]=4 1260 B12R1.27 BrCC(Br)CNc1ccncn1 92b2ab76716d23aff403fa3f4fc02055 [0,1,0,0,0,1|2,0,0]=4 1261 B12R1.27 BrCC(Br)CNc1cnccn1 1f184251eec548e9e3933b2f4153f491 [0,1,0,0,0,1|2,0,0]=4 1262 B12R1.27 C#CC(C)NCc1ccccc1 0c823c8410acc72523ada4697880703b [0,1,0,0,0,1|1,0,1]=4 1263 B12R1.27 C#CC(C)NCc1ccccn1 ad6b1fb21ba096ea477c4ba3a68283ca [0,1,0,0,0,1|0,0,1]=3 1264 B12R1.27 C#CC(C)NCc1cccnn1 6e0a8ee4768975e6ae3857823a13fce8 [0,1,0,0,0,1|1,0,1]=4 1265 B12R1.27 C#CC(C)NCc1ccncn1 762aa66d2d77724433212c87141c7023 [0,1,0,0,0,1|1,0,1]=4 1266 B12R1.27 C#CC(C)NCc1cnccn1 c67b65ad9bb4aa4866be84c7c962c9c0 [0,1,0,0,0,1|1,0,1]=4 1267 B12R1.27 C#CC(C)NCc1ncccn1 d909747ecbc6bd5cdf20c3b63150fb03 [0,1,0,0,0,1|1,0,1]=4 1268 B12R1.27 C#CC(C)OCc1ccccc1 f6359202a87cde289007d81369eaa165 [0,1,0,0,0,1|1,0,1]=4 1269 B12R1.27 C#CC(C)OCc1ccccn1 903ee5413328087e012403be2a6f9a74 [0,1,0,0,0,1|0,0,1]=3 1270 B12R1.27 C#CC(C)OCc1cccnn1 9509181281f3fc3f21f042c89f2fbb97 [0,1,0,0,0,1|1,0,1]=4 1271 B12R1.27 C#CC(C)OCc1ccncn1 4ae94074c689d9c3ba7a308fa94ffc28 [0,1,0,0,0,1|1,0,1]=4 1272 B12R1.27 C#CC(C)OCc1cnccn1 ec585cebe3068813ffea29ee9daeca91 [0,1,0,0,0,1|1,0,1]=4 1273 B12R1.27 C#CC(C)OCc1ncccn1 724fdff34e78a87cf48cf06a9d372d11 [0,1,0,0,0,1|1,0,1]=4 1274 B12R1.27 C#C[C@@H](C)NCc1ccccc1 51fd06b5dc99f337c53516eb04becf75 [0,1,0,0,0,1|1,0,1]=4 1275 B12R1.27 C#C[C@@H](C)NCc1ccccn1 4d1c127dd42610df5076aa2ebacb008d [0,1,0,0,0,1|0,0,1]=3 1276 B12R1.27 C#C[C@@H](C)NCc1cccnn1 4adabd3fa0ffce5d3e6289518b19308d [0,1,0,0,0,1|1,0,1]=4 1277 B12R1.27 C#C[C@@H](C)NCc1ccncn1 22474fa7107957601fb4de22749cb467 [0,1,0,0,0,1|1,0,1]=4 1278 B12R1.27 C#C[C@@H](C)NCc1ncccn1 bb7f09ea6d0bd18381538e5692bffd5d [0,1,0,0,0,1|1,0,1]=4 1279 B12R1.27 C#C[C@@H](C)OCc1ccccc1 5a1f683c3ddc74682e7065902596ab4b [0,1,0,0,0,1|1,0,1]=4 1280 B12R1.27 C#C[C@@H](C)OCc1ccccn1 04d0f33658cd73c944a5f8ac187b6720 [0,1,0,0,0,1|0,0,1]=3 1281 B12R1.27 C#C[C@@H](C)OCc1cccnn1 19fb21c02bc6c3870a140f447ccf36bc [0,1,0,0,0,1|1,0,1]=4 1282 B12R1.27 C#C[C@@H](C)OCc1ccncn1 1e0296011cecf0285bb41474dbc547a8 [0,1,0,0,0,1|1,0,1]=4 1283 B12R1.27 C#C[C@@H](C)OCc1ncccn1 33fe10380b93c9e21eab1a5be783f7cd [0,1,0,0,0,1|1,0,1]=4 1284 B12R1.27 C#C[C@H](C)NCc1ccccc1 5c0b47a0f6d5613da204666041aaf216 [0,1,0,0,0,1|1,0,1]=4 1285 B12R1.27 C#C[C@H](C)NCc1ccccn1 decfdb3d020b9f8f1748be500b3d3e94 [0,1,0,0,0,1|0,0,1]=3 1286 B12R1.27 C#C[C@H](C)NCc1cccnn1 2f94b8c279649d446c2cf5169d1ea762 [0,1,0,0,0,1|1,0,1]=4 1287 B12R1.27 C#C[C@H](C)NCc1ccncn1 f05146eb0df15cf1324455470b1c4fc4 [0,1,0,0,0,1|1,0,1]=4 1288 B12R1.27 C#C[C@H](C)NCc1ncccn1 37e0a27da6ba822769369783d25c2db8 [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)OCc1ccccn1 194393544ea69e88ea521cbd4a133ce5 [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)OCc1ccncn1 5d067f5747946ce723e30f118597189f [0,1,0,0,0,1|1,0,1]=4 1293 B12R1.27 C#C[C@H](C)OCc1ncccn1 ee0b48ee9f3df81093821cbbb8b13097 [0,1,0,0,0,1|1,0,1]=4 1294 B12R1.27 C=C(CC)CNc1ccccn1 269fffb91f576e6b2d02d6dbae013f37 [0,1,0,0,0,1|0,0,2]=4 1295 B12R1.27 C=C(CC)COc1ccccn1 fcb5a49cd024de94d9cb7e17b7984e9f [0,1,0,0,0,1|0,0,2]=4 1296 B12R1.27 C=C(CNc1ccccn1)OC 3de7e001df09be3a86b7985205b8d232 [0,1,0,0,0,1|0,0,2]=4 1297 B12R1.27 C=C(CO)CNc1ccccn1 6105decc4fd535ea60914c586543371b [0,1,0,0,0,1|0,0,2]=4 1298 B12R1.27 C=C(COc1ccccn1)OC a43bd483ae573d6cfa4f8d7b75d98ff8 [0,1,0,0,0,1|0,0,2]=4 1299 B12R1.27 C=CC(C)NCc1ccccc1 a2d84df39e96bf4d63bb9a0f31cf21bd [0,1,0,0,0,1|1,0,1]=4 1300 B12R1.27 C=CC(C)NCc1ccccn1 c2585ccce6fd2359aaa73835bf2cf65d [0,1,0,0,0,1|0,0,1]=3 1301 B12R1.27 C=CC(C)NCc1cccnn1 8c7bc6d5b57596359f4dca2ca2aa05b8 [0,1,0,0,0,1|1,0,1]=4 1302 B12R1.27 C=CC(C)NCc1ccncn1 05ef75f82bc2aafe10af7a1a988c64da [0,1,0,0,0,1|1,0,1]=4 1303 B12R1.27 C=CC(C)NCc1cnccn1 8ddabd6bd7f8072902771a596bc64276 [0,1,0,0,0,1|1,0,1]=4 1304 B12R1.27 C=CC(C)NCc1ncccn1 91f8ba3fac56e08c85a05ffa85df715c [0,1,0,0,0,1|1,0,1]=4 1305 B12R1.27 C=CC(C)OCc1ccccc1 5eba3aa739773a1c08ab0c58859512d1 [0,1,0,0,0,1|1,0,1]=4 1306 B12R1.27 C=CC(C)OCc1ccccn1 bbdfd69ebb8ab53913fa15d4b2825809 [0,1,0,0,0,1|0,0,1]=3 1307 B12R1.27 C=CC(C)OCc1cccnn1 ccda418f885f89e6337c4c84edd002bc [0,1,0,0,0,1|1,0,1]=4 1308 B12R1.27 C=CC(C)OCc1ccncn1 ea7a50313afba626ff8b2a121c4337b6 [0,1,0,0,0,1|1,0,1]=4 1309 B12R1.27 C=CC(C)OCc1cnccn1 f7d5645560c34e1d7d3ca1e28096be5c [0,1,0,0,0,1|1,0,1]=4 1310 B12R1.27 C=CC(C)OCc1ncccn1 ea14786051120126e961143419943b7f [0,1,0,0,0,1|1,0,1]=4 1311 B12R1.27 C=CC(O)CNc1ccccn1 38bb823f312b98d5691f547d82dd5a59 [0,1,0,0,0,1|1,0,1]=4 1312 B12R1.27 C=C[C@H](C)OCc1ccccc1 723c5fd60a5c4ba97fa272fb1c420579 [0,1,0,0,0,1|1,0,1]=4 1313 B12R1.27 C=C[C@H](C)OCc1ccccn1 9eb6fc20ae0d5afdfad18379d27f9f8b [0,1,0,0,0,1|0,0,1]=3 1314 B12R1.27 C=C[C@H](C)OCc1cccnn1 22c51ae750b178aa2b87a5c87f810598 [0,1,0,0,0,1|1,0,1]=4 1315 B12R1.27 C=C[C@H](C)OCc1ccncn1 a9595779c9b6a218450df246ab31f064 [0,1,0,0,0,1|1,0,1]=4 1316 B12R1.27 C=C[C@H](C)OCc1ncccn1 cf1510ebcf2b66d294fb75abe4124f11 [0,1,0,0,0,1|1,0,1]=4 1317 B12R1.27 CC(C#N)CNc1ccccc1 bca83eb9ab77da1cbd259e8c3d4283ee [0,1,0,0,0,1|1,0,1]=4 1318 B12R1.27 CC(C#N)CNc1ccccn1 0fc32d740ad406a6dc426ede3076b193 [0,1,0,0,0,1|0,0,1]=3 1319 B12R1.27 CC(C#N)CNc1cccnn1 ffdd819700eed9670d3cb0981045cdae [0,1,0,0,0,1|1,0,1]=4 1320 B12R1.27 CC(C#N)CNc1ccncn1 1af4423311fbf2a07389c7b82aa641dd [0,1,0,0,0,1|1,0,1]=4 1321 B12R1.27 CC(C#N)CNc1cnccn1 5ebd415e7833dce25f3107176809240e [0,1,0,0,0,1|1,0,1]=4 1322 B12R1.27 CC(C#N)CNc1ncccn1 d7ac5aa50b93638a37914f80e998aaa8 [0,1,0,0,0,1|1,0,1]=4 1323 B12R1.27 CC(C#N)COc1ccccn1 ba403bd0c82629b664b7888c6e2df195 [0,1,0,0,0,1|0,0,1]=3 1324 B12R1.27 CC(C#N)COc1cnccn1 1ebbb03f06733134a93f9d5b3752d6ea [0,1,0,0,0,1|1,0,1]=4 1325 B12R1.27 CC(C#N)COc1ncccn1 ea7e4bab2bd9bb63131fc482e4882505 [0,1,0,0,0,1|1,0,1]=4 1326 B12R1.27 CC(C#N)NCc1ccccc1 a297cbe65f4070e0226da02d61e71151 [0,1,0,0,0,1|1,0,1]=4 1327 B12R1.27 CC(C#N)NCc1ccccn1 c49f40e61428cbf5316185f700db1db6 [0,1,0,0,0,1|0,0,1]=3 1328 B12R1.27 CC(C#N)NCc1cccnn1 69c62e6fe1eb9be4d783e2415a386bb5 [0,1,0,0,0,1|1,0,1]=4 1329 B12R1.27 CC(C#N)NCc1ccncn1 d5a796cdedb342b0547206253253a542 [0,1,0,0,0,1|1,0,1]=4 1330 B12R1.27 CC(C#N)NCc1ncccn1 70ed6efca295211f4aa200bf26adce15 [0,1,0,0,0,1|1,0,1]=4 1331 B12R1.27 CC(C#N)OCc1cccnn1 06aebbba38da5b67aaf5c4e2395c7656 [0,1,0,0,0,1|1,0,1]=4 1332 B12R1.27 CC(C=O)NCc1ccccc1 52acbe8f861a146c2fae15c546c154ce [0,1,0,0,0,1|1,0,1]=4 1333 B12R1.27 CC(C=O)NCc1ccccn1 0951a0ee01d1b16bb17c0f8e58213b1e [0,1,0,0,0,1|0,0,1]=3 1334 B12R1.27 CC(C=O)NCc1cccnn1 f7914194e335d384b13fecaa58dee496 [0,1,0,0,0,1|1,0,1]=4 1335 B12R1.27 CC(C=O)NCc1ccncn1 0ffc28381cafa30bf6a686b3f8307a3f [0,1,0,0,0,1|1,0,1]=4 1336 B12R1.27 CC(C=O)NCc1cnccn1 fafdb43f2983d03f73f0520daec21fcc [0,1,0,0,0,1|1,0,1]=4 1337 B12R1.27 CC(C=O)NCc1ncccn1 3f786525937af98c2061621cf76f531c [0,1,0,0,0,1|1,0,1]=4 1338 B12R1.27 CC(C=O)OCc1ccccc1 dab13d83530825bb9c7bbbb7bc6908d9 [0,1,0,0,0,1|1,0,1]=4 1339 B12R1.27 CC(C=O)OCc1ccccn1 1cd8eadb46df6e59cb4a04a39c1e77c7 [0,1,0,0,0,1|0,0,1]=3 1340 B12R1.27 CC(C=O)OCc1cccnn1 21123c033370273565f926229effccf6 [0,1,0,0,0,1|1,0,1]=4 1341 B12R1.27 CC(C=O)OCc1ccncn1 cdca3498916abcc66b90440aaa61702e [0,1,0,0,0,1|1,0,1]=4 1342 B12R1.27 CC(C=O)OCc1cnccn1 a6bf276b7123bc8a9730bc60a4ba9730 [0,1,0,0,0,1|1,0,1]=4 1343 B12R1.27 CC(C=O)OCc1ncccn1 c686780fab0ce6d674d8f8b5fbbc06e9 [0,1,0,0,0,1|1,0,1]=4 1344 B12R1.27 CC(CF)OCc1ccccc1 c18da580e3dabe7992624a35c25d53e8 [0,1,0,0,0,1|1,0,0]=3 1345 B12R1.27 CC(CF)OCc1ccccn1 0d7b7c864206636c9235d181d09d6b15 [0,1,0,0,0,1|0,0,0]=2 1346 B12R1.27 CC(CF)OCc1cccnc1 dcd165da872903498dbd39f6392c4596 [0,1,0,0,0,1|2,0,0]=4 1347 B12R1.27 CC(CF)OCc1cccnn1 2c6b5889e411e9f53b3bd7e4e48410da [0,1,0,0,0,1|1,0,0]=3 1348 B12R1.27 CC(CF)OCc1ccncn1 7eb50aaf117aa7f61d2941f6dd6c4fce [0,1,0,0,0,1|1,0,0]=3 1349 B12R1.27 CC(CF)OCc1ncccn1 efeafcf08dded6fb6ac0d0bf6fb697f6 [0,1,0,0,0,1|1,0,0]=3 1350 B12R1.27 CC(CO)CNc1ccccc1 f07a32871260f72c2fb2363a7f611104 [0,1,0,0,0,1|1,0,0]=3 1351 B12R1.27 CC(CO)CNc1ccccn1 9228158f05cdce3bcf2332746a0d5a23 [0,1,0,0,0,1|0,0,0]=2 1352 B12R1.27 CC(CO)CNc1cccnc1 801122522d7c4cbfe437832579f981bf [0,1,0,0,0,1|2,0,0]=4 1353 B12R1.27 CC(CO)CNc1cccnn1 98d1904fab5d41362a075c11e1efa1aa [0,1,0,0,0,1|1,0,0]=3 1354 B12R1.27 CC(CO)CNc1ccncc1 40e833cdc1404a8681b4db576acfe323 [0,1,0,0,0,1|2,0,0]=4 1355 B12R1.27 CC(CO)CNc1ccncn1 b45c3d5b1659b474c15fccd6fbedf12a [0,1,0,0,0,1|1,0,0]=3 1356 B12R1.27 CC(CO)CNc1cnccn1 4467f0cfd9c9dbc876a653a533aa52f9 [0,1,0,0,0,1|1,0,0]=3 1357 B12R1.27 CC(CO)CNc1cnncn1 1a9eb317c77b1a680f7b166803fdc38b [0,1,0,0,0,1|2,0,0]=4 1358 B12R1.27 CC(CO)CNc1ncccn1 201c3fb44aebb48ac9014ffccfbfbea5 [0,1,0,0,0,1|1,0,0]=3 1359 B12R1.27 CC(CO)CNc1nccnn1 506d874710e2222e9931c0f1b3a94fd9 [0,1,0,0,0,1|2,0,0]=4 1360 B12R1.27 CC(CO)CNc1ncncn1 7506da1823d82ebbacb9d4f982b01627 [0,1,0,0,0,1|2,0,0]=4 1361 B12R1.27 CC(CO)NCc1ccccc1 8f2e7b2c99e7f1ec8ee06bbaf841b37c [0,1,0,0,0,1|1,0,0]=3 1362 B12R1.27 CC(CO)NCc1ccccn1 dc606027ab1cf21842521e3cd6aab041 [0,1,0,0,0,1|0,0,0]=2 1363 B12R1.27 CC(CO)NCc1cccnc1 80adcdefa26a29e6989696dff2f189ce [0,1,0,0,0,1|2,0,0]=4 1364 B12R1.27 CC(CO)NCc1cccnn1 c0ae66a6706b4b09ae7fbfdd61df0b00 [0,1,0,0,0,1|1,0,0]=3 1365 B12R1.27 CC(CO)NCc1ccncc1 9672e7a66b4b38bfe57c10026c0328a2 [0,1,0,0,0,1|2,0,0]=4 1366 B12R1.27 CC(CO)NCc1ccncn1 eeb32be9623ececc3cd1b1108d4a73d9 [0,1,0,0,0,1|1,0,0]=3 1367 B12R1.27 CC(CO)NCc1cnccn1 c4d9086c3d359aa0fead8d59b651d860 [0,1,0,0,0,1|1,0,0]=3 1368 B12R1.27 CC(CO)NCc1ncccn1 837e97a48ad085370e6b0d812fd567c5 [0,1,0,0,0,1|1,0,0]=3 1369 B12R1.27 CC(CS)OCc1ccccc1 bf9173a456888d57225f0e1203a32c5e [0,1,0,0,0,1|1,0,0]=3 1370 B12R1.27 CC(CS)OCc1ccccn1 d5c25dfa8bcef5c73ff7d0ae8229ced9 [0,1,0,0,0,1|0,0,0]=2 1371 B12R1.27 CC(CS)OCc1cccnc1 c6dbc5eba4423fac160580b226332d7c [0,1,0,0,0,1|2,0,0]=4 1372 B12R1.27 CC(CS)OCc1cccnn1 a0872fdb6d741d866e92a6ca3a80681f [0,1,0,0,0,1|1,0,0]=3 1373 B12R1.27 CC(CS)OCc1ccncn1 6bc0b1ad4d781f68d45af34f251458c6 [0,1,0,0,0,1|1,0,0]=3 1374 B12R1.27 CC(CS)OCc1ncccn1 ae0239a16957c280a40779b5f9f2f28f [0,1,0,0,0,1|1,0,0]=3 1375 B12R1.27 CCC(=O)CNc1ccccn1 2d342bf045411702eec8a271afb524c7 [0,1,0,0,0,1|1,0,1]=4 1376 B12R1.27 CCC(=O)COc1ccccn1 3a724b1bda77ee3c2eba66bde7c3ebc1 [0,1,0,0,0,1|1,0,1]=4 1377 B12R1.27 CCC(=O)NCc1ccccn1 8feeaaa17ff0b8e92392e088c3f6feb2 [0,1,0,0,0,1|1,0,1]=4 1378 B12R1.27 CCC(C)CNc1ccccc1 fb8ee4288bf8853fd57c8a217184507f [0,1,0,0,0,1|1,0,0]=3 1379 B12R1.27 CCC(C)CNc1ccccn1 6f2b4521dfa3e14ebf77bc9e288b8c6c [0,1,0,0,0,1|0,0,0]=2 1380 B12R1.27 CCC(C)CNc1cccnc1 799d2535ec95c75adc3efc07c94a55e6 [0,1,0,0,0,1|2,0,0]=4 1381 B12R1.27 CCC(C)CNc1cccnn1 fe60a93e339912dde949c52c81965e44 [0,1,0,0,0,1|1,0,0]=3 1382 B12R1.27 CCC(C)CNc1ccncc1 1d114bdb53eb8bc5873d9cc0853c5acf [0,1,0,0,0,1|2,0,0]=4 1383 B12R1.27 CCC(C)CNc1ccncn1 0030485c0ff4d5483f8ba9ed97ccde88 [0,1,0,0,0,1|1,0,0]=3 1384 B12R1.27 CCC(C)CNc1cnccn1 3cf63567314cf83ced5941a4b5546fbb [0,1,0,0,0,1|1,0,0]=3 1385 B12R1.27 CCC(C)CNc1cnncn1 6d72a6f9e1301c8ce1098ad663d57751 [0,1,0,0,0,1|2,0,0]=4 1386 B12R1.27 CCC(C)CNc1ncccn1 497fd02a45b5f50f2e8db83a730bdce0 [0,1,0,0,0,1|1,0,0]=3 1387 B12R1.27 CCC(C)CNc1nccnn1 57f3d440302fc8184936cfcffe3767dd [0,1,0,0,0,1|2,0,0]=4 1388 B12R1.27 CCC(C)CNc1ncncn1 82a79ccfb4ad166dc812093c7248e456 [0,1,0,0,0,1|2,0,0]=4 1389 B12R1.27 CCC(C)COc1ccccn1 068a7be24dc7922a67d6964a1394c7d6 [0,1,0,0,0,1|0,0,0]=2 1390 B12R1.27 CCC(C)COc1cccnc1 0c32f61d8566e65294b7d65adcb5b70b [0,1,0,0,0,1|2,0,0]=4 1391 B12R1.27 CCC(C)COc1ccncc1 60b90e0040b7a2f08da03a263d76f7dc [0,1,0,0,0,1|2,0,0]=4 1392 B12R1.27 CCC(C)COc1cnccn1 c288149b64550ff633a3f83434c9440a [0,1,0,0,0,1|1,0,0]=3 1393 B12R1.27 CCC(C)COc1cncnn1 c83a8d8b5fd62552650db277a1811352 [0,1,0,0,0,1|2,0,0]=4 1394 B12R1.27 CCC(C)COc1ncccn1 91b15bfc3cf8a97e2d4d562bae36eb9d [0,1,0,0,0,1|1,0,0]=3 1395 B12R1.27 CCC(C)NCc1ccccc1 ab8df84230779f2ea3e6a09700944eac [0,1,0,0,0,1|1,0,0]=3 1396 B12R1.27 CCC(C)NCc1ccccn1 600531c2c0367b3cbfd9810ef9c18666 [0,1,0,0,0,1|0,0,0]=2 1397 B12R1.27 CCC(C)NCc1cccnc1 03aa38772555301826d5e6a7450f6276 [0,1,0,0,0,1|2,0,0]=4 1398 B12R1.27 CCC(C)NCc1cccnn1 e88f67ed586eb144bc95e5bd7bcb62fb [0,1,0,0,0,1|1,0,0]=3 1399 B12R1.27 CCC(C)NCc1ccncc1 8f2ef9d0f5df7ed3c4b3d292b12e10fb [0,1,0,0,0,1|2,0,0]=4 1400 B12R1.27 CCC(C)NCc1ccncn1 01397d606cc3fffc348ba55c505e4e14 [0,1,0,0,0,1|1,0,0]=3 1401 B12R1.27 CCC(C)NCc1cnccn1 a0930806765eb19590abfca69771946b [0,1,0,0,0,1|1,0,0]=3 1402 B12R1.27 CCC(C)NCc1ncccn1 8df2592374dc9d99b6917404fbb9e793 [0,1,0,0,0,1|1,0,0]=3 1403 B12R1.27 CCC(C)OCc1ccccc1 ecd56e0e8d83f20f8ba3d53f4367b277 [0,1,0,0,0,1|1,0,0]=3 1404 B12R1.27 CCC(C)OCc1ccccn1 cdbc114ff1e98274e0c76d4efba7fd19 [0,1,0,0,0,1|0,0,0]=2 1405 B12R1.27 CCC(C)OCc1cccnc1 48e9afbe8701af90763c0a4646314a57 [0,1,0,0,0,1|2,0,0]=4 1406 B12R1.27 CCC(C)OCc1cccnn1 931286049d3813ef6a988d4bb07d95ff [0,1,0,0,0,1|1,0,0]=3 1407 B12R1.27 CCC(C)OCc1ccncc1 a48ab0f470a95fc03f35a49430e127c9 [0,1,0,0,0,1|2,0,0]=4 1408 B12R1.27 CCC(C)OCc1ccncn1 e6dd96fe0be9c443333ddd94f3b52c38 [0,1,0,0,0,1|1,0,0]=3 1409 B12R1.27 CCC(C)OCc1cnccn1 989f83298573eea5a35c1e5bc64dd4aa [0,1,0,0,0,1|1,0,0]=3 1410 B12R1.27 CCC(C)OCc1ncccn1 38a703d49d9020f50edd3359d9d3a942 [0,1,0,0,0,1|1,0,0]=3 1411 B12R1.27 CCC(O)CNc1ccccc1 3a32ac0a6b49d877750df15cf382268b [0,1,0,0,0,1|2,0,0]=4 1412 B12R1.27 CCC(O)CNc1ccccn1 6864d6686de3983b3129898abd14e11f [0,1,0,0,0,1|1,0,0]=3 1413 B12R1.27 CCC(O)CNc1cccnn1 ac8c3cdae8804672bacb52140e53905b [0,1,0,0,0,1|2,0,0]=4 1414 B12R1.27 CCC(O)CNc1ccncn1 ca102469dcbe8fe4e133ae077b53bc80 [0,1,0,0,0,1|2,0,0]=4 1415 B12R1.27 CCC(O)CNc1cnccn1 6334d1439105446d009be2bfcd484584 [0,1,0,0,0,1|2,0,0]=4 1416 B12R1.27 CCC(O)CNc1ncccn1 fcd9c82d249780013a859f025e7e3182 [0,1,0,0,0,1|2,0,0]=4 1417 B12R1.27 CCN(C)CCc1ccccc1 7c4ca4f684c66e96c63c7f2e129ac623 [0,1,0,0,0,1|2,0,0]=4 1418 B12R1.27 CCN(C)CCc1ccccn1 2fc992e6b94f2894c06f88d1be2c6eae [0,1,0,0,0,1|1,0,0]=3 1419 B12R1.27 CC[C@@H](C)CNc1ccccc1 7adb7de69cc286747885efdd5e0d3ab0 [0,1,0,0,0,1|1,0,0]=3 1420 B12R1.27 CC[C@@H](C)CNc1ccccn1 b147644fe4c42e26e6b4ca990988fc8c [0,1,0,0,0,1|0,0,0]=2 1421 B12R1.27 CC[C@@H](C)CNc1cccnc1 1eb105ddecf8c3249110848ecff4eaa7 [0,1,0,0,0,1|2,0,0]=4 1422 B12R1.27 CC[C@@H](C)CNc1cccnn1 f138a0d0c9267c29c52fe7f61c67828a [0,1,0,0,0,1|1,0,0]=3 1423 B12R1.27 CC[C@@H](C)CNc1ccncc1 ea454cc837b589ad6fa29f9da9abac60 [0,1,0,0,0,1|2,0,0]=4 1424 B12R1.27 CC[C@@H](C)CNc1ccncn1 9bdf9c9da31ebd979aecf6842d7ac6dc [0,1,0,0,0,1|1,0,0]=3 1425 B12R1.27 CC[C@@H](C)CNc1cnccn1 03c5733ba7940e2549808a371cd40c8d [0,1,0,0,0,1|1,0,0]=3 1426 B12R1.27 CC[C@@H](C)CNc1cnncn1 cce845849acdf356a4fb8233fd6c64ab [0,1,0,0,0,1|2,0,0]=4 1427 B12R1.27 CC[C@@H](C)CNc1ncccn1 182960260e320668bc478065c63b7965 [0,1,0,0,0,1|1,0,0]=3 1428 B12R1.27 CC[C@@H](C)CNc1nccnn1 94611cb70ff9bf45b3491622bc2df22e [0,1,0,0,0,1|2,0,0]=4 1429 B12R1.27 CC[C@@H](C)CNc1ncncn1 3fe1d195d89ac6910db4cbb2d46441ec [0,1,0,0,0,1|2,0,0]=4 1430 B12R1.27 CC[C@@H](C)COc1ccccn1 874982a66f916edcb8896717a7802590 [0,1,0,0,0,1|0,0,0]=2 1431 B12R1.27 CC[C@@H](C)COc1cccnc1 58227191aae01f35afcd7cf132697857 [0,1,0,0,0,1|2,0,0]=4 1432 B12R1.27 CC[C@@H](C)COc1ccncc1 d0894bc1ae7cda042c896f44faa1550c [0,1,0,0,0,1|2,0,0]=4 1433 B12R1.27 CC[C@@H](C)COc1cnccn1 7b3f825b503a154f58403ce019b27176 [0,1,0,0,0,1|1,0,0]=3 1434 B12R1.27 CC[C@@H](C)COc1cncnn1 68dcc5b8420837a8199c57e6694db34a [0,1,0,0,0,1|2,0,0]=4 1435 B12R1.27 CC[C@@H](C)COc1ncccn1 b6054516e1fc527614d9f5bd8fbbfebc [0,1,0,0,0,1|1,0,0]=3 1436 B12R1.27 CC[C@@H](C)NCc1ccccc1 1448d746eef22413d3964f8047936159 [0,1,0,0,0,1|1,0,0]=3 1437 B12R1.27 CC[C@@H](C)NCc1ccccn1 abcbefa3b0b43406c128be8257adf8b2 [0,1,0,0,0,1|0,0,0]=2 1438 B12R1.27 CC[C@@H](C)NCc1cccnc1 b119e02beb918b7f43cb64ab2c69b801 [0,1,0,0,0,1|2,0,0]=4 1439 B12R1.27 CC[C@@H](C)NCc1cccnn1 67c35e96e8b22c34c0f9f2bf0dbc7c53 [0,1,0,0,0,1|1,0,0]=3 1440 B12R1.27 CC[C@@H](C)NCc1ccncn1 8982898b930cc64d3f97e8f22b517451 [0,1,0,0,0,1|1,0,0]=3 1441 B12R1.27 CC[C@@H](C)NCc1ncccn1 f3d5324285f373a311d24ca5f258e5b2 [0,1,0,0,0,1|1,0,0]=3 1442 B12R1.27 CC[C@@H](C)OCc1ccccc1 0a5e215baf34a258dd8987ff4d2156b3 [0,1,0,0,0,1|1,0,0]=3 1443 B12R1.27 CC[C@@H](C)OCc1ccccn1 01fb0c2d8a73e699c5cca2351e7c51da [0,1,0,0,0,1|0,0,0]=2 1444 B12R1.27 CC[C@@H](C)OCc1cccnc1 2a740981d9be19ca809d229b469f45a2 [0,1,0,0,0,1|2,0,0]=4 1445 B12R1.27 CC[C@@H](C)OCc1cccnn1 2fac72deb935cb1047377c76377e9d51 [0,1,0,0,0,1|1,0,0]=3 1446 B12R1.27 CC[C@@H](C)OCc1ccncn1 6836f2a86da52782b28754e4db4a7845 [0,1,0,0,0,1|1,0,0]=3 1447 B12R1.27 CC[C@@H](C)OCc1ncccn1 0a03468190ed42b08f9cfae2cfb173a4 [0,1,0,0,0,1|1,0,0]=3 1448 B12R1.27 CC[C@@H](O)CNc1ccccc1 765034dc37ea09fed7d7c3321191febe [0,1,0,0,0,1|2,0,0]=4 1449 B12R1.27 CC[C@@H](O)CNc1ccncn1 649018c5a6a5f17284abaad2f68f2eae [0,1,0,0,0,1|2,0,0]=4 1450 B12R1.27 CC[C@H](C)CNc1ccccc1 1ad1285ada078333483cb7913624769f [0,1,0,0,0,1|1,0,0]=3 1451 B12R1.27 CC[C@H](C)CNc1ccccn1 75c9b55178b9e6cbffbfe52153637e1b [0,1,0,0,0,1|0,0,0]=2 1452 B12R1.27 CC[C@H](C)CNc1cccnc1 2e0a2075fe988129d1dcbf5d21b158ec [0,1,0,0,0,1|2,0,0]=4 1453 B12R1.27 CC[C@H](C)CNc1cccnn1 f45f47606b109d68254290173d5081e6 [0,1,0,0,0,1|1,0,0]=3 1454 B12R1.27 CC[C@H](C)CNc1ccncc1 1476b49c3603a7542420a49c2bf3dc59 [0,1,0,0,0,1|2,0,0]=4 1455 B12R1.27 CC[C@H](C)CNc1ccncn1 f07bef34dedeff8e4d46ab831df19257 [0,1,0,0,0,1|1,0,0]=3 1456 B12R1.27 CC[C@H](C)CNc1cnccn1 8ecdfdf7b0f098ad2d5cb8d4d77444ce [0,1,0,0,0,1|1,0,0]=3 1457 B12R1.27 CC[C@H](C)CNc1cnncn1 93e26faa6eea2540f42bb35fe390a07e [0,1,0,0,0,1|2,0,0]=4 1458 B12R1.27 CC[C@H](C)CNc1ncccn1 577523f9b16287c54754a979f87ae1b0 [0,1,0,0,0,1|1,0,0]=3 1459 B12R1.27 CC[C@H](C)CNc1nccnn1 26821168c217d3f15e15d954537c94e7 [0,1,0,0,0,1|2,0,0]=4 1460 B12R1.27 CC[C@H](C)CNc1ncncn1 6defcee22a5572c3c77befec64af8b2c [0,1,0,0,0,1|2,0,0]=4 1461 B12R1.27 CC[C@H](C)COc1ccccn1 f5b749782758cf24dab04e1718b2b720 [0,1,0,0,0,1|0,0,0]=2 1462 B12R1.27 CC[C@H](C)COc1cccnc1 07e42e29a9d594c30776c88035bd838e [0,1,0,0,0,1|2,0,0]=4 1463 B12R1.27 CC[C@H](C)COc1ccncc1 91877b6a13f619eb114c1ca0ccf0b7a7 [0,1,0,0,0,1|2,0,0]=4 1464 B12R1.27 CC[C@H](C)COc1cnccn1 cab76278093fc45be19b2bc8e97ced1c [0,1,0,0,0,1|1,0,0]=3 1465 B12R1.27 CC[C@H](C)COc1cncnn1 97c445a9830c8bf9f171e601386da812 [0,1,0,0,0,1|2,0,0]=4 1466 B12R1.27 CC[C@H](C)COc1ncccn1 7aae48ba7a09d63ea52adb232ad746c4 [0,1,0,0,0,1|1,0,0]=3 1467 B12R1.27 CC[C@H](C)NCc1ccccc1 1d652b15c79b972376b40d93f2c0c28b [0,1,0,0,0,1|1,0,0]=3 1468 B12R1.27 CC[C@H](C)NCc1ccccn1 db87df854d63d8a538c09dd589fcce72 [0,1,0,0,0,1|0,0,0]=2 1469 B12R1.27 CC[C@H](C)NCc1cccnc1 fa7be05a72600688ba61bb2a45c0e2c1 [0,1,0,0,0,1|2,0,0]=4 1470 B12R1.27 CC[C@H](C)NCc1cccnn1 afb2d02055de31c3b13c38e7426238a5 [0,1,0,0,0,1|1,0,0]=3 1471 B12R1.27 CC[C@H](C)NCc1ccncn1 68e404577e6515900cd967404a759d1e [0,1,0,0,0,1|1,0,0]=3 1472 B12R1.27 CC[C@H](C)NCc1ncccn1 4b99ab313f24380219528f42be31f07d [0,1,0,0,0,1|1,0,0]=3 1473 B12R1.27 CC[C@H](C)OCc1ccccc1 b8de8bd5177d460679bde97bee24bb31 [0,1,0,0,0,1|1,0,0]=3 1474 B12R1.27 CC[C@H](C)OCc1ccccn1 095ff59c775b3964aafbd1681dc69b03 [0,1,0,0,0,1|0,0,0]=2 1475 B12R1.27 CC[C@H](C)OCc1cccnc1 dc7942b08bf13064943cbe342b7c887c [0,1,0,0,0,1|2,0,0]=4 1476 B12R1.27 CC[C@H](C)OCc1cccnn1 140744aee80ca8123abb7507b4305d28 [0,1,0,0,0,1|1,0,0]=3 1477 B12R1.27 CC[C@H](C)OCc1ccncn1 35f3c9d29295bb910146093a6786c4b1 [0,1,0,0,0,1|1,0,0]=3 1478 B12R1.27 CC[C@H](C)OCc1ncccn1 181b6f3316ad03af0956648dba459c7a [0,1,0,0,0,1|1,0,0]=3 1479 B12R1.27 CN(C=O)CCc1ccccn1 16a2ece4ff1bacf526fae60eca9f8ffa [0,1,0,0,0,1|1,0,1]=4 1480 B12R1.27 CN(CF)CCc1ccccc1 af958a660e6bf737d02c2dfab1bc467d [0,1,0,0,0,1|2,0,0]=4 1481 B12R1.27 CN(CF)CCc1ccccn1 e47249cec0a9e47647623cac83a45a8e [0,1,0,0,0,1|1,0,0]=3 1482 B12R1.27 CN(CO)CCc1ccccc1 c9a67cdf713e4c874ec2d63ed5e8590a [0,1,0,0,0,1|2,0,0]=4 1483 B12R1.27 CN(CO)CCc1ccccn1 aa0d4ac6d05fc927494412ee9fe9c7cc [0,1,0,0,0,1|1,0,0]=3 1484 B12R1.27 CNC(=O)CNc1ccccn1 fc4762116a27bb8b6ea53a6e66542d19 [0,1,0,0,0,1|1,0,1]=4 1485 B12R1.27 CNC(=O)COc1ccccn1 bd4756c0f0116ab38b1a4beac8202f0e [0,1,0,0,0,1|1,0,1]=4 1486 B12R1.27 COC(=O)CNc1ccccn1 422ec05b49687667e2eb26080da1b005 [0,1,0,0,0,1|1,0,1]=4 1487 B12R1.27 COC(=O)COc1ccccn1 b9320fa8fadd3b157619c972c855ab22 [0,1,0,0,0,1|1,0,1]=4 1488 B12R1.27 COC(C)CNc1ccccc1 8b7aea6540e0014f2969161722152c0a [0,1,0,0,0,1|1,0,0]=3 1489 B12R1.27 COC(C)CNc1ccccn1 aa1fffc4826b028b66ca3b6131bb2129 [0,1,0,0,0,1|0,0,0]=2 1490 B12R1.27 COC(C)CNc1cccnc1 22ea1776f5c64fa404e2b1d10875769b [0,1,0,0,0,1|2,0,0]=4 1491 B12R1.27 COC(C)CNc1cccnn1 57b8f2e31a89437037bb968036b0a7ad [0,1,0,0,0,1|1,0,0]=3 1492 B12R1.27 COC(C)CNc1ccncc1 8583756de850d35d798b9d18e790369d [0,1,0,0,0,1|2,0,0]=4 1493 B12R1.27 COC(C)CNc1ccncn1 9a338fed3fdbe41865e288d21845d7b6 [0,1,0,0,0,1|1,0,0]=3 1494 B12R1.27 COC(C)CNc1cnccn1 4934fe98e881c8caac1de5e17b4dc92d [0,1,0,0,0,1|1,0,0]=3 1495 B12R1.27 COC(C)CNc1cnncn1 5bb2ec6d9dd14914b019e4f393d54c7a [0,1,0,0,0,1|2,0,0]=4 1496 B12R1.27 COC(C)CNc1ncccn1 8570879f1ddd8a7a1e5f6c89edecdeea [0,1,0,0,0,1|1,0,0]=3 1497 B12R1.27 COC(C)CNc1nccnn1 c427842542b2d45807932d688f9e8d20 [0,1,0,0,0,1|2,0,0]=4 1498 B12R1.27 COC(C)CNc1ncncn1 e9215300dc180c53d2288c3d75ea6d68 [0,1,0,0,0,1|2,0,0]=4 1499 B12R1.27 COC(C)COc1ccccn1 f8dc8bfeccf22df73c7ed2e356fc48da [0,1,0,0,0,1|0,0,0]=2 1500 B12R1.27 COC(C)COc1cccnc1 9293f71aa0063e3b71a6c85117d16856 [0,1,0,0,0,1|2,0,0]=4 1501 B12R1.27 COC(C)COc1ccncc1 5fbc7e5892edbad02dcb9a66b68a62df [0,1,0,0,0,1|2,0,0]=4 1502 B12R1.27 COC(C)COc1cnccn1 168521879b84e34b8c393d32fd7d174c [0,1,0,0,0,1|1,0,0]=3 1503 B12R1.27 COC(C)COc1cncnn1 3522cbbde3bc4e35a710657e091b22c0 [0,1,0,0,0,1|2,0,0]=4 1504 B12R1.27 COC(C)COc1ncccn1 0fcc0297343c993aabe4b47abb5acb0d [0,1,0,0,0,1|1,0,0]=3 1505 B12R1.27 CO[C@@H](C)CNc1ccccc1 1db51b6397d595cc5bd1ef07b3dce178 [0,1,0,0,0,1|1,0,0]=3 1506 B12R1.27 CO[C@@H](C)CNc1ccccn1 3f6f24d683b32bf983db741333c2969d [0,1,0,0,0,1|0,0,0]=2 1507 B12R1.27 CO[C@@H](C)CNc1cccnc1 ed45e74a30d0fad7831c896f4455a3e9 [0,1,0,0,0,1|2,0,0]=4 1508 B12R1.27 CO[C@@H](C)CNc1cccnn1 a7aab28edd21d3a5ef3d70cba3e8d7f9 [0,1,0,0,0,1|1,0,0]=3 1509 B12R1.27 CO[C@@H](C)CNc1ccncc1 321a70901c24d6141307a3fd83345c5f [0,1,0,0,0,1|2,0,0]=4 1510 B12R1.27 CO[C@@H](C)CNc1ccncn1 917b47bd5f497576d3e7486855c6ee57 [0,1,0,0,0,1|1,0,0]=3 1511 B12R1.27 CO[C@@H](C)CNc1cnccn1 53ae0935256e105b3eb7c609b854c909 [0,1,0,0,0,1|1,0,0]=3 1512 B12R1.27 CO[C@@H](C)CNc1cnncn1 70675b7b34d8454e55d101f9d036ea3a [0,1,0,0,0,1|2,0,0]=4 1513 B12R1.27 CO[C@@H](C)CNc1ncccn1 0812a69d040d25016f59a08e6acb2161 [0,1,0,0,0,1|1,0,0]=3 1514 B12R1.27 CO[C@@H](C)CNc1nccnn1 3f319315f8461a0301bc59faf9c380e8 [0,1,0,0,0,1|2,0,0]=4 1515 B12R1.27 CO[C@@H](C)CNc1ncncn1 8026d384711a8b257349ed6e169e9e1f [0,1,0,0,0,1|2,0,0]=4 1516 B12R1.27 CO[C@@H](C)COc1ccccn1 74e5eb55678aa99f2f01dd02e58c0f99 [0,1,0,0,0,1|0,0,0]=2 1517 B12R1.27 CO[C@@H](C)COc1cccnc1 4625df0874e428ea62a16a84848b31c3 [0,1,0,0,0,1|2,0,0]=4 1518 B12R1.27 CO[C@@H](C)COc1ccncc1 a06e60f07f6a57574e8cbc8ff90265e7 [0,1,0,0,0,1|2,0,0]=4 1519 B12R1.27 CO[C@@H](C)COc1cnccn1 b74633bf8dc1ffc4614cbf0963cc0979 [0,1,0,0,0,1|1,0,0]=3 1520 B12R1.27 CO[C@@H](C)COc1cncnn1 f098bf292fb80f3c4cf2844255e2e8d8 [0,1,0,0,0,1|2,0,0]=4 1521 B12R1.27 CO[C@@H](C)COc1ncccn1 d43b5c2f21fcbe512af85251c28b8a25 [0,1,0,0,0,1|1,0,0]=3 1522 B12R1.27 CO[C@H](C)CNc1ccccc1 b7b86a2dea3233b080c54d71a8f46990 [0,1,0,0,0,1|1,0,0]=3 1523 B12R1.27 CO[C@H](C)CNc1ccccn1 04ec0231ca9bc4cf1eff96f841c37724 [0,1,0,0,0,1|0,0,0]=2 1524 B12R1.27 CO[C@H](C)CNc1cccnc1 3d28dbb191d334198e2e90ddce2fa1a4 [0,1,0,0,0,1|2,0,0]=4 1525 B12R1.27 CO[C@H](C)CNc1cccnn1 308d9b61ca0613da225819a6631aa0ff [0,1,0,0,0,1|1,0,0]=3 1526 B12R1.27 CO[C@H](C)CNc1ccncc1 bd2ba612a637b68c883a6591cf32e881 [0,1,0,0,0,1|2,0,0]=4 1527 B12R1.27 CO[C@H](C)CNc1ccncn1 7bf1aa7877bed7ec80381d13b25beaa6 [0,1,0,0,0,1|1,0,0]=3 1528 B12R1.27 CO[C@H](C)CNc1cnccn1 b719a317b586b472c3ca3ba92317ee19 [0,1,0,0,0,1|1,0,0]=3 1529 B12R1.27 CO[C@H](C)CNc1cnncn1 c507692e57cc61356ccbdb5636c25478 [0,1,0,0,0,1|2,0,0]=4 1530 B12R1.27 CO[C@H](C)CNc1ncccn1 b988e20ae9c69cfad8a575078571ad98 [0,1,0,0,0,1|1,0,0]=3 1531 B12R1.27 CO[C@H](C)CNc1nccnn1 9d6ce3a63018ecb573892488d0574039 [0,1,0,0,0,1|2,0,0]=4 1532 B12R1.27 CO[C@H](C)CNc1ncncn1 45ced3328afc7a8a76eb0892471edcbc [0,1,0,0,0,1|2,0,0]=4 1533 B12R1.27 CO[C@H](C)COc1ccccn1 48788836bfd03aade6f0bd2c51b60c5c [0,1,0,0,0,1|0,0,0]=2 1534 B12R1.27 CO[C@H](C)COc1cccnc1 a0e969ee0f3c10fe22a63e3d03e64109 [0,1,0,0,0,1|2,0,0]=4 1535 B12R1.27 CO[C@H](C)COc1ccncc1 8e99d9b0419ebb5515c91639e755a31d [0,1,0,0,0,1|2,0,0]=4 1536 B12R1.27 CO[C@H](C)COc1cnccn1 f10e17992a6825010ede7d0e515d88a7 [0,1,0,0,0,1|1,0,0]=3 1537 B12R1.27 CO[C@H](C)COc1cncnn1 e7b4c7d00c64a96fbc6c915b59481402 [0,1,0,0,0,1|2,0,0]=4 1538 B12R1.27 CO[C@H](C)COc1ncccn1 f5255e9db0e1162de21d873188fcd514 [0,1,0,0,0,1|1,0,0]=3 1539 B12R1.27 C[C@@H](CO)CNc1ccccc1 8acaf8396f10bf3948fe3b52f4656e75 [0,1,0,0,0,1|1,0,0]=3 1540 B12R1.27 C[C@@H](CO)CNc1ccccn1 af016b84d95f1080f07ef6f02d15824a [0,1,0,0,0,1|0,0,0]=2 1541 B12R1.27 C[C@@H](CO)CNc1cccnc1 6052f0c67d4cdd3f80ceffbd11480331 [0,1,0,0,0,1|2,0,0]=4 1542 B12R1.27 C[C@@H](CO)CNc1cccnn1 0b6a2fb6d9427f1ca932a4a2c6e94db3 [0,1,0,0,0,1|1,0,0]=3 1543 B12R1.27 C[C@@H](CO)CNc1ccncc1 f14674535a69f3232455d568e370ba78 [0,1,0,0,0,1|2,0,0]=4 1544 B12R1.27 C[C@@H](CO)CNc1ccncn1 d45f622473b51bdfa511c740fe038021 [0,1,0,0,0,1|1,0,0]=3 1545 B12R1.27 C[C@@H](CO)CNc1cnccn1 b34ebd6399cbc236ef2ab5ac79900198 [0,1,0,0,0,1|1,0,0]=3 1546 B12R1.27 C[C@@H](CO)CNc1cnncn1 ce5b9079878930fa9d0bd1703e79eed4 [0,1,0,0,0,1|2,0,0]=4 1547 B12R1.27 C[C@@H](CO)CNc1ncccn1 af018eff6911c0d83a5da864e125d204 [0,1,0,0,0,1|1,0,0]=3 1548 B12R1.27 C[C@@H](CO)CNc1nccnn1 44679a6048e67aae5032c61f6eb201d5 [0,1,0,0,0,1|2,0,0]=4 1549 B12R1.27 C[C@@H](CO)CNc1ncncn1 5d7e7491ad32418a884e23a3895b11e4 [0,1,0,0,0,1|2,0,0]=4 1550 B12R1.27 C[C@@H](CO)NCc1ccccc1 a52866c987a35d6e1a5b62fda8afddea [0,1,0,0,0,1|1,0,0]=3 1551 B12R1.27 C[C@@H](CO)NCc1ccccn1 24b346e5ac8cec24f6566fe18f21e557 [0,1,0,0,0,1|0,0,0]=2 1552 B12R1.27 C[C@@H](CO)NCc1cccnc1 c05978b6b00adbcee4f88cca44b079ed [0,1,0,0,0,1|2,0,0]=4 1553 B12R1.27 C[C@@H](CO)NCc1cccnn1 05a1dc5c207ae3eee6144f6e1c657205 [0,1,0,0,0,1|1,0,0]=3 1554 B12R1.27 C[C@@H](CO)NCc1ccncc1 5b07b762d221cbddc1d819cacc34979c [0,1,0,0,0,1|2,0,0]=4 1555 B12R1.27 C[C@@H](CO)NCc1ccncn1 f6ff3ba88bfe69e87216c2a7058d07f8 [0,1,0,0,0,1|1,0,0]=3 1556 B12R1.27 C[C@@H](CO)NCc1cnccn1 848c1433beb181bd59c54d3b96b16fa8 [0,1,0,0,0,1|1,0,0]=3 1557 B12R1.27 C[C@@H](CO)NCc1ncccn1 18b98af25da2c21ca4e52167d59e15d7 [0,1,0,0,0,1|1,0,0]=3 1558 B12R1.27 C[C@H](C=O)NCc1ccccc1 645b627cd889138b5240bcb1ce686b72 [0,1,0,0,0,1|1,0,1]=4 1559 B12R1.27 C[C@H](C=O)NCc1ccccn1 03bdbd8da67049c2d2c33d47db20e2fa [0,1,0,0,0,1|0,0,1]=3 1560 B12R1.27 C[C@H](C=O)NCc1cccnn1 657071ba38b6ea55f45a9b75d84e4c25 [0,1,0,0,0,1|1,0,1]=4 1561 B12R1.27 C[C@H](C=O)NCc1ccncn1 2ff71016de2465e0e088d4646675cf16 [0,1,0,0,0,1|1,0,1]=4 1562 B12R1.27 C[C@H](C=O)NCc1cnccn1 00a48b8902f9721f5a3d11f6dee664fc [0,1,0,0,0,1|1,0,1]=4 1563 B12R1.27 C[C@H](C=O)NCc1ncccn1 e9aeda99371a6cb1c1b0cc534ac8735b [0,1,0,0,0,1|1,0,1]=4 1564 B12R1.27 C[C@H](C=O)OCc1ccccc1 d71860644cbe1541da13b3966902f7f7 [0,1,0,0,0,1|1,0,1]=4 1565 B12R1.27 C[C@H](C=O)OCc1ccccn1 77e036a149c9b895f58a4f79f65d470f [0,1,0,0,0,1|0,0,1]=3 1566 B12R1.27 C[C@H](C=O)OCc1cccnn1 65266623877ef171e93c3c92f1781a12 [0,1,0,0,0,1|1,0,1]=4 1567 B12R1.27 C[C@H](C=O)OCc1ccncn1 9cfb53ab0921ae94da9c12afa06e5666 [0,1,0,0,0,1|1,0,1]=4 1568 B12R1.27 C[C@H](C=O)OCc1cnccn1 a1de2c21d85cbf557f40a4ba5e6a0c0d [0,1,0,0,0,1|1,0,1]=4 1569 B12R1.27 C[C@H](C=O)OCc1ncccn1 4e06b65e0320c112989734747d3db285 [0,1,0,0,0,1|1,0,1]=4 1570 B12R1.27 C[C@H](CO)CNc1ccccc1 de01f7c1f1d3b008ec664fad35110bba [0,1,0,0,0,1|1,0,0]=3 1571 B12R1.27 C[C@H](CO)CNc1ccccn1 e822e956d48a344afeb617359365dcfb [0,1,0,0,0,1|0,0,0]=2 1572 B12R1.27 C[C@H](CO)CNc1cccnc1 27ef93a68bfc032deefa13733949bda2 [0,1,0,0,0,1|2,0,0]=4 1573 B12R1.27 C[C@H](CO)CNc1cccnn1 560938529d62da9a8aac673de498ec01 [0,1,0,0,0,1|1,0,0]=3 1574 B12R1.27 C[C@H](CO)CNc1ccncc1 4fd9d26d176ae9102178ddd2e18bcf70 [0,1,0,0,0,1|2,0,0]=4 1575 B12R1.27 C[C@H](CO)CNc1ccncn1 bda1eef39f4a95e453c3bac3205df33f [0,1,0,0,0,1|1,0,0]=3 1576 B12R1.27 C[C@H](CO)CNc1cnccn1 de693ece84470b212343000297ad249f [0,1,0,0,0,1|1,0,0]=3 1577 B12R1.27 C[C@H](CO)CNc1cnncn1 98b2d21e8bfaa474c3a894782abfb70f [0,1,0,0,0,1|2,0,0]=4 1578 B12R1.27 C[C@H](CO)CNc1ncccn1 916d39941d1066a7157031db8367b91b [0,1,0,0,0,1|1,0,0]=3 1579 B12R1.27 C[C@H](CO)CNc1nccnn1 193d5b8ecca065c23ac52a80442960ab [0,1,0,0,0,1|2,0,0]=4 1580 B12R1.27 C[C@H](CO)CNc1ncncn1 3c31aa7e5460755936c5403e7b652914 [0,1,0,0,0,1|2,0,0]=4 1581 B12R1.27 C[C@H](CO)NCc1ccccc1 6eed9f4ff81e8b8226b9282b8f3ad13f [0,1,0,0,0,1|1,0,0]=3 1582 B12R1.27 C[C@H](CO)NCc1ccccn1 f876cbcb18ab33a44cd48067a6e0c620 [0,1,0,0,0,1|0,0,0]=2 1583 B12R1.27 C[C@H](CO)NCc1cccnc1 21544267eb570ab70ec823c251a550b0 [0,1,0,0,0,1|2,0,0]=4 1584 B12R1.27 C[C@H](CO)NCc1cccnn1 1a2bd735b97b66ca6ea47e333ae5c2c6 [0,1,0,0,0,1|1,0,0]=3 1585 B12R1.27 C[C@H](CO)NCc1ccncc1 7dbeacc2c2607a95fa1f0ce20b03a078 [0,1,0,0,0,1|2,0,0]=4 1586 B12R1.27 C[C@H](CO)NCc1ccncn1 c32e0f5fede4f5050d0aa02b72ffe485 [0,1,0,0,0,1|1,0,0]=3 1587 B12R1.27 C[C@H](CO)NCc1cnccn1 aa92059eda1f440fdfb5e1dbb18875a2 [0,1,0,0,0,1|1,0,0]=3 1588 B12R1.27 C[C@H](CO)NCc1ncccn1 0f954e7651a99fa27d25d1118270587f [0,1,0,0,0,1|1,0,0]=3 1589 B12R1.27 C[C@H](CS)OCc1ccccc1 76a62ad706fe4942b152f21141bdace8 [0,1,0,0,0,1|1,0,0]=3 1590 B12R1.27 C[C@H](CS)OCc1ccccn1 bfa2f3c46950c58e36e3009f57740457 [0,1,0,0,0,1|0,0,0]=2 1591 B12R1.27 C[C@H](CS)OCc1cccnc1 ac5d95777938b777033779188a5a5b0a [0,1,0,0,0,1|2,0,0]=4 1592 B12R1.27 C[C@H](CS)OCc1cccnn1 ed596dc0487d88f9c4050fab00936dd6 [0,1,0,0,0,1|1,0,0]=3 1593 B12R1.27 C[C@H](CS)OCc1ccncn1 bcfae6bd9da7a561bbca62d1ea19c5d1 [0,1,0,0,0,1|1,0,0]=3 1594 B12R1.27 C[C@H](CS)OCc1ncccn1 58841d38a292b01728562b6a0e3ba5a4 [0,1,0,0,0,1|1,0,0]=3 1595 B12R1.27 O=C(CF)NCc1ccccn1 4c7b5fbb214e22648f8c87757a037fe0 [0,1,0,0,0,1|1,0,1]=4 1596 B12R1.27 O=C(CO)CNc1ccccn1 0c5a750a3ead3f0642560291fe4bd338 [0,1,0,0,0,1|1,0,1]=4 1597 B12R1.27 O=C(CO)NCc1ccccn1 76eb78e75930ec6892869074780cca40 [0,1,0,0,0,1|1,0,1]=4 1598 B12R1.27 O=C(CS)NCc1ccccn1 ae765a2702e1ea1d8d048ef10891fe36 [0,1,0,0,0,1|1,0,1]=4 1599 B12R1.27 OC(CF)CNc1ccccc1 e518893c8dbaaac7e0289d266d42fc20 [0,1,0,0,0,1|2,0,0]=4 1600 B12R1.27 OC(CF)CNc1ccccn1 1b489c84af593acbd12dd849bb8613a4 [0,1,0,0,0,1|1,0,0]=3 1601 B12R1.27 OC(CF)CNc1cccnn1 29f1003d9f08ef42ebf9fbe7bc31121a [0,1,0,0,0,1|2,0,0]=4 1602 B12R1.27 OC(CF)CNc1ccncn1 0bcfbf6e12b3f59f0790d80fc41339c1 [0,1,0,0,0,1|2,0,0]=4 1603 B12R1.27 OC(CF)CNc1cnccn1 ee6cb5aa7b22cf43e37825f709173987 [0,1,0,0,0,1|2,0,0]=4 1604 B12R1.27 OC(CF)CNc1ncccn1 dd089ad3929e2fe47b5067487d7f2a6d [0,1,0,0,0,1|2,0,0]=4 1605 B12R1.27 OCC(F)CNc1ccccc1 12f6637854cd5607d7beeb33d98c9d66 [0,1,0,0,0,1|2,0,0]=4 1606 B12R1.27 OCC(F)CNc1ccccn1 636742c95dad33ab1c71801ff2f3a9f9 [0,1,0,0,0,1|1,0,0]=3 1607 B12R1.27 OCC(F)CNc1cccnn1 3206d2a2e5405671183d9fbae6b6f869 [0,1,0,0,0,1|2,0,0]=4 1608 B12R1.27 OCC(F)CNc1ccncn1 e47a7fece5be9dab87f5065b8d5faad2 [0,1,0,0,0,1|2,0,0]=4 1609 B12R1.27 OCC(F)CNc1cnccn1 afb9dfd6639eb50d2d5ff1a29359175d [0,1,0,0,0,1|2,0,0]=4 1610 B12R1.27 OCC(F)CNc1ncccn1 e95c3ce2f17538746c4f3fd19d2dcf76 [0,1,0,0,0,1|2,0,0]=4 1611 B12R1.27 OCC(O)CNc1ccccc1 2c98ea52c81c0230088b12196d6eb24a [0,1,0,0,0,1|2,0,0]=4 1612 B12R1.27 OCC(O)CNc1ccccn1 01ee7f693227d7b41743528a5289097e [0,1,0,0,0,1|1,0,0]=3 1613 B12R1.27 OCC(O)CNc1cccnn1 c37660606513696fffd56ba0becf4339 [0,1,0,0,0,1|2,0,0]=4 1614 B12R1.27 OCC(O)CNc1ccncn1 6c3d967743ad1842f53cd0a78440874e [0,1,0,0,0,1|2,0,0]=4 1615 B12R1.27 OCC(O)CNc1cnccn1 38f4f717546be1a1edb1cb90ca085d60 [0,1,0,0,0,1|2,0,0]=4 1616 B12R1.27 OCC(O)CNc1ncccn1 c8c3ea7763b8905b18ba231ae62c2d9a [0,1,0,0,0,1|2,0,0]=4 1617 B12R1.27 OCC(O)COc1ccccn1 de982e49db9e5905cbf502b472dbf63c [0,1,0,0,0,1|1,0,0]=3 1618 B12R1.27 OCC(O)COc1cnccn1 11df0c63b0f6b4d8bd464a325e4a7069 [0,1,0,0,0,1|2,0,0]=4 1619 B12R1.27 OCC(O)COc1ncccn1 286403b4fdbdd90521acb85f3a67a40b [0,1,0,0,0,1|2,0,0]=4 1620 B12R1.27 OC[C@@H](F)CNc1ccccc1 df0a72159854bbc7d14ee531e659ec9c [0,1,0,0,0,1|2,0,0]=4 1621 B12R1.27 OC[C@@H](F)CNc1ccccn1 1584848d336c5e6a789273d622755063 [0,1,0,0,0,1|1,0,0]=3 1622 B12R1.27 OC[C@@H](F)CNc1cccnn1 c59c212ecfe4a38d71370a6090a4c76b [0,1,0,0,0,1|2,0,0]=4 1623 B12R1.27 OC[C@@H](F)CNc1ccncn1 f33c3b0dfeabff0c991fb4ca945e03c9 [0,1,0,0,0,1|2,0,0]=4 1624 B12R1.27 OC[C@@H](F)CNc1cnccn1 908a6074f6ae5123691476cafb870574 [0,1,0,0,0,1|2,0,0]=4 1625 B12R1.27 OC[C@@H](F)CNc1ncccn1 abc44e6dacd16d67f5cef855f5167cc3 [0,1,0,0,0,1|2,0,0]=4 1626 B12R1.27 OC[C@@H](O)CNc1ccccc1 d5ed593b781b051c17ac5c0f665c9b28 [0,1,0,0,0,1|2,0,0]=4 1627 B12R1.27 OC[C@@H](O)CNc1ccccn1 2519c7c1d8c00423d8e7e0d2e871ff57 [0,1,0,0,0,1|1,0,0]=3 1628 B12R1.27 OC[C@@H](O)CNc1cccnn1 58a3e678159e6534b8b3409e8c95293a [0,1,0,0,0,1|2,0,0]=4 1629 B12R1.27 OC[C@@H](O)CNc1ccncn1 10efd3c226492fc8b4b0e6a19a39c9ac [0,1,0,0,0,1|2,0,0]=4 1630 B12R1.27 OC[C@@H](O)CNc1cnccn1 7407429709e17e3ed0b8a23970e73740 [0,1,0,0,0,1|2,0,0]=4 1631 B12R1.27 OC[C@@H](O)CNc1ncccn1 67a9d28146b1982de145b045ea5f4c68 [0,1,0,0,0,1|2,0,0]=4 1632 B12R1.27 OC[C@@H](O)COc1ccccn1 5d7275d622eef8cbe7d078a5f35c4912 [0,1,0,0,0,1|1,0,0]=3 1633 B12R1.27 OC[C@@H](O)COc1cnccn1 0eed07766913688fb589489d701afc2f [0,1,0,0,0,1|2,0,0]=4 1634 B12R1.27 OC[C@@H](O)COc1ncccn1 fb606f8980318ebc969c6d4c4b853e7d [0,1,0,0,0,1|2,0,0]=4 1635 B12R1.27 OC[C@H](F)CNc1ccccc1 9734eac13b001b84d3ee28ab012b0276 [0,1,0,0,0,1|2,0,0]=4 1636 B12R1.27 OC[C@H](F)CNc1ccccn1 9c1fd0a321ca27bdcba2b167501dd415 [0,1,0,0,0,1|1,0,0]=3 1637 B12R1.27 OC[C@H](F)CNc1cccnn1 629ab3e247071759d1dae6b893a9e5b7 [0,1,0,0,0,1|2,0,0]=4 1638 B12R1.27 OC[C@H](F)CNc1ccncn1 25dca2b737caaea3176c6988483e7be0 [0,1,0,0,0,1|2,0,0]=4 1639 B12R1.27 OC[C@H](F)CNc1cnccn1 d3061d41a310308078c944c00d350274 [0,1,0,0,0,1|2,0,0]=4 1640 B12R1.27 OC[C@H](F)CNc1ncccn1 2f2d808ea141af971353304ead1b3d7b [0,1,0,0,0,1|2,0,0]=4 1641 B12R1.27 OC[C@H](O)CNc1ccccc1 4df6835ea35fcadc1546d95d2a23469d [0,1,0,0,0,1|2,0,0]=4 1642 B12R1.27 OC[C@H](O)CNc1ccccn1 e668a53640e03ea6cd35db659b23303b [0,1,0,0,0,1|1,0,0]=3 1643 B12R1.27 OC[C@H](O)CNc1cccnn1 087448f1183ed7f43bb3b961de8ba49d [0,1,0,0,0,1|2,0,0]=4 1644 B12R1.27 OC[C@H](O)CNc1ccncn1 70c5dc777387b42dc9ea51088d2653ff [0,1,0,0,0,1|2,0,0]=4 1645 B12R1.27 OC[C@H](O)CNc1cnccn1 ee79647d0d893b6c2e8e16a89ef61985 [0,1,0,0,0,1|2,0,0]=4 1646 B12R1.27 OC[C@H](O)CNc1ncccn1 ababa3637c22251016991c8e9b423ba2 [0,1,0,0,0,1|2,0,0]=4 1647 B12R1.27 OC[C@H](O)COc1ccccn1 045d37c66440cc9315b76b72a2532fa4 [0,1,0,0,0,1|1,0,0]=3 1648 B12R1.27 OC[C@H](O)COc1cnccn1 f148bf1e896930240548bc4612b4a608 [0,1,0,0,0,1|2,0,0]=4 1649 B12R1.27 OC[C@H](O)COc1ncccn1 ec1e58c945dcba45a17837c41f7c3b4c [0,1,0,0,0,1|2,0,0]=4 1650 B12R1.43 CC(=O)C(C)Nc1ccccn1 6d5887e0d8b1250c5c284bdd7ecb6e6c [0,1,0,0,0,1|1,0,1]=4 1651 B12R1.43 CC(=O)C(C)Oc1ccccn1 956a9943d8f79641215d0b6217f9d9e7 [0,1,0,0,0,1|1,0,1]=4 1652 B12R1.43 CC(=O)N(C)Cc1ccccn1 c450d3ea04b8e825f53753140b07d344 [0,1,0,0,0,1|1,0,1]=4 1653 B12R1.43 CC(C)C(C)Nc1ccccc1 48093fab6ce2f9bea5eaf7557d6a555a [0,1,0,0,0,1|1,0,0]=3 1654 B12R1.43 CC(C)C(C)Nc1ccccn1 56417f300787c21b824e0c0aa0c41aee [0,1,0,0,0,1|0,0,0]=2 1655 B12R1.43 CC(C)C(C)Nc1cccnc1 d9c105ac720d93c173804a1a7215f55a [0,1,0,0,0,1|2,0,0]=4 1656 B12R1.43 CC(C)C(C)Nc1cccnn1 0a469f37b5444077b8692f36de1c05b8 [0,1,0,0,0,1|1,0,0]=3 1657 B12R1.43 CC(C)C(C)Nc1ccncc1 f569432198f25ecd4f5fab536aa2585a [0,1,0,0,0,1|2,0,0]=4 1658 B12R1.43 CC(C)C(C)Nc1ccncn1 1116d2be5f26d9154e843c4e9cc5cb8a [0,1,0,0,0,1|1,0,0]=3 1659 B12R1.43 CC(C)C(C)Nc1cnccn1 b5f607b374481fe7f7c596bdd3172c1b [0,1,0,0,0,1|1,0,0]=3 1660 B12R1.43 CC(C)C(C)Nc1cnncn1 7a7f61f70c037eaec193b34068d50f7b [0,1,0,0,0,1|2,0,0]=4 1661 B12R1.43 CC(C)C(C)Nc1ncccn1 fbb99fb5c3fa7aba16b51cfefb3dc222 [0,1,0,0,0,1|1,0,0]=3 1662 B12R1.43 CC(C)C(C)Nc1nccnn1 4c6d154f03e634e1b07c5ebef5d5585b [0,1,0,0,0,1|2,0,0]=4 1663 B12R1.43 CC(C)C(C)Nc1ncncn1 3a25df1247b3a42fb422ce31cffdd19e [0,1,0,0,0,1|2,0,0]=4 1664 B12R1.43 CC(C)C(C)Oc1ccccn1 0d1f1b8bafc8f4ae0cafc9a3a285e8fd [0,1,0,0,0,1|0,0,0]=2 1665 B12R1.43 CC(C)C(C)Oc1cccnc1 7dd98d846884613a0fa0dacf726d609e [0,1,0,0,0,1|2,0,0]=4 1666 B12R1.43 CC(C)C(C)Oc1ccncc1 e9f09d2447e1596ae903cb10648aeae2 [0,1,0,0,0,1|2,0,0]=4 1667 B12R1.43 CC(C)C(C)Oc1cnccn1 f783fc9cd6692dcbaa9e73f9e16f312b [0,1,0,0,0,1|1,0,0]=3 1668 B12R1.43 CC(C)C(C)Oc1ncccn1 8ed3f32e324e7960ad0151bf61e28cba [0,1,0,0,0,1|1,0,0]=3 1669 B12R1.43 CC(C)N(C)Cc1ccccc1 d5edd43e495581ab07d4c878cf7efc6a [0,1,0,0,0,1|1,0,0]=3 1670 B12R1.43 CC(C)N(C)Cc1ccccn1 1f5d3f68b51d0d1177f99817ac8f4046 [0,1,0,0,0,1|0,0,0]=2 1671 B12R1.43 CC(C)N(C)Cc1cccnc1 1e873a4fbb2a3d762374aea8e87346b5 [0,1,0,0,0,1|2,0,0]=4 1672 B12R1.43 CC(C)N(C)Cc1cccnn1 56b270dc77c53b384e585bf122092d3b [0,1,0,0,0,1|1,0,0]=3 1673 B12R1.43 CC(C)N(C)Cc1ccncc1 46734e331886f41f4f5306fbbfbe60e0 [0,1,0,0,0,1|2,0,0]=4 1674 B12R1.43 CC(C)N(C)Cc1ccncn1 c2e8d57c9d85953e86b5625c4dc8ce44 [0,1,0,0,0,1|1,0,0]=3 1675 B12R1.43 CC(C)N(C)Cc1cnccn1 b2491d397acf9864492335ec9ed2ee8b [0,1,0,0,0,1|1,0,0]=3 1676 B12R1.43 CC(C)N(C)Cc1ncccn1 cb846134316c5231ec12f246dd485fef [0,1,0,0,0,1|1,0,0]=3 1677 B12R1.43 CC(C)[C@@H](C)Nc1ccccc1 638de983f09ad8573a19e829866f679b [0,1,0,0,0,1|1,0,0]=3 1678 B12R1.43 CC(C)[C@@H](C)Nc1cccnc1 8cc5cb560100920359a30d0b936931d0 [0,1,0,0,0,1|2,0,0]=4 1679 B12R1.43 CC(C)[C@H](C)Nc1ccccc1 37a4cc2968d8598e2dd44bb0f3ee65d4 [0,1,0,0,0,1|1,0,0]=3 1680 B12R1.43 CC(C)[C@H](C)Nc1cccnc1 a0486500948362bfb0f4d9c857b8c881 [0,1,0,0,0,1|2,0,0]=4 1681 B12R1.43 CC(O)C(=O)Nc1ccccn1 f1d6303cd0d3b7df7383a33060640cf2 [0,1,0,0,0,1|1,0,1]=4 1682 B12R1.43 CC(O)C(C)Nc1ccccc1 807016486516eda629177f9c4eb1e753 [0,1,0,0,0,1|2,0,0]=4 1683 B12R1.43 CC(S)C(=O)Nc1ccccn1 6d0c7c3706380b1cb2cf4c87c48e0868 [0,1,0,0,0,1|1,0,1]=4 1684 B12R1.43 C[C@@H](O)C(=O)Nc1ccccn1 20404072193521e4c24d9cd80d7ff514 [0,1,0,0,0,1|1,0,1]=4 1685 B12R1.43 C[C@H](O)C(=O)Nc1ccccn1 10afc9763efda53effac1a6da94c3576 [0,1,0,0,0,1|1,0,1]=4 1686 B12R1.107 C=C(C)CN(C)c1ccccn1 71fe334c980c5de5251ac86975b71f68 [0,1,0,0,0,1|0,0,2]=4 1687 B12R1.107 CC(=O)NC(C)c1ccccn1 9f2410e3ed5d3dedf6c6d0d1d301442e [0,1,0,0,0,1|1,0,1]=4 1688 B12R1.107 CC(=O)N[C@@H](C)c1ccccn1 bbfb864aee062a617392dbd043149f2d [0,1,0,0,0,1|1,0,1]=4 1689 B12R1.107 CC(=O)N[C@H](C)c1ccccn1 c6420d1df4c62b07acb66dd07c94413a [0,1,0,0,0,1|1,0,1]=4 1690 B12R1.107 CC(C)CN(C)c1ccccc1 95fef0ba310b862ee7742e989aa00371 [0,1,0,0,0,1|1,0,0]=3 1691 B12R1.107 CC(C)CN(C)c1ccccn1 8902d7360de5bdf38f8ffbb3d266f9d8 [0,1,0,0,0,1|0,0,0]=2 1692 B12R1.107 CC(C)CN(C)c1cccnc1 a80b388d9409df9822a700b6b9414c72 [0,1,0,0,0,1|2,0,0]=4 1693 B12R1.107 CC(C)CN(C)c1cccnn1 f9c00f6f7f31a5b889a8a3c14d4b2b89 [0,1,0,0,0,1|1,0,0]=3 1694 B12R1.107 CC(C)CN(C)c1ccncc1 190e4353355d3998c1470756e6537d1f [0,1,0,0,0,1|2,0,0]=4 1695 B12R1.107 CC(C)CN(C)c1ccncn1 28eacd66d7a93303882b64be6085271b [0,1,0,0,0,1|1,0,0]=3 1696 B12R1.107 CC(C)CN(C)c1cnccn1 5feafdf4bd62bccb51c88ca1c5c90660 [0,1,0,0,0,1|1,0,0]=3 1697 B12R1.107 CC(C)CN(C)c1ncccn1 7763bbc3854536c5f3f8c30e90aa2e36 [0,1,0,0,0,1|1,0,0]=3 1698 B12R1.107 CC(C)CN(C)c1nccnn1 499daacb7cfc21f82c0a393bb86838c8 [0,1,0,0,0,1|2,0,0]=4 1699 B12R1.107 CC(C)NC(C)c1ccccn1 7a8a49744ff2dc697705e105a4d29b31 [0,1,0,0,0,1|0,0,0]=2 1700 B12R1.107 CC(C)NC(C)c1cccnc1 f83045cb9bb475cbbd0d72c753be3dbb [0,1,0,0,0,1|2,0,0]=4 1701 B12R1.107 CC(C)NC(C)c1cccnn1 26293dd49f70df18d847319875299dbd [0,1,0,0,0,1|1,0,0]=3 1702 B12R1.107 CC(C)NC(C)c1ccncc1 4565af1a01c9e3a5c5433e3411958097 [0,1,0,0,0,1|2,0,0]=4 1703 B12R1.107 CC(C)NC(C)c1ccncn1 34b6a27a2e8d3c4decef32691bd6427c [0,1,0,0,0,1|1,0,0]=3 1704 B12R1.107 CC(C)NC(C)c1cnccn1 84a7f59b7fa5379e0f7e834f97b5b6f2 [0,1,0,0,0,1|1,0,0]=3 1705 B12R1.107 CC(C)NC(C)c1ncccn1 e86ef39c1d5268c5e6aaf193ebdf6c96 [0,1,0,0,0,1|1,0,0]=3 1706 B12R1.107 CC(C)N[C@@H](C)c1ccccn1 5a8182a5c2834a1b8d14a1d525ca73eb [0,1,0,0,0,1|0,0,0]=2 1707 B12R1.107 CC(C)N[C@@H](C)c1cccnc1 bba252309d650ecc30069f3dddd1b105 [0,1,0,0,0,1|2,0,0]=4 1708 B12R1.107 CC(C)N[C@@H](C)c1ccncc1 775d0cb56d3dd6bc4738e2685aee9f6a [0,1,0,0,0,1|2,0,0]=4 1709 B12R1.107 CC(C)N[C@H](C)c1ccccn1 8a594a7c5da3e31c163d1068dcac9471 [0,1,0,0,0,1|0,0,0]=2 1710 B12R1.107 CC(C)N[C@H](C)c1cccnc1 ce94c3a37523dd9db9b3b4f768ea9506 [0,1,0,0,0,1|2,0,0]=4 1711 B12R1.107 CC(C)N[C@H](C)c1ccncc1 a8f7ac5675fa91c5d895f344e2b2bc66 [0,1,0,0,0,1|2,0,0]=4 1712 B12R1.107 CC(C)OC(C)c1ccccc1 c88937e1bba3e11ca71331a692d3263d [0,1,0,0,0,1|1,0,0]=3 1713 B12R1.107 CC(C)OC(C)c1ccccn1 e36bdb169f8c2820d6238217cf2c0c9b [0,1,0,0,0,1|0,0,0]=2 1714 B12R1.107 CC(C)OC(C)c1cccnc1 a720356d264ae2e2bd94268a34af0246 [0,1,0,0,0,1|2,0,0]=4 1715 B12R1.107 CC(C)OC(C)c1cccnn1 b9a675cb0413e62ea73a2fc61b472f4c [0,1,0,0,0,1|1,0,0]=3 1716 B12R1.107 CC(C)OC(C)c1ccncc1 dff8cce62d02c112ddba22a89b06b30b [0,1,0,0,0,1|2,0,0]=4 1717 B12R1.107 CC(C)OC(C)c1cnccn1 49dbbb014eb1d6d6604592a692551887 [0,1,0,0,0,1|1,0,0]=3 1718 B12R1.107 CC(C)OC(C)c1ncccn1 b23cbc3cd3127cb04e9d3cc352ec230e [0,1,0,0,0,1|1,0,0]=3 1719 B12R1.107 CC(C)O[C@@H](C)c1ccccc1 cd312c9ad337f3d7e7cf959a697dd297 [0,1,0,0,0,1|1,0,0]=3 1720 B12R1.107 CC(C)O[C@@H](C)c1ccccn1 6a258a3944fb55be34cbeaa329643f08 [0,1,0,0,0,1|0,0,0]=2 1721 B12R1.107 CC(C)O[C@@H](C)c1cccnc1 e078965ffd7282aede11459af9dd81de [0,1,0,0,0,1|2,0,0]=4 1722 B12R1.107 CC(C)O[C@@H](C)c1ccncc1 a72003c25fd185808d9c1b428a24fd38 [0,1,0,0,0,1|2,0,0]=4 1723 B12R1.107 CC(C)O[C@@H](C)c1ccncn1 bed54438b6203db69d9a1a5ad07b2058 [0,1,0,0,0,1|1,0,0]=3 1724 B12R1.107 CC(C)O[C@@H](C)c1cnccn1 009a5e07c5407526fe204e5b95c47bc3 [0,1,0,0,0,1|1,0,0]=3 1725 B12R1.107 CC(C)O[C@@H](C)c1ncccn1 56e13dc95b010111c031baa3ea76a9e4 [0,1,0,0,0,1|1,0,0]=3 1726 B12R1.107 CC(C)O[C@H](C)c1ccccc1 b2ce62b73f9b987a3fea9afe8162e394 [0,1,0,0,0,1|1,0,0]=3 1727 B12R1.107 CC(C)O[C@H](C)c1ccccn1 328ee8bf306075f10d7c4472fab39f5c [0,1,0,0,0,1|0,0,0]=2 1728 B12R1.107 CC(C)O[C@H](C)c1cccnc1 8b46fac7478602a39d5771164fd44ea8 [0,1,0,0,0,1|2,0,0]=4 1729 B12R1.107 CC(C)O[C@H](C)c1cccnn1 258869d92b5c7432895492f62b948e1d [0,1,0,0,0,1|1,0,0]=3 1730 B12R1.107 CC(C)O[C@H](C)c1ccncc1 0ca354191167bd77b68c3f542b91cfff [0,1,0,0,0,1|2,0,0]=4 1731 B12R1.107 CC(C)O[C@H](C)c1cnccn1 9a9e1989e4a9739b76eb56e3ea916435 [0,1,0,0,0,1|1,0,0]=3 1732 B12R1.107 CC(C)O[C@H](C)c1ncccn1 b27fe86b2e773326c121cfd8807cedb9 [0,1,0,0,0,1|1,0,0]=3 1733 B12R1.107 CC(O)CN(C)c1ccccc1 f96f86be852a8f681918c1e7f925b14c [0,1,0,0,0,1|2,0,0]=4 1734 B12R1.107 CC(O)CN(C)c1cccnn1 1c322cd267a516fbadcd110637f977e6 [0,1,0,0,0,1|2,0,0]=4 1735 B12R1.107 CC(O)CN(C)c1ccncn1 856fb79055e7dfde8054faed0dc226a3 [0,1,0,0,0,1|2,0,0]=4 1736 B12R1.107 CC(O)CN(C)c1cnccn1 0c5963eca3b43b7dbe63fc25f7d89dfb [0,1,0,0,0,1|2,0,0]=4 1737 B12R1.107 CC(O)CN(C)c1ncccn1 932fe967f2ac95a07966ae3381083442 [0,1,0,0,0,1|2,0,0]=4 1738 B12R1.107 CN(C)CN(C)c1ccncn1 81abe79658b775779d55cfb93559ce71 [0,1,0,0,0,1|2,0,0]=4 1739 B12R1.107 CN(C)CN(C)c1cnccn1 8ca0bdcec584bedf935db872bad4aa03 [0,1,0,0,0,1|2,0,0]=4 1740 B12R1.107 CN(C)CN(C)c1ncccn1 b6750d95d0668d903d3bb7a6e28fd672 [0,1,0,0,0,1|2,0,0]=4 1741 B12R1.107 CN(CC(F)F)c1ccccn1 b04ee8e688cf04a9d79e18432249ac14 [0,1,0,0,0,1|2,0,0]=4 1742 B12R1.107 C[C@H](O)CN(C)c1ccccc1 623c379093f4d5c87dbfc7a6a5452bce [0,1,0,0,0,1|2,0,0]=4 1743 B12R1.107 C[C@H](O)CN(C)c1cccnn1 30d1677c9624272e2ac32f5aadc53724 [0,1,0,0,0,1|2,0,0]=4 1744 B12R1.107 C[C@H](O)CN(C)c1ccncn1 367e5c4b202bca095bf1fec483c70387 [0,1,0,0,0,1|2,0,0]=4 1745 B12R1.107 C[C@H](O)CN(C)c1cnccn1 e7140e82e0ba3da361ffbb30c9119f91 [0,1,0,0,0,1|2,0,0]=4 1746 B12R1.107 C[C@H](O)CN(C)c1ncccn1 7f650c85a1af20974b789ac773bff4cc [0,1,0,0,0,1|2,0,0]=4 1747 B12R1.125 C=C(C)CNc1ncccc1Br 45d5596d61c241e46ccb38c3a38d5cf1 [0,1,0,0,0,1|0,0,2]=4 1748 B12R1.125 C=C(C)CNc1ncccc1C 3f0687faaed092af2498b0fecad2c0a1 [0,1,0,0,0,1|0,0,2]=4 1749 B12R1.125 C=C(C)CNc1ncccc1Cl 3795f332154c5545c8c1b857118a64f5 [0,1,0,0,0,1|0,0,2]=4 1750 B12R1.125 C=C(C)CNc1ncccc1F 0ae0b708969c5a6db8beee753f6fb28e [0,1,0,0,0,1|0,0,2]=4 1751 B12R1.125 C=C(C)CNc1ncccc1I 6837363ded23ace3a7e5c8987f0f0dc0 [0,1,0,0,0,1|0,0,2]=4 1752 B12R1.125 C=C(C)COc1ncccc1Br 57c50c1ff2da9259522d15c826fdd6f1 [0,1,0,0,0,1|0,0,2]=4 1753 B12R1.125 C=C(C)COc1ncccc1C 40dba3eeb8e9790b141f85136580e1f2 [0,1,0,0,0,1|0,0,2]=4 1754 B12R1.125 C=C(C)COc1ncccc1Cl ac35ea87058003c54a26cacc81cddf49 [0,1,0,0,0,1|0,0,2]=4 1755 B12R1.125 C=C(C)COc1ncccc1F 6821e8491fb855c37166f376d0d64369 [0,1,0,0,0,1|0,0,2]=4 1756 B12R1.125 CC(=O)CNc1ncccc1C 8c46539dba1af3f1e1a25f7220da0d1f [0,1,0,0,0,1|1,0,1]=4 1757 B12R1.125 CC(=O)CNc1ncccc1F 3b414f316fb6f5d0839469fddf69a691 [0,1,0,0,0,1|1,0,1]=4 1758 B12R1.125 CC(=O)CNc1ncccc1O 0d8aef73d615e9f0d4ce4315f9f9bb07 [0,1,0,0,0,1|1,0,1]=4 1759 B12R1.125 CC(=O)NCc1ncccc1Br e4fffdfee10e36c569e067c3c218f970 [0,1,0,0,0,1|1,0,1]=4 1760 B12R1.125 CC(=O)NCc1ncccc1C aca4e86732225f733801ebe508110b68 [0,1,0,0,0,1|1,0,1]=4 1761 B12R1.125 CC(=O)NCc1ncccc1Cl 0b2d7789d42fa9dba1a6fd00984de015 [0,1,0,0,0,1|1,0,1]=4 1762 B12R1.125 CC(=O)NCc1ncccc1F 5b6f475df8e6a6b3575519ff77a19400 [0,1,0,0,0,1|1,0,1]=4 1763 B12R1.125 CC(=O)NCc1ncccc1O 25474b4a15ab9026b21497dfe5b7bebd [0,1,0,0,0,1|1,0,1]=4 1764 B12R1.125 CC(C)CNc1c[nH]ccc1=O 3b03ea0bb77f8e7d321e8ba0c96772d1 [0,1,0,0,0,1|2,0,0]=4 1765 B12R1.125 CC(C)CNc1ccc[nH]c1=S 8e3a62399c7f1ac89cf2c2b861315f33 [0,1,0,0,0,1|2,0,0]=4 1766 B12R1.125 CC(C)CNc1cccc[n+]1[O-] 689b30fb24174281715b1e2295d6fd1b [0,1,0,0,0,1|0,0,1]=3 1767 B12R1.125 CC(C)CNc1ccccc1Br 97dcb5c3c65ce65124839fce143060ed [0,1,0,0,0,1|1,0,0]=3 1768 B12R1.125 CC(C)CNc1ccccc1Cl 75d6f72f33e1b81eaa5975119e7851a7 [0,1,0,0,0,1|1,0,0]=3 1769 B12R1.125 CC(C)CNc1ccccc1F 1f6d990d4611c55e81ba435b4de3227f [0,1,0,0,0,1|1,0,0]=3 1770 B12R1.125 CC(C)CNc1ccccc1I 8137d11aab68af4ff87c3b0c458aeadf [0,1,0,0,0,1|1,0,0]=3 1771 B12R1.125 CC(C)CNc1ccccc1S abeaa0222adaeba5cb90e228335806a0 [0,1,0,0,0,1|1,0,0]=3 1772 B12R1.125 CC(C)CNc1cccnc1Br e4e35cf9a45e8464362812984f0dcb29 [0,1,0,0,0,1|2,0,0]=4 1773 B12R1.125 CC(C)CNc1cccnc1Cl e27f120938cdfad22a9d53ca2ece2161 [0,1,0,0,0,1|2,0,0]=4 1774 B12R1.125 CC(C)CNc1cccnc1F 96b3802c2db207930b95c94df62440dc [0,1,0,0,0,1|2,0,0]=4 1775 B12R1.125 CC(C)CNc1cccnc1I 48231421f771901ae224cd2d83518b5a [0,1,0,0,0,1|2,0,0]=4 1776 B12R1.125 CC(C)CNc1ccncc1Br c2ed8fd4459e567e6fc82d9899d25f80 [0,1,0,0,0,1|2,0,0]=4 1777 B12R1.125 CC(C)CNc1ccncc1Cl 1a3dd903c6829977355f03ea4926eb4b [0,1,0,0,0,1|2,0,0]=4 1778 B12R1.125 CC(C)CNc1ccncc1F 5747fbc5541ea5634e0d79e127688ce0 [0,1,0,0,0,1|2,0,0]=4 1779 B12R1.125 CC(C)CNc1ccncc1I 1554741b1b824ec64a61799e1f57cd4a [0,1,0,0,0,1|2,0,0]=4 1780 B12R1.125 CC(C)CNc1cnccc1Br a1750953a126ec3c55ead7f1bbd124cb [0,1,0,0,0,1|2,0,0]=4 1781 B12R1.125 CC(C)CNc1cnccc1Cl ea676dc248bf0bb68510cef98a5c2721 [0,1,0,0,0,1|2,0,0]=4 1782 B12R1.125 CC(C)CNc1cnccc1F bd64b3b317a29392a4044c03bdb541d5 [0,1,0,0,0,1|2,0,0]=4 1783 B12R1.125 CC(C)CNc1cnccc1I 05e43f5b8e6667c6fbf8f845bd4fb066 [0,1,0,0,0,1|2,0,0]=4 1784 B12R1.125 CC(C)CNc1cnccc1S 24918fb93412c853be460e7bc090cec7 [0,1,0,0,0,1|2,0,0]=4 1785 B12R1.125 CC(C)CNc1ncccc1Br fae7f676714f4f0b4d9a3346ec38d262 [0,1,0,0,0,1|0,0,0]=2 1786 B12R1.125 CC(C)CNc1ncccc1Cl 6854bd1dac0bcfd1589f4cde44ac0686 [0,1,0,0,0,1|0,0,0]=2 1787 B12R1.125 CC(C)CNc1ncccc1F c9b843ec39757011d12a4f0d9d477f19 [0,1,0,0,0,1|0,0,0]=2 1788 B12R1.125 CC(C)CNc1ncccc1I a8a8c3c3e1f4d6c6293dd19e4366ca81 [0,1,0,0,0,1|0,0,0]=2 1789 B12R1.125 CC(C)CNc1nccnc1Br 7a3db6762f00c94b79cab8721cfb0e6c [0,1,0,0,0,1|1,0,0]=3 1790 B12R1.125 CC(C)CNc1nccnc1Cl dd927439bde3f8a81ffb69ed26a09444 [0,1,0,0,0,1|1,0,0]=3 1791 B12R1.125 CC(C)CNc1nccnc1I 23302d05465fc43a29a79514291627f0 [0,1,0,0,0,1|1,0,0]=3 1792 B12R1.125 CC(C)CNc1ncncc1Br 81c1ea257dca30b0d3b0522bea5f8a85 [0,1,0,0,0,1|1,0,0]=3 1793 B12R1.125 CC(C)CNc1ncncc1Cl 13e6abe55e0e4a1cbcdfed72dcc7ae29 [0,1,0,0,0,1|1,0,0]=3 1794 B12R1.125 CC(C)CNc1ncncc1F 057b2dbabe281b62324764b62e2a910f [0,1,0,0,0,1|1,0,0]=3 1795 B12R1.125 CC(C)CNc1ncncc1I 2987a22f7c799e2c1ea59135afb02c1d [0,1,0,0,0,1|1,0,0]=3 1796 B12R1.125 CC(C)COc1ccc[nH]c1=S 7cf31679b8b84a26df7d913fb8de737f [0,1,0,0,0,1|2,0,0]=4 1797 B12R1.125 CC(C)COc1cccc[n+]1[O-] 90f4e1bdff35950ddac633fbe78456a9 [0,1,0,0,0,1|0,0,1]=3 1798 B12R1.125 CC(C)COc1ccccc1Br 15e4cd0efed59b74bb1886c65548b9ce [0,1,0,0,0,1|1,0,0]=3 1799 B12R1.125 CC(C)COc1ccccc1Cl ec2a4d693a1f337c73c825dab32a22e8 [0,1,0,0,0,1|1,0,0]=3 1800 B12R1.125 CC(C)COc1ccccc1F 3d250d7b85e326d2d954c337a0f1907d [0,1,0,0,0,1|1,0,0]=3 1801 B12R1.125 CC(C)COc1ccccc1I 179013c2eef1a81cfd9d0470359a57c5 [0,1,0,0,0,1|1,0,0]=3 1802 B12R1.125 CC(C)COc1ccccc1S 3c07cbd446137458a8a811b24d5966d2 [0,1,0,0,0,1|1,0,0]=3 1803 B12R1.125 CC(C)COc1cccnc1Br 0278dcd8e75402c6e226bd0d671b7cf3 [0,1,0,0,0,1|2,0,0]=4 1804 B12R1.125 CC(C)COc1cccnc1Cl 41fd6af4f5d26b414a821e4b03b3d8fa [0,1,0,0,0,1|2,0,0]=4 1805 B12R1.125 CC(C)COc1cccnc1F fd7af796a2b1344ab209b53adf573de3 [0,1,0,0,0,1|2,0,0]=4 1806 B12R1.125 CC(C)COc1cccnc1I 8818acbf89666f4ebe1942f8299c4bc1 [0,1,0,0,0,1|2,0,0]=4 1807 B12R1.125 CC(C)COc1cccoc1=O 45df10a23fce7e58eaab8fa4ac81b508 [0,1,0,0,0,1|2,0,0]=4 1808 B12R1.125 CC(C)COc1ccncc1Br 76b5f88eb65a5cfb6ae6b530d5f76337 [0,1,0,0,0,1|2,0,0]=4 1809 B12R1.125 CC(C)COc1ccncc1Cl f28708ed6a61c93329f92a369d11035a [0,1,0,0,0,1|2,0,0]=4 1810 B12R1.125 CC(C)COc1ccncc1F 6c709eb8750c3a8924247fa6b8a79fc8 [0,1,0,0,0,1|2,0,0]=4 1811 B12R1.125 CC(C)COc1cnccc1Br baa265ac6db9382ad621fb0e3d2e4286 [0,1,0,0,0,1|2,0,0]=4 1812 B12R1.125 CC(C)COc1cnccc1Cl f1a754cc7617bfcd453fe7e24b90cd5e [0,1,0,0,0,1|2,0,0]=4 1813 B12R1.125 CC(C)COc1cnccc1F d2888be0656caedf957d8f1373572b95 [0,1,0,0,0,1|2,0,0]=4 1814 B12R1.125 CC(C)COc1cnccc1I 446f87702702d377df3b308dd5125063 [0,1,0,0,0,1|2,0,0]=4 1815 B12R1.125 CC(C)COc1coccc1=O 614bed8cd5a90cce22ec40c4fdcd726a [0,1,0,0,0,1|2,0,0]=4 1816 B12R1.125 CC(C)COc1ncccc1Br 3f386d7d47b34b2ac46f0a2ae6e73e95 [0,1,0,0,0,1|0,0,0]=2 1817 B12R1.125 CC(C)COc1ncccc1Cl 6de14ae7428ddbeb75053110c130c498 [0,1,0,0,0,1|0,0,0]=2 1818 B12R1.125 CC(C)COc1ncccc1F a9cb4a7eade6381f71dc5eb3e7f6b4ad [0,1,0,0,0,1|0,0,0]=2 1819 B12R1.125 CC(C)COc1nccnc1Br 6e621a660be38c569afa1cdfd4e4a619 [0,1,0,0,0,1|1,0,0]=3 1820 B12R1.125 CC(C)COc1ncncc1Cl e2270ed6e92319d473813e711850fab4 [0,1,0,0,0,1|1,0,0]=3 1821 B12R1.125 CC(C)COc1ncncc1F ad8619d7a1a557a4c2f9644c17b80fff [0,1,0,0,0,1|1,0,0]=3 1822 B12R1.125 CC(C)COc1ncncc1I bbf02c0da9afea92f590d3bcba639c83 [0,1,0,0,0,1|1,0,0]=3 1823 B12R1.125 CC(C)COc1nnccc1Cl 6aa320793d459924367c709b3023d874 [0,1,0,0,0,1|1,0,0]=3 1824 B12R1.125 CC(C)COc1nnccc1I 108465f2559ff3785f8f5314c7d646bf [0,1,0,0,0,1|1,0,0]=3 1825 B12R1.125 CC(C)COn1ccccc1=N e29cdf3d114d78764214cf0d7bd88c1b [0,1,0,0,0,1|2,0,0]=4 1826 B12R1.125 CC(C)COn1ccccc1=O 520cbc87b96c5de6e4f7512692f10f1c [0,1,0,0,0,1|2,0,0]=4 1827 B12R1.125 CC(C)COn1ccccc1=S 6836594d7ae7c3a48edd8c4299ac9353 [0,1,0,0,0,1|2,0,0]=4 1828 B12R1.125 CC(C)NCc1cccc[n+]1[O-] 75c78e72999a2a9c82d82071968cfcf8 [0,1,0,0,0,1|0,0,1]=3 1829 B12R1.125 CC(C)NCc1ccccc1Cl 9b9897219917fd3530700a473a4db4bc [0,1,0,0,0,1|1,0,0]=3 1830 B12R1.125 CC(C)NCc1ccccc1F 22106e2f6b32da238c4d16ecaebf9107 [0,1,0,0,0,1|1,0,0]=3 1831 B12R1.125 CC(C)NCc1ccccc1I 3b248e8d40a66b793c94674298302a5d [0,1,0,0,0,1|1,0,0]=3 1832 B12R1.125 CC(C)NCc1cccnc1Br 22459f2ca835d8f7937b98fb2a9c12c5 [0,1,0,0,0,1|2,0,0]=4 1833 B12R1.125 CC(C)NCc1cccnc1Cl 1a6e41b1638b07ef5214929c520cab92 [0,1,0,0,0,1|2,0,0]=4 1834 B12R1.125 CC(C)NCc1cccnc1F 25593b5896d79eeec200973b3dd6952c [0,1,0,0,0,1|2,0,0]=4 1835 B12R1.125 CC(C)NCc1ccncc1Br d81e7ee16e73504478b6791c384b9ec3 [0,1,0,0,0,1|2,0,0]=4 1836 B12R1.125 CC(C)NCc1ccncc1Cl 251b95b9f8185cc37c498345c403ee2f [0,1,0,0,0,1|2,0,0]=4 1837 B12R1.125 CC(C)NCc1ccncc1F 3fd62883cc180b7243d81db6adc63828 [0,1,0,0,0,1|2,0,0]=4 1838 B12R1.125 CC(C)NCc1ncccc1Br ba070c387cfb926f8a021c30b52f1b8f [0,1,0,0,0,1|0,0,0]=2 1839 B12R1.125 CC(C)NCc1ncccc1Cl 1546787973be24b721a8bc7496cac392 [0,1,0,0,0,1|0,0,0]=2 1840 B12R1.125 CC(C)NCc1ncccc1F aa0069dced2d7cc22965885f3f7a9397 [0,1,0,0,0,1|0,0,0]=2 1841 B12R1.125 CC(C)NCc1nccnc1Cl 74733b782e009da747c4009745ad32b0 [0,1,0,0,0,1|1,0,0]=3 1842 B12R1.125 CC(C)NCc1nnc[nH]c1=O 74992fe247281a1b75df777b6b1bfff8 [0,1,0,0,0,1|2,0,0]=4 1843 B12R1.125 CC(C)OCc1ccc[nH]c1=O e297c1be086c22b1e84c5a8b3babb68d [0,1,0,0,0,1|2,0,0]=4 1844 B12R1.125 CC(C)OCc1ccccc1Cl f1d0578f20039107ab7831c744270352 [0,1,0,0,0,1|1,0,0]=3 1845 B12R1.125 CC(C)OCc1ccccc1F 88ffe0c3ffb1a7712dee49c51d8757cb [0,1,0,0,0,1|1,0,0]=3 1846 B12R1.125 CC(C)OCc1ccccc1I 091e4f6992ab541edd05dc5206b2152a [0,1,0,0,0,1|1,0,0]=3 1847 B12R1.125 CC(C)OCc1cccnc1Br 054a1fa90d466c66e80e2f94ee0cc8ad [0,1,0,0,0,1|2,0,0]=4 1848 B12R1.125 CC(C)OCc1cccnc1Cl 9341dccfc0e34600d7a9f7d86868c180 [0,1,0,0,0,1|2,0,0]=4 1849 B12R1.125 CC(C)OCc1cccnc1F 43198bce1943ba438eca35cf747bbab3 [0,1,0,0,0,1|2,0,0]=4 1850 B12R1.125 CC(C)OCc1ccncc1Cl b2bd70abc2680c5faca01e36afe3c508 [0,1,0,0,0,1|2,0,0]=4 1851 B12R1.125 CC(C)OCc1ccncc1F e0f664bd9f24e773b8099a6425861e38 [0,1,0,0,0,1|2,0,0]=4 1852 B12R1.125 CC(C)OCc1ccncc1I a9ac24f885be578976859e0b73ccf536 [0,1,0,0,0,1|2,0,0]=4 1853 B12R1.125 CC(C)OCc1cnccc1Br 3e276621683da2bb94d01c109be41823 [0,1,0,0,0,1|2,0,0]=4 1854 B12R1.125 CC(C)OCc1cnccc1Cl eb99f0c34344c7f47466de55040bd0d4 [0,1,0,0,0,1|2,0,0]=4 1855 B12R1.125 CC(C)OCc1cnccc1F 68c200210a3748d543a35abac99f931b [0,1,0,0,0,1|2,0,0]=4 1856 B12R1.125 CC(C)OCc1ncccc1Br 4614c9d7b350005a40859c2bd40e6e3d [0,1,0,0,0,1|0,0,0]=2 1857 B12R1.125 CC(C)OCc1ncccc1Cl 4451d4ad31d9d68f63a26b0996be1d97 [0,1,0,0,0,1|0,0,0]=2 1858 B12R1.125 CC(C)OCc1ncccc1F a6ff5296d7d94bb454d989a3d95e21c4 [0,1,0,0,0,1|0,0,0]=2 1859 B12R1.125 CC(C)OCc1nccnc1Cl cf955ada05304600400341f0a06ba741 [0,1,0,0,0,1|1,0,0]=3 1860 B12R1.125 CC(O)CNc1cccc[n+]1[O-] 58ef4e5c02549723bc3393d8daa55594 [0,1,0,0,0,1|1,0,1]=4 1861 B12R1.125 CC(O)CNc1ccccc1Br 4a8178895a974705dd8c5d47896d821f [0,1,0,0,0,1|2,0,0]=4 1862 B12R1.125 CC(O)CNc1ccccc1Cl 18a1aeb377915ff3d7752e638825109f [0,1,0,0,0,1|2,0,0]=4 1863 B12R1.125 CC(O)CNc1ccccc1F 2118f4d689b50b2f5bf4fe77b0346bb5 [0,1,0,0,0,1|2,0,0]=4 1864 B12R1.125 CC(O)CNc1ccccc1I 4ba68e475ff4710ffb78d3e623e4dd83 [0,1,0,0,0,1|2,0,0]=4 1865 B12R1.125 CC(O)CNc1ccccc1S c9cd17787d858b75a205fbdc344be6ff [0,1,0,0,0,1|2,0,0]=4 1866 B12R1.125 CC(O)CNc1ncccc1Br 07bd0212188f6402081d3601f8be3e37 [0,1,0,0,0,1|1,0,0]=3 1867 B12R1.125 CC(O)CNc1ncccc1Cl fb81df189928bf6a6f8705b7c6310d7f [0,1,0,0,0,1|1,0,0]=3 1868 B12R1.125 CC(O)CNc1ncccc1F 5c44bed55227ca225f290d0a98f09154 [0,1,0,0,0,1|1,0,0]=3 1869 B12R1.125 CC(O)CNc1ncccc1I b32669ead1f744a88a5ba4686f32e11f [0,1,0,0,0,1|1,0,0]=3 1870 B12R1.125 CC(O)CNc1nccnc1Br cc4d4b08fae26fb04cdddfd3aca5f05a [0,1,0,0,0,1|2,0,0]=4 1871 B12R1.125 CC(O)CNc1nccnc1Cl 6834193a32564dc37ba03b5264bcaa81 [0,1,0,0,0,1|2,0,0]=4 1872 B12R1.125 CC(O)CNc1nccnc1I 59f1472df2ab39c7f7ac33aea6f92d3d [0,1,0,0,0,1|2,0,0]=4 1873 B12R1.125 CC(O)CNc1ncncc1Br 8688ff4334942155e6617bc49678216c [0,1,0,0,0,1|2,0,0]=4 1874 B12R1.125 CC(O)CNc1ncncc1Cl c4a8759560c83246518d9dc27481a8f3 [0,1,0,0,0,1|2,0,0]=4 1875 B12R1.125 CC(O)CNc1ncncc1F a4417d2546eacdd3f1a20bf81c15911a [0,1,0,0,0,1|2,0,0]=4 1876 B12R1.125 CC(O)CNc1ncncc1I 6aca8c3f0ffac486542d82f2a98a5b58 [0,1,0,0,0,1|2,0,0]=4 1877 B12R1.125 CN(C)CNc1cccc[n+]1[O-] f5a5c36c8838bcfbd083a7bfa4d4edee [0,1,0,0,0,1|1,0,1]=4 1878 B12R1.125 CN(C)CNc1ccccc1I 9db091b00fc74cd0330b59002f1d7c8a [0,1,0,0,0,1|2,0,0]=4 1879 B12R1.125 CN(C)CNc1ncccc1Br 8aa8740e00f7dc6bcf5287eabb084590 [0,1,0,0,0,1|1,0,0]=3 1880 B12R1.125 CN(C)CNc1ncccc1Cl 62da9edd5ceca1dbb768561e7bfa19a1 [0,1,0,0,0,1|1,0,0]=3 1881 B12R1.125 CN(C)CNc1ncccc1F e9058db4b4166674a7e1857876078392 [0,1,0,0,0,1|1,0,0]=3 1882 B12R1.125 CN(C)CNc1ncccc1I 9c722473668fb7ad29bc2ec6303f8751 [0,1,0,0,0,1|1,0,0]=3 1883 B12R1.125 CN(C)CNc1nccnc1Br 391e9cdf5cba9a3392d4a10de234aebb [0,1,0,0,0,1|2,0,0]=4 1884 B12R1.125 CN(C)CNc1nccnc1Cl 94b2aa3e4919ffee61b0cd4ad1881ca8 [0,1,0,0,0,1|2,0,0]=4 1885 B12R1.125 CN(C)CNc1nccnc1I 9942d75a30f4732a0737076cb0f1ab87 [0,1,0,0,0,1|2,0,0]=4 1886 B12R1.125 CN(C)CNc1ncncc1Br ece51a730bf3c8304a61a05ea8b4d93f [0,1,0,0,0,1|2,0,0]=4 1887 B12R1.125 CN(C)CNc1ncncc1Cl 4c5251c398a71999bfb37a2e93b541bf [0,1,0,0,0,1|2,0,0]=4 1888 B12R1.125 CN(C)CNc1ncncc1F c2167beb84d19e50d03197cafeee8211 [0,1,0,0,0,1|2,0,0]=4 1889 B12R1.125 CN(C)CNc1ncncc1I b9ea3c907690b0ddf0057c4431503f54 [0,1,0,0,0,1|2,0,0]=4 1890 B12R1.125 CN(C)COc1cccc[n+]1[O-] 86aace5b574904c15e5139fbf05333f8 [0,1,0,0,0,1|1,0,1]=4 1891 B12R1.125 CN(C)COc1ccccc1Cl 97615d5e6a9b6d2759b55d0ad129882e [0,1,0,0,0,1|2,0,0]=4 1892 B12R1.125 CN(C)COc1ccccc1F d924d84b19d4fe40db67235213a44035 [0,1,0,0,0,1|2,0,0]=4 1893 B12R1.125 CN(C)COc1ccccc1I 6002f90dd33e7c9d3ab5ef7fc55225a1 [0,1,0,0,0,1|2,0,0]=4 1894 B12R1.125 CN(C)COc1ncccc1Br 7f9de696ee8ea6910493bd394b5d0084 [0,1,0,0,0,1|1,0,0]=3 1895 B12R1.125 CN(C)COc1ncccc1Cl 931e9401e5b14a57b5986dd9b44c7cdd [0,1,0,0,0,1|1,0,0]=3 1896 B12R1.125 CN(C)COc1ncccc1F 59444ad0b00cb4bff36a3da01222a736 [0,1,0,0,0,1|1,0,0]=3 1897 B12R1.125 CN(C)COc1nccnc1Br 5a98f03358b01b961bf7a552238955dd [0,1,0,0,0,1|2,0,0]=4 1898 B12R1.125 CN(C)COc1ncncc1Cl 2bb3e578df9f7baceeea70a133478a39 [0,1,0,0,0,1|2,0,0]=4 1899 B12R1.125 CN(C)COc1ncncc1F 16d144118a8dc5c6f3b9fd58a7135a28 [0,1,0,0,0,1|2,0,0]=4 1900 B12R1.125 CN(C)COc1ncncc1I a011599e78c8fe8d50e63781e8db1271 [0,1,0,0,0,1|2,0,0]=4 1901 B12R1.125 CN(C)COc1nnccc1Cl e3deb3143fe78d8f1d57f2fa097c6702 [0,1,0,0,0,1|2,0,0]=4 1902 B12R1.125 CN(C)COc1nnccc1I 7ec2d217773f8d49b64b2446b77c7c62 [0,1,0,0,0,1|2,0,0]=4 1903 B12R1.125 C[C@@H](O)CNc1cccc[n+]1[O-] 687afa08a076e2b07454026ec39dcbac [0,1,0,0,0,1|1,0,1]=4 1904 B12R1.125 C[C@@H](O)CNc1ccccc1I 9fbcb093ddb932bd7f24eaa426a08c17 [0,1,0,0,0,1|2,0,0]=4 1905 B12R1.125 C[C@@H](O)CNc1ncccc1F 8d1fce3ad304cd5add0f920bc2011ffa [0,1,0,0,0,1|1,0,0]=3 1906 B12R1.125 C[C@@H](O)CNc1ncccc1I 8f85ec08735117db5aa326be3c8b449f [0,1,0,0,0,1|1,0,0]=3 1907 B12R1.125 C[C@@H](O)CNc1nccnc1Br 53bc0939e796139317b30a0557107641 [0,1,0,0,0,1|2,0,0]=4 1908 B12R1.125 C[C@@H](O)CNc1nccnc1Cl 84fa54c54da9940b46748dde2bf5da88 [0,1,0,0,0,1|2,0,0]=4 1909 B12R1.125 C[C@@H](O)CNc1nccnc1I d9ba8c3e809b4805db25e99080cd4f46 [0,1,0,0,0,1|2,0,0]=4 1910 B12R1.125 C[C@@H](O)CNc1ncncc1Br 2fd6a5fbce337ee4e586442e7bc72b23 [0,1,0,0,0,1|2,0,0]=4 1911 B12R1.125 C[C@H](O)CNc1cccc[n+]1[O-] 3ca150da2baee929ab0eb5c41a876172 [0,1,0,0,0,1|1,0,1]=4 1912 B12R1.125 C[C@H](O)CNc1ccccc1Br c817d086f8954ccab620e5f4c72375d6 [0,1,0,0,0,1|2,0,0]=4 1913 B12R1.125 C[C@H](O)CNc1ccccc1Cl 764c54c7fa40fe5604a3aadd5e4b8400 [0,1,0,0,0,1|2,0,0]=4 1914 B12R1.125 C[C@H](O)CNc1ccccc1F 215b77315898b180d735c74dedf26562 [0,1,0,0,0,1|2,0,0]=4 1915 B12R1.125 C[C@H](O)CNc1ccccc1I a750a87f3e2f024043f4659d08af95be [0,1,0,0,0,1|2,0,0]=4 1916 B12R1.125 C[C@H](O)CNc1ccccc1S a2817a071e3134750611d07f0df977a7 [0,1,0,0,0,1|2,0,0]=4 1917 B12R1.125 C[C@H](O)CNc1ncccc1Br 0cd2e15e8d36860b3e21dab3e9fca808 [0,1,0,0,0,1|1,0,0]=3 1918 B12R1.125 C[C@H](O)CNc1ncccc1Cl d053537d578a96648da276ead9a8082b [0,1,0,0,0,1|1,0,0]=3 1919 B12R1.125 C[C@H](O)CNc1ncccc1F 9167006b81bfb33786aa0bc27dcdeb3d [0,1,0,0,0,1|1,0,0]=3 1920 B12R1.125 C[C@H](O)CNc1ncccc1I ddf72d40dbf0953fdd2ccbeedb79e867 [0,1,0,0,0,1|1,0,0]=3 1921 B12R1.125 C[C@H](O)CNc1nccnc1Br 2b2272ced237b2785135ce64b8f6f5f1 [0,1,0,0,0,1|2,0,0]=4 1922 B12R1.125 C[C@H](O)CNc1nccnc1Cl e2402ce8d2abb48f3c4ce46737c4dcb6 [0,1,0,0,0,1|2,0,0]=4 1923 B12R1.125 C[C@H](O)CNc1nccnc1I 3ab4f844d13dc351cbe56eb74040719a [0,1,0,0,0,1|2,0,0]=4 1924 B12R1.125 C[C@H](O)CNc1ncncc1Br 0272c8e1ea4a569345c45381f145f189 [0,1,0,0,0,1|2,0,0]=4 1925 B12R1.125 C[C@H](O)CNc1ncncc1Cl 2f8bf4bf5aec8dc2216df65fb4b8ef00 [0,1,0,0,0,1|2,0,0]=4 1926 B12R1.125 C[C@H](O)CNc1ncncc1F c0072eca7885b6054adffa3de4307858 [0,1,0,0,0,1|2,0,0]=4 1927 B12R1.125 C[C@H](O)CNc1ncncc1I ddc915dc5d4607dcd9aa0d3c50ebcb54 [0,1,0,0,0,1|2,0,0]=4 1928 B12R1.125 Cc1ccccc1CNC(C)C 2dd08d80be2d3e51d4d72fed96629045 [0,1,0,0,0,1|1,0,0]=3 1929 B12R1.125 Cc1ccccc1NCC(C)C 1586ab8e64ea906befcc8bbfad124462 [0,1,0,0,0,1|1,0,0]=3 1930 B12R1.125 Cc1ccccc1NCC(C)O 31ba569e9dedf1c2e9bd352e34766cab [0,1,0,0,0,1|2,0,0]=4 1931 B12R1.125 Cc1ccccc1NC[C@H](C)O f7931a4967f5c286879c882148e8589e [0,1,0,0,0,1|2,0,0]=4 1932 B12R1.125 Cc1ccccc1OCC(C)C 364254b27b947c9392bf52594b3dc819 [0,1,0,0,0,1|1,0,0]=3 1933 B12R1.125 Cc1ccccc1OCN(C)C 352a0cc9d2eab6580b092e8e3f27bcfa [0,1,0,0,0,1|2,0,0]=4 1934 B12R1.125 Cc1cccnc1CNC(C)C 5c608f0fb577a4839d6566b1f8cde4a7 [0,1,0,0,0,1|0,0,0]=2 1935 B12R1.125 Cc1cccnc1COC(C)C d0c708a01280fb6f5078e1dd21e398c6 [0,1,0,0,0,1|0,0,0]=2 1936 B12R1.125 Cc1cccnc1NCC(C)C 282c02e5a453782598cad364ccee854e [0,1,0,0,0,1|0,0,0]=2 1937 B12R1.125 Cc1cccnc1NCC(C)O 35dc987bd3bce708549aef0f92ed4026 [0,1,0,0,0,1|1,0,0]=3 1938 B12R1.125 Cc1cccnc1NCC(F)F c6fa291441ab1d885c2ed66fed255e1f [0,1,0,0,0,1|2,0,0]=4 1939 B12R1.125 Cc1cccnc1NCN(C)C 9768761a4de7cf6a83c2de6ca1c019b9 [0,1,0,0,0,1|1,0,0]=3 1940 B12R1.125 Cc1cccnc1NC[C@@H](C)O e4ef53946909e77e87e6f77348db81d0 [0,1,0,0,0,1|1,0,0]=3 1941 B12R1.125 Cc1cccnc1NC[C@H](C)O abae2ad82f4f1fc30603b3fd48fc0e6e [0,1,0,0,0,1|1,0,0]=3 1942 B12R1.125 Cc1cccnc1OCC(C)C 573ebe28edc295f62b8c3f4cb7f93024 [0,1,0,0,0,1|0,0,0]=2 1943 B12R1.125 Cc1cccnc1OCC(F)F 30aeef2018f348245003e98293768bf1 [0,1,0,0,0,1|2,0,0]=4 1944 B12R1.125 Cc1cccnc1OCN(C)C 1e3923435c689e8b186179be6d06e7ac [0,1,0,0,0,1|1,0,0]=3 1945 B12R1.125 Cc1ccncc1NCC(C)C 0a5762a41cc112098a2ea13f68f3fa1b [0,1,0,0,0,1|2,0,0]=4 1946 B12R1.125 Cc1ccncc1OCC(C)C ac9c54ecd0093716288cc6cafb2156d2 [0,1,0,0,0,1|2,0,0]=4 1947 B12R1.125 Cc1ccnnc1CNC(C)C 053d53ff032d307f2f7189f453930b8b [0,1,0,0,0,1|1,0,0]=3 1948 B12R1.125 Cc1ccnnc1COC(C)C 4efceeefc5d2f3dc52e6096749d82f5a [0,1,0,0,0,1|1,0,0]=3 1949 B12R1.125 Cc1ccnnc1NCC(C)C d5d65ddd29197d95dc730724717c3777 [0,1,0,0,0,1|1,0,0]=3 1950 B12R1.125 Cc1ccnnc1NCC(C)O 94eef95e3cdfc01d10444dd7a9a11f6c [0,1,0,0,0,1|2,0,0]=4 1951 B12R1.125 Cc1ccnnc1NCN(C)C f04b66d95ccda9ae947d4353c2c4693c [0,1,0,0,0,1|2,0,0]=4 1952 B12R1.125 Cc1ccnnc1NC[C@@H](C)O 581d76d91d7628bccd66c456ef25661f [0,1,0,0,0,1|2,0,0]=4 1953 B12R1.125 Cc1ccnnc1NC[C@H](C)O b232633cd438aa76d2ba534ac0c96e8e [0,1,0,0,0,1|2,0,0]=4 1954 B12R1.125 Cc1ccnnc1OCC(C)C b543cf433e7ce1644f0a08f12e56aca3 [0,1,0,0,0,1|1,0,0]=3 1955 B12R1.125 Cc1ccnnc1OCN(C)C 03c41bc7bacfa4b9fcbb1cf5f73ec560 [0,1,0,0,0,1|2,0,0]=4 1956 B12R1.125 Cc1cnccc1CNC(C)C fd3c13616b7aae9904ff75b6dc257c3e [0,1,0,0,0,1|2,0,0]=4 1957 B12R1.125 Cc1cnccc1COC(C)C ff9355dbcebbc16b1ea6e10e3b3965f7 [0,1,0,0,0,1|2,0,0]=4 1958 B12R1.125 Cc1cnccc1NCC(C)C cd6d78737d148d2d51c403a22f81251b [0,1,0,0,0,1|2,0,0]=4 1959 B12R1.125 Cc1cnccc1OCC(C)C c3a7d65c45f030d0d75c0ef6588ca42d [0,1,0,0,0,1|2,0,0]=4 1960 B12R1.125 Cc1cncnc1NCC(C)C 8c633c174e0fb987ba591ac42314cf32 [0,1,0,0,0,1|1,0,0]=3 1961 B12R1.125 Cc1cncnc1NCC(C)O 4d765ec78b022f6e9b85ca348665ca3d [0,1,0,0,0,1|2,0,0]=4 1962 B12R1.125 Cc1cncnc1NC[C@H](C)O a3739be52799ee6701d7b6dfe65e473f [0,1,0,0,0,1|2,0,0]=4 1963 B12R1.125 Cc1cncnc1OCC(C)C 2452fd2fc9cf992805cc9fa07081b2f9 [0,1,0,0,0,1|1,0,0]=3 1964 B12R1.125 Cc1cncnc1OCN(C)C 9369a503d5f00f25b573778572f28374 [0,1,0,0,0,1|2,0,0]=4 1965 B12R1.125 Cc1ncccc1CNC(C)C 9e75f3824b522bcdb845f9a2f15ad81b [0,1,0,0,0,1|2,0,0]=4 1966 B12R1.125 Cc1ncccc1COC(C)C a9da00623a47634eafd7b8cce50e0671 [0,1,0,0,0,1|2,0,0]=4 1967 B12R1.125 Cc1ncccc1NCC(C)C c7474db981f6e5e3e75f25e8d6317671 [0,1,0,0,0,1|2,0,0]=4 1968 B12R1.125 Cc1ncccc1OCC(C)C c4d92e6663fbe07004fa45eda68d9c29 [0,1,0,0,0,1|2,0,0]=4 1969 B12R1.125 Cc1nccnc1COC(C)C 17ec3e09c1fd2bbc7c2646442d27bb8d [0,1,0,0,0,1|1,0,0]=3 1970 B12R1.125 Cc1nccnc1NCC(C)C 5e6727e773c0a20a267b34cfe228d269 [0,1,0,0,0,1|1,0,0]=3 1971 B12R1.125 Cc1nccnc1NCC(C)O c6fe08610e3144e5261435fd521f805d [0,1,0,0,0,1|2,0,0]=4 1972 B12R1.125 Cc1nccnc1NCN(C)C 337b17090b5a7b49959264b7c5c3dd7d [0,1,0,0,0,1|2,0,0]=4 1973 B12R1.125 Cc1nccnc1NC[C@@H](C)O 787d4bf46d569ab2aca96e5d43300a12 [0,1,0,0,0,1|2,0,0]=4 1974 B12R1.125 Cc1nccnc1NC[C@H](C)O ef24cce204f0dffa88e8432611e18df9 [0,1,0,0,0,1|2,0,0]=4 1975 B12R1.125 Cc1nccnc1OCC(C)C 3957a235338a92b4686d66572e359399 [0,1,0,0,0,1|1,0,0]=3 1976 B12R1.125 Cc1nccnc1OCN(C)C af001de6fcbb0a2739f4ec49cdf76c3c [0,1,0,0,0,1|2,0,0]=4 1977 B12R1.125 FC(F)CNc1ncccc1Br 23e0faac20d65e90842aff787f6c474e [0,1,0,0,0,1|2,0,0]=4 1978 B12R1.125 FC(F)CNc1ncccc1Cl f739f754da7842b5084ddc7f710b30c1 [0,1,0,0,0,1|2,0,0]=4 1979 B12R1.125 FC(F)CNc1ncccc1I e154d0e05b07d8fee8195a3c83b90079 [0,1,0,0,0,1|2,0,0]=4 1980 B12R1.125 FC(F)COc1ncccc1Br 314998444d84d2ea07eb2c4c8479fe58 [0,1,0,0,0,1|2,0,0]=4 1981 B12R1.125 FC(F)COc1ncccc1Cl e99d7596df891ae8dbb1ad3e461b4cbf [0,1,0,0,0,1|2,0,0]=4 1982 B12R1.125 Fc1cccnc1NCC(F)F 59dc65c5951b65dd1b2b4ffd5be243f2 [0,1,0,0,0,1|2,0,0]=4 1983 B12R1.125 Fc1cccnc1OCC(F)F 5b8cfc84def1a21d6ff863c8d237c85e [0,1,0,0,0,1|2,0,0]=4 1984 B12R1.226 C=C(C)CNc1cc(ccn1)Br 10669550ed51257d23340a70ad6e4e7f [0,1,0,0,0,1|0,0,2]=4 1985 B12R1.226 C=C(C)CNc1cc(ccn1)C 8d05cfb273b442f250a3ba69a1e07ce7 [0,1,0,0,0,1|0,0,2]=4 1986 B12R1.226 C=C(C)CNc1cc(ccn1)Cl 0d396b0b0cb1bbf74ef65dd6a7dc6188 [0,1,0,0,0,1|0,0,2]=4 1987 B12R1.226 C=C(C)CNc1cc(ccn1)F 4f69b47e527df7427fc17a2c511ae656 [0,1,0,0,0,1|0,0,2]=4 1988 B12R1.226 C=C(C)CNc1cc(ccn1)I 20a1fa6ce0790d90ade24f83783db4d3 [0,1,0,0,0,1|0,0,2]=4 1989 B12R1.226 C=C(C)CNc1cccc(n1)Br 6dcb1cb0e1db1000a29fcd2d1aaee4a3 [0,1,0,0,0,1|0,0,2]=4 1990 B12R1.226 C=C(C)CNc1cccc(n1)C 987de2df6f7e5a74c02accaed687a7a2 [0,1,0,0,0,1|0,0,2]=4 1991 B12R1.226 C=C(C)CNc1cccc(n1)Cl 63cde3ae90657903be8412bc40421cbc [0,1,0,0,0,1|0,0,2]=4 1992 B12R1.226 C=C(C)CNc1cccc(n1)F c0bbdf783df96d5f67315728161fe468 [0,1,0,0,0,1|0,0,2]=4 1993 B12R1.226 C=C(C)CNc1cccc(n1)I fd125d299224c5dd593b66b7780bc5a3 [0,1,0,0,0,1|0,0,2]=4 1994 B12R1.226 C=C(C)COc1cc(ccn1)Br 551c7ce6486891998025a5f423b85e9a [0,1,0,0,0,1|0,0,2]=4 1995 B12R1.226 C=C(C)COc1cc(ccn1)C 0a07185ab2f6612bdeef84a752c3fd1d [0,1,0,0,0,1|0,0,2]=4 1996 B12R1.226 C=C(C)COc1cc(ccn1)Cl 3a796c540e5ba377ea6b109d6b788d9c [0,1,0,0,0,1|0,0,2]=4 1997 B12R1.226 C=C(C)COc1cc(ccn1)F d82cf8c272d0a4f7bea4c3b4ad1205c0 [0,1,0,0,0,1|0,0,2]=4 1998 B12R1.226 C=C(C)COc1cccc(n1)Br 5eb9e8572c2ca7a9e58e0b0c1dadef3b [0,1,0,0,0,1|0,0,2]=4 1999 B12R1.226 C=C(C)COc1cccc(n1)C 52522b280db70b709b008b96be26ff75 [0,1,0,0,0,1|0,0,2]=4 2000 B12R1.226 C=C(C)COc1cccc(n1)F ca17527b3a392308694300eaf8fd4f92 [0,1,0,0,0,1|0,0,2]=4 2001 B12R1.226 CC(=O)CNc1cc(ccn1)C 3aafab600ba32790f0ee0be2b99f0860 [0,1,0,0,0,1|1,0,1]=4 2002 B12R1.226 CC(=O)CNc1cc(ccn1)F a17d6b45dbbcbf83cb475fd3643b7b18 [0,1,0,0,0,1|1,0,1]=4 2003 B12R1.226 CC(=O)CNc1cc(ccn1)O eb39aaaa18769243057b64a56cf36a1e [0,1,0,0,0,1|1,0,1]=4 2004 B12R1.226 CC(=O)CNc1cccc(n1)C a13e6b5db7aa5f180e3645c0af3807d0 [0,1,0,0,0,1|1,0,1]=4 2005 B12R1.226 CC(=O)NCc1cc(ccn1)Br 3c346d9dddff29000302a5d526317a77 [0,1,0,0,0,1|1,0,1]=4 2006 B12R1.226 CC(=O)NCc1cc(ccn1)C 429b26804f717563030425c491283281 [0,1,0,0,0,1|1,0,1]=4 2007 B12R1.226 CC(=O)NCc1cc(ccn1)Cl 7586965aa22ceb837f608b8f0594f814 [0,1,0,0,0,1|1,0,1]=4 2008 B12R1.226 CC(=O)NCc1cccc(n1)Br 0f60240374d98f44993e2c5ba8414971 [0,1,0,0,0,1|1,0,1]=4 2009 B12R1.226 CC(=O)NCc1cccc(n1)C ff894d8ae2ecfa1c00d2f0abc4131898 [0,1,0,0,0,1|1,0,1]=4 2010 B12R1.226 CC(=O)NCc1cccc(n1)Cl 420099df8a33fec62f353266fdcc63a0 [0,1,0,0,0,1|1,0,1]=4 2011 B12R1.226 CC(=O)NCc1cccc(n1)F cc4f35c3fc7c759cf2a59c9c9b1dd0b0 [0,1,0,0,0,1|1,0,1]=4 2012 B12R1.226 CC(C)CNc1cc(ccn1)Br 92e025e0f5a2b5ee3ca5c62e3c3e1dcc [0,1,0,0,0,1|0,0,0]=2 2013 B12R1.226 CC(C)CNc1cc(ccn1)Cl d2d6d3ca355190ba86f24e0a8858fa79 [0,1,0,0,0,1|0,0,0]=2 2014 B12R1.226 CC(C)CNc1cc(ccn1)F fefa2d67f700e4e010a470257d2f7319 [0,1,0,0,0,1|0,0,0]=2 2015 B12R1.226 CC(C)CNc1cc(ccn1)I 8615c250cd177f5b70fa7122f7be7ad9 [0,1,0,0,0,1|0,0,0]=2 2016 B12R1.226 CC(C)CNc1cc(cnn1)Br 7c62b0d3703020f71ba5d8b3884f1b65 [0,1,0,0,0,1|1,0,0]=3 2017 B12R1.226 CC(C)CNc1cc(cnn1)Cl c41eb2ed82c930c01a238ec154e3bc94 [0,1,0,0,0,1|1,0,0]=3 2018 B12R1.226 CC(C)CNc1cc(ncn1)Br 0bb2778d58a4025a7591eb7dfd8a8f74 [0,1,0,0,0,1|1,0,0]=3 2019 B12R1.226 CC(C)CNc1cc(ncn1)Cl 59a9c72a520a5f065a0113efa49949f2 [0,1,0,0,0,1|1,0,0]=3 2020 B12R1.226 CC(C)CNc1cc(ncn1)F 7d01770dbce70d07d8c7c759072e9eb0 [0,1,0,0,0,1|1,0,0]=3 2021 B12R1.226 CC(C)CNc1cc(ncn1)I 2ae35b4adba06d87e4c1651eb1f439fd [0,1,0,0,0,1|1,0,0]=3 2022 B12R1.226 CC(C)CNc1cc[nH]c(=O)n1 8cc77779bdc306d54cef7352bb8d0cd7 [0,1,0,0,0,1|1,0,0]=3 2023 B12R1.226 CC(C)CNc1cc[nH]c(=S)c1 6fa2bce60248fa1a55a78ba1b0e6f048 [0,1,0,0,0,1|2,0,0]=4 2024 B12R1.226 CC(C)CNc1cccc(c1)Br 47f96ede91384a2957a9f738bcf7cbb7 [0,1,0,0,0,1|1,0,0]=3 2025 B12R1.226 CC(C)CNc1cccc(c1)Cl b77efea477419bad137ef23a5b33cfdb [0,1,0,0,0,1|1,0,0]=3 2026 B12R1.226 CC(C)CNc1cccc(c1)F 4fe892f19d398f74f696f31fe8fec9d4 [0,1,0,0,0,1|1,0,0]=3 2027 B12R1.226 CC(C)CNc1cccc(c1)I a713b158e8d2e866fe5954e27f6736a8 [0,1,0,0,0,1|1,0,0]=3 2028 B12R1.226 CC(C)CNc1cccc(c1)S d8df0c59c2a95482a973f3e4b2ca8288 [0,1,0,0,0,1|1,0,0]=3 2029 B12R1.226 CC(C)CNc1cccc(n1)Br 7cbe956768fbcb50152ecf7d1bbee778 [0,1,0,0,0,1|0,0,0]=2 2030 B12R1.226 CC(C)CNc1cccc(n1)Cl 275fe9b94c6e556eab72865e8ebbfc62 [0,1,0,0,0,1|0,0,0]=2 2031 B12R1.226 CC(C)CNc1cccc(n1)F 642e3c48e9102d05aba90e53da3173d7 [0,1,0,0,0,1|0,0,0]=2 2032 B12R1.226 CC(C)CNc1cccc(n1)I fa3c8c557f38affcb6d5ab100906efef [0,1,0,0,0,1|0,0,0]=2 2033 B12R1.226 CC(C)CNc1ccnc(c1)Br b7f6e7319a4a3a503754e67c3ba677af [0,1,0,0,0,1|2,0,0]=4 2034 B12R1.226 CC(C)CNc1ccnc(c1)Cl 38b36b62c659df80d9a95e292196ebce [0,1,0,0,0,1|2,0,0]=4 2035 B12R1.226 CC(C)CNc1ccnc(c1)F 1bd28f05743f77b2f662056e62d42111 [0,1,0,0,0,1|2,0,0]=4 2036 B12R1.226 CC(C)CNc1ccnc(c1)I 56c42639de0d700bc834f828eafaa370 [0,1,0,0,0,1|2,0,0]=4 2037 B12R1.226 CC(C)CNc1ccnc(n1)Br 5e8674d1b240abbdac27f387a2e19946 [0,1,0,0,0,1|1,0,0]=3 2038 B12R1.226 CC(C)CNc1ccnc(n1)Cl ae24f00a99109cddb95e166b8efb9c3e [0,1,0,0,0,1|1,0,0]=3 2039 B12R1.226 CC(C)CNc1ccnc(n1)F 4cbdeb21ccae62e3f414829f18b2770b [0,1,0,0,0,1|1,0,0]=3 2040 B12R1.226 CC(C)CNc1ccnc(n1)S 9f9149cc8019d656559518dd449e4597 [0,1,0,0,0,1|1,0,0]=3 2041 B12R1.226 CC(C)CNc1cn[nH]c(=O)n1 98bb22c60940b133f2f99fad596d0807 [0,1,0,0,0,1|2,0,0]=4 2042 B12R1.226 CC(C)CNc1cncc(c1)Br e1d37862732b58ed0d46ad2b442fe3ba [0,1,0,0,0,1|2,0,0]=4 2043 B12R1.226 CC(C)CNc1cncc(c1)Cl a05988a39f568b9d29f394a1d8d672cd [0,1,0,0,0,1|2,0,0]=4 2044 B12R1.226 CC(C)CNc1cncc(c1)F de5f8ad0fa30543c8eba1d330606506b [0,1,0,0,0,1|2,0,0]=4 2045 B12R1.226 CC(C)CNc1cncc(c1)I 794da77beffd2e94bc5b6bbef9ad3be2 [0,1,0,0,0,1|2,0,0]=4 2046 B12R1.226 CC(C)CNc1cncc(n1)Br b439d0926326d065e6e829a2f20bca9a [0,1,0,0,0,1|1,0,0]=3 2047 B12R1.226 CC(C)CNc1cncc(n1)Cl 76a9fed4d7e9f700a8e1b926b4728d7b [0,1,0,0,0,1|1,0,0]=3 2048 B12R1.226 CC(C)CNc1cncc(n1)F 008f5dc7da91d67bc715a7c979acc322 [0,1,0,0,0,1|1,0,0]=3 2049 B12R1.226 CC(C)CNc1cnnc(n1)Cl 3869c6a235d9c185f051b24b745f5cf7 [0,1,0,0,0,1|2,0,0]=4 2050 B12R1.226 CC(C)CNc1nc[nH]c(=O)n1 cb932553292cfc1b6961ed43d82d1064 [0,1,0,0,0,1|2,0,0]=4 2051 B12R1.226 CC(C)CNc1nccc(=O)[nH]1 bb4e13286f1f221c7a3e76cab55b6cd5 [0,1,0,0,0,1|1,0,0]=3 2052 B12R1.226 CC(C)CNc1nccc(n1)Br 46e04286be118d7573d2d17ca29b804d [0,1,0,0,0,1|1,0,0]=3 2053 B12R1.226 CC(C)CNc1nccc(n1)Cl 443b15f8a59eb04be48fc0e25c6409ae [0,1,0,0,0,1|1,0,0]=3 2054 B12R1.226 CC(C)CNc1nccc(n1)F 6313cb47c608967c6ea882ca9c005356 [0,1,0,0,0,1|1,0,0]=3 2055 B12R1.226 CC(C)CNc1nccc(n1)I 89923e61a31d44c325d0548b40cd0ade [0,1,0,0,0,1|1,0,0]=3 2056 B12R1.226 CC(C)CNc1nccc(n1)S 8196c3447a40a4ce7f1b0f08036a4be2 [0,1,0,0,0,1|1,0,0]=3 2057 B12R1.226 CC(C)CNc1ncnc(n1)Cl d201c6470dd89e2e5c17777118ea39c7 [0,1,0,0,0,1|2,0,0]=4 2058 B12R1.226 CC(C)CNc1ncnc(n1)S 6b7e0216941e459865f4072bf7573263 [0,1,0,0,0,1|2,0,0]=4 2059 B12R1.226 CC(C)COc1cc(ccn1)Br f34d9e1ee8531a4e480a1dab2ae0a766 [0,1,0,0,0,1|0,0,0]=2 2060 B12R1.226 CC(C)COc1cc(ccn1)Cl 876f25ea2e7c43d383155eac009ff9ac [0,1,0,0,0,1|0,0,0]=2 2061 B12R1.226 CC(C)COc1cc(ccn1)F f833658a0f7dc9066d84a60638d4b26c [0,1,0,0,0,1|0,0,0]=2 2062 B12R1.226 CC(C)COc1cc(ncn1)Br ca460534683b55f639c2b36aac8d3dce [0,1,0,0,0,1|1,0,0]=3 2063 B12R1.226 CC(C)COc1cc(ncn1)Cl cf11465824832841aae8452a02a8aab7 [0,1,0,0,0,1|1,0,0]=3 2064 B12R1.226 CC(C)COc1ccc[n+](c1)[O-] 7bd89c5d1cf67818819101f40977c4c5 [0,1,0,0,0,1|2,0,0]=4 2065 B12R1.226 CC(C)COc1cccc(=O)[nH]1 ad01ea304d19906638e478d39a2e0124 [0,1,0,0,0,1|0,0,1]=3 2066 B12R1.226 CC(C)COc1cccc(c1)Br 78b9893bdd66fbb7fd676a9f9d9a6b5c [0,1,0,0,0,1|1,0,0]=3 2067 B12R1.226 CC(C)COc1cccc(c1)Cl 17fc81f1248afd3345d318121f9a6be5 [0,1,0,0,0,1|1,0,0]=3 2068 B12R1.226 CC(C)COc1cccc(c1)F 952f6b6f6d9d7e5903334a6085f9ca2b [0,1,0,0,0,1|1,0,0]=3 2069 B12R1.226 CC(C)COc1cccc(c1)I 825de32ad6ba816c4a9b0b15d9f5b09d [0,1,0,0,0,1|1,0,0]=3 2070 B12R1.226 CC(C)COc1cccc(c1)S 1e2cf6d2ce302e2dbeb13d96800a69ca [0,1,0,0,0,1|1,0,0]=3 2071 B12R1.226 CC(C)COc1cccc(n1)Br b034d8c99d6faa3c6865be3de5d1442b [0,1,0,0,0,1|0,0,0]=2 2072 B12R1.226 CC(C)COc1cccc(n1)F 62d939db865eee29d08bcd45e7a528d8 [0,1,0,0,0,1|0,0,0]=2 2073 B12R1.226 CC(C)COc1ccnc(c1)Br ee849173a5a5c4349d085cdc486c9b3d [0,1,0,0,0,1|2,0,0]=4 2074 B12R1.226 CC(C)COc1ccnc(c1)Cl 679d6a5727deb8c64975da6c5556c5ff [0,1,0,0,0,1|2,0,0]=4 2075 B12R1.226 CC(C)COc1ccnc(c1)F 4a5d6ec80c2f156124d7c2b22754a005 [0,1,0,0,0,1|2,0,0]=4 2076 B12R1.226 CC(C)COc1ccnc(n1)Cl 6e112e0819767f5ec863881c54eda168 [0,1,0,0,0,1|1,0,0]=3 2077 B12R1.226 CC(C)COc1cncc(c1)Br 4dedea8b7dbd937fa79e1f0cc22c2bb9 [0,1,0,0,0,1|2,0,0]=4 2078 B12R1.226 CC(C)COc1cncc(c1)Cl 59840de6f9ae77e1a87386e35ac7e867 [0,1,0,0,0,1|2,0,0]=4 2079 B12R1.226 CC(C)COc1cncc(c1)F 639ce80f70067fb9c55b302b07f69de6 [0,1,0,0,0,1|2,0,0]=4 2080 B12R1.226 CC(C)COc1cncc(c1)I f4bb8d8afe699062abc94a3155f1deaa [0,1,0,0,0,1|2,0,0]=4 2081 B12R1.226 CC(C)COc1cncc(n1)Br 5e492240ee1a09ca358095322a7f0c27 [0,1,0,0,0,1|1,0,0]=3 2082 B12R1.226 CC(C)COc1cncc(n1)Cl 38184b24b7b8d51c406bdb92fb50d31d [0,1,0,0,0,1|1,0,0]=3 2083 B12R1.226 CC(C)COc1nccc(n1)Cl e77af05ff586b107c98b98d6cebf60d2 [0,1,0,0,0,1|1,0,0]=3 2084 B12R1.226 CC(C)COc1nccc(n1)S 6cabe4f22ad811d582b97604cad2cbe8 [0,1,0,0,0,1|1,0,0]=3 2085 B12R1.226 CC(C)NCc1cc(ccn1)Br 8e80878aa33f629cad82435a04ceb908 [0,1,0,0,0,1|0,0,0]=2 2086 B12R1.226 CC(C)NCc1cc(ccn1)Cl 32e06332ef624538e73eda4739130df1 [0,1,0,0,0,1|0,0,0]=2 2087 B12R1.226 CC(C)NCc1cc[nH]c(=O)c1 a9d3b7042d066144e705a5aefd7af7a3 [0,1,0,0,0,1|2,0,0]=4 2088 B12R1.226 CC(C)NCc1cc[nH]c(=O)n1 6435f67c87745f9f27c7df14c21efc37 [0,1,0,0,0,1|1,0,0]=3 2089 B12R1.226 CC(C)NCc1ccc[n+](c1)[O-] 9ce22988e76f5dc081315f40c755b50e [0,1,0,0,0,1|2,0,0]=4 2090 B12R1.226 CC(C)NCc1cccc(c1)Br 1c3c944c566959e7eef7efc9a8c8251c [0,1,0,0,0,1|1,0,0]=3 2091 B12R1.226 CC(C)NCc1cccc(c1)Cl 9dbc94fad7d16f41b15b3aebc8ca545b [0,1,0,0,0,1|1,0,0]=3 2092 B12R1.226 CC(C)NCc1cccc(c1)F 3787b7b4f5a6fda7587bfa332950191c [0,1,0,0,0,1|1,0,0]=3 2093 B12R1.226 CC(C)NCc1cccc(c1)I d4cf7394a008619606fd5e038404d76e [0,1,0,0,0,1|1,0,0]=3 2094 B12R1.226 CC(C)NCc1cccc(n1)Br 92981f813a24d8d775368435b84eaa2a [0,1,0,0,0,1|0,0,0]=2 2095 B12R1.226 CC(C)NCc1cccc(n1)Cl aa1ee281695a9ad7738f13543541b870 [0,1,0,0,0,1|0,0,0]=2 2096 B12R1.226 CC(C)NCc1cccc(n1)F d5092e57e9a868be90528ab937b42467 [0,1,0,0,0,1|0,0,0]=2 2097 B12R1.226 CC(C)NCc1ccnc(c1)Br 4e955cd75cbd32217324fe06a5f62d16 [0,1,0,0,0,1|2,0,0]=4 2098 B12R1.226 CC(C)NCc1ccnc(c1)Cl c3a0e82e1c5d8e071306a6e2c2031c2a [0,1,0,0,0,1|2,0,0]=4 2099 B12R1.226 CC(C)NCc1ccnc(c1)F 855389c627a9d2d3a26eb81ea5120d6e [0,1,0,0,0,1|2,0,0]=4 2100 B12R1.226 CC(C)NCc1cncc(c1)Cl 1beac4c811c386bd882c5994a0320252 [0,1,0,0,0,1|2,0,0]=4 2101 B12R1.226 CC(C)NCc1cncc(c1)F e2080bbe71ccb9f6d9cbbca121cbe88f [0,1,0,0,0,1|2,0,0]=4 2102 B12R1.226 CC(C)NCc1cncc(n1)Cl beb266a97cc9b37847c137031bb8f85a [0,1,0,0,0,1|1,0,0]=3 2103 B12R1.226 CC(C)NCc1nccc(n1)Cl 0cb7ade68556f6132e4dd03c238727a2 [0,1,0,0,0,1|1,0,0]=3 2104 B12R1.226 CC(C)OCc1cc(ccn1)Br 9932eefd1b7919be677ec4d9584bc46e [0,1,0,0,0,1|0,0,0]=2 2105 B12R1.226 CC(C)OCc1cc(ccn1)Cl 6dc5ed2046731d52a661701cd5d846d3 [0,1,0,0,0,1|0,0,0]=2 2106 B12R1.226 CC(C)OCc1cc(ccn1)F f1226fa30365aecf5c0399c4c40863a8 [0,1,0,0,0,1|0,0,0]=2 2107 B12R1.226 CC(C)OCc1cc(ccn1)I e74abf2de8912acb35da5a89ba1deed6 [0,1,0,0,0,1|0,0,0]=2 2108 B12R1.226 CC(C)OCc1cc(ncn1)Cl c192916a6dba8095836caff57e60455b [0,1,0,0,0,1|1,0,0]=3 2109 B12R1.226 CC(C)OCc1cc[nH]c(=O)c1 85d906cbf41d5a15f8bc6c1395069ebe [0,1,0,0,0,1|2,0,0]=4 2110 B12R1.226 CC(C)OCc1ccc[n+](c1)[O-] d38acb4354d307073691091144cd615b [0,1,0,0,0,1|2,0,0]=4 2111 B12R1.226 CC(C)OCc1cccc(c1)Br 879562350b15275860c09e604131f21c [0,1,0,0,0,1|1,0,0]=3 2112 B12R1.226 CC(C)OCc1cccc(c1)Cl c3629f30972b60636a5bcff8690532c9 [0,1,0,0,0,1|1,0,0]=3 2113 B12R1.226 CC(C)OCc1cccc(c1)F 9a739aed0fdfe4226f0a5132088c54a0 [0,1,0,0,0,1|1,0,0]=3 2114 B12R1.226 CC(C)OCc1cccc(c1)I bf4c5f71e0f6d55a1580b32357b1183d [0,1,0,0,0,1|1,0,0]=3 2115 B12R1.226 CC(C)OCc1cccc(n1)Br 35fa467c36dfbeeeb465ccad65fa5030 [0,1,0,0,0,1|0,0,0]=2 2116 B12R1.226 CC(C)OCc1cccc(n1)Cl 9428a85a94900d1b57fec614b8d404d0 [0,1,0,0,0,1|0,0,0]=2 2117 B12R1.226 CC(C)OCc1cccc(n1)F 97b1015e3c5a2a7f62c00be27b547db2 [0,1,0,0,0,1|0,0,0]=2 2118 B12R1.226 CC(C)OCc1cccc(n1)I bb69f335dbd7852f08b40a535b49fbee [0,1,0,0,0,1|0,0,0]=2 2119 B12R1.226 CC(C)OCc1ccnc(=O)[nH]1 d7ab4a90a6f731f6577f520301c6d1b1 [0,1,0,0,0,1|1,0,1]=4 2120 B12R1.226 CC(C)OCc1ccnc(c1)Br a129fd8f23288caa4054dfc29ac5eb88 [0,1,0,0,0,1|2,0,0]=4 2121 B12R1.226 CC(C)OCc1ccnc(c1)Cl 1cde8935647c5b7477594cd8497eb539 [0,1,0,0,0,1|2,0,0]=4 2122 B12R1.226 CC(C)OCc1ccnc(c1)F 6b057a32826a40ca519dab472d51b7eb [0,1,0,0,0,1|2,0,0]=4 2123 B12R1.226 CC(C)OCc1ccnc(n1)Cl 4c598ff4c8e252bcf4cb319f6bb684cd [0,1,0,0,0,1|1,0,0]=3 2124 B12R1.226 CC(C)OCc1cncc(c1)Br ae9940374847da64ff378c9e72639058 [0,1,0,0,0,1|2,0,0]=4 2125 B12R1.226 CC(C)OCc1cncc(c1)Cl a8d8ad9bc31d1803aaf9b8722356b9ab [0,1,0,0,0,1|2,0,0]=4 2126 B12R1.226 CC(C)OCc1cncc(c1)F 9f506b2078438f04c43df9245dc018b1 [0,1,0,0,0,1|2,0,0]=4 2127 B12R1.226 CC(C)OCc1cncc(c1)I 4b26f759d15ef95a86ae863dc2ee2fb0 [0,1,0,0,0,1|2,0,0]=4 2128 B12R1.226 CC(C)OCc1cncc(n1)Cl 36cff3a82d9a9b0ddcd089b4c4011a1e [0,1,0,0,0,1|1,0,0]=3 2129 B12R1.226 CC(C)OCc1nccc(n1)Cl 646b143ecab9c5cf5384f3d3e1d7f44a [0,1,0,0,0,1|1,0,0]=3 2130 B12R1.226 CC(O)CNc1cc(ccn1)Br 4eb75113648cbcdd9f085f4cb97ba67f [0,1,0,0,0,1|1,0,0]=3 2131 B12R1.226 CC(O)CNc1cc(ccn1)Cl 2f5be7214cdb8b3e284b1eb1ed5ee7f5 [0,1,0,0,0,1|1,0,0]=3 2132 B12R1.226 CC(O)CNc1cc(ccn1)F 21f5483da5ae45e7d097182623f22a69 [0,1,0,0,0,1|1,0,0]=3 2133 B12R1.226 CC(O)CNc1cc(ccn1)I e88beb584feee4f1bf0fa29e79faf809 [0,1,0,0,0,1|1,0,0]=3 2134 B12R1.226 CC(O)CNc1cc(cnn1)Br 888f26521393825b95116a696d653f84 [0,1,0,0,0,1|2,0,0]=4 2135 B12R1.226 CC(O)CNc1cc(cnn1)Cl 0e9319fab4d929dbf651d2cdc938f329 [0,1,0,0,0,1|2,0,0]=4 2136 B12R1.226 CC(O)CNc1cc(ncn1)Br bdda0e368d176ad04e1d699866232a60 [0,1,0,0,0,1|2,0,0]=4 2137 B12R1.226 CC(O)CNc1cc(ncn1)Cl 1f6e54092fd3f693c15c07bcc3f1ffd1 [0,1,0,0,0,1|2,0,0]=4 2138 B12R1.226 CC(O)CNc1cc(ncn1)F a71c21948f87260a41be9843836398d5 [0,1,0,0,0,1|2,0,0]=4 2139 B12R1.226 CC(O)CNc1cc(ncn1)I 132cbc72684e796186114e477bf0620f [0,1,0,0,0,1|2,0,0]=4 2140 B12R1.226 CC(O)CNc1cc[nH]c(=O)n1 1440b7a33a2adb7cead598a97b48cbf4 [0,1,0,0,0,1|2,0,0]=4 2141 B12R1.226 CC(O)CNc1cccc(c1)Br 1313cc150d07e3249eb16f742927aba5 [0,1,0,0,0,1|2,0,0]=4 2142 B12R1.226 CC(O)CNc1cccc(c1)Cl b0b36293e53ebea3215e5b365b1c91a1 [0,1,0,0,0,1|2,0,0]=4 2143 B12R1.226 CC(O)CNc1cccc(c1)F 7b51f8f85220316ed6f71fbb6c6e04a1 [0,1,0,0,0,1|2,0,0]=4 2144 B12R1.226 CC(O)CNc1cccc(c1)I e3b39e215b46b137d14817575c01ba24 [0,1,0,0,0,1|2,0,0]=4 2145 B12R1.226 CC(O)CNc1cccc(c1)S 78e49f113d0630c078debe2e470f3646 [0,1,0,0,0,1|2,0,0]=4 2146 B12R1.226 CC(O)CNc1cccc(n1)Br 600a21101ec147af960b049dc357cb45 [0,1,0,0,0,1|1,0,0]=3 2147 B12R1.226 CC(O)CNc1cccc(n1)Cl 6249d33464a0922906315c0826fdb5fa [0,1,0,0,0,1|1,0,0]=3 2148 B12R1.226 CC(O)CNc1cccc(n1)F 1d15f0d9b31cdbefc2079c301be686b8 [0,1,0,0,0,1|1,0,0]=3 2149 B12R1.226 CC(O)CNc1cccc(n1)I 7cc58b0d323c56e7f4787fe1a4fc323f [0,1,0,0,0,1|1,0,0]=3 2150 B12R1.226 CC(O)CNc1ccnc(n1)Br b1d9d5fc2900cf81df8a87fc805a8b03 [0,1,0,0,0,1|2,0,0]=4 2151 B12R1.226 CC(O)CNc1ccnc(n1)Cl 62b3b2336dad305112f42d526bacff94 [0,1,0,0,0,1|2,0,0]=4 2152 B12R1.226 CC(O)CNc1ccnc(n1)F 9795421cded406df3b46cb00670bc275 [0,1,0,0,0,1|2,0,0]=4 2153 B12R1.226 CC(O)CNc1ccnc(n1)S 5b7205285a92d6c3d392f2f73e23d24e [0,1,0,0,0,1|2,0,0]=4 2154 B12R1.226 CC(O)CNc1cncc(n1)Br 33f1a478d8cc5ce347621abfd2874687 [0,1,0,0,0,1|2,0,0]=4 2155 B12R1.226 CC(O)CNc1cncc(n1)Cl 8cab8eccaa3e550304b77b1cb5af6a07 [0,1,0,0,0,1|2,0,0]=4 2156 B12R1.226 CC(O)CNc1cncc(n1)F 47d55a68f70eb49a4c542cd72f36a420 [0,1,0,0,0,1|2,0,0]=4 2157 B12R1.226 CC(O)CNc1nccc(=O)[nH]1 21513092a3ad5fcc74a8c4892edca595 [0,1,0,0,0,1|2,0,0]=4 2158 B12R1.226 CC(O)CNc1nccc(n1)Br 09a7b2c73576d28648408c3644c0ccce [0,1,0,0,0,1|2,0,0]=4 2159 B12R1.226 CC(O)CNc1nccc(n1)Cl c7ea86216e25467ed2bbbd41e6dafd32 [0,1,0,0,0,1|2,0,0]=4 2160 B12R1.226 CC(O)CNc1nccc(n1)F ff3fc83d0f40ad1207e13b30ce7f50bf [0,1,0,0,0,1|2,0,0]=4 2161 B12R1.226 CC(O)CNc1nccc(n1)I 3479f9c91cdd0978ac5b8031c7ea8532 [0,1,0,0,0,1|2,0,0]=4 2162 B12R1.226 CC(O)CNc1nccc(n1)S a84c318f5d3a04cf95532469a4a12771 [0,1,0,0,0,1|2,0,0]=4 2163 B12R1.226 CN(C)CNc1cc(ccn1)Br 5a8a5e39870fad0620cc8752b50d68c6 [0,1,0,0,0,1|1,0,0]=3 2164 B12R1.226 CN(C)CNc1cc(ccn1)Cl 83634623950ac7631d7d46c1f08d24c9 [0,1,0,0,0,1|1,0,0]=3 2165 B12R1.226 CN(C)CNc1cc(ccn1)F c05e659d4554bdad1dec07811342f30b [0,1,0,0,0,1|1,0,0]=3 2166 B12R1.226 CN(C)CNc1cc(ccn1)I cbfe3862577d6f8ea171a22d4db4d26b [0,1,0,0,0,1|1,0,0]=3 2167 B12R1.226 CN(C)CNc1cc(cnn1)Br 1b5a6e683e398ff991b82279d3d4cacd [0,1,0,0,0,1|2,0,0]=4 2168 B12R1.226 CN(C)CNc1cc(cnn1)Cl 32f199a647d7d5d97062eaf14e6cdff9 [0,1,0,0,0,1|2,0,0]=4 2169 B12R1.226 CN(C)CNc1cc(ncn1)Br 14d2ee8399cebe1c349702e7709b1ae0 [0,1,0,0,0,1|2,0,0]=4 2170 B12R1.226 CN(C)CNc1cc(ncn1)Cl 74bb941db4c26ff2b66b548bfc2b5267 [0,1,0,0,0,1|2,0,0]=4 2171 B12R1.226 CN(C)CNc1cc(ncn1)F ed53086cbd2df753c1384be1c5e2e3b8 [0,1,0,0,0,1|2,0,0]=4 2172 B12R1.226 CN(C)CNc1cc(ncn1)I b105f699563be987a60c09248c146e94 [0,1,0,0,0,1|2,0,0]=4 2173 B12R1.226 CN(C)CNc1cc[nH]c(=O)n1 a8ebd79362239b7787e051a9c9457601 [0,1,0,0,0,1|2,0,0]=4 2174 B12R1.226 CN(C)CNc1cccc(c1)Br a9db52ec4d18e43fd5f8052a16d9b2f5 [0,1,0,0,0,1|2,0,0]=4 2175 B12R1.226 CN(C)CNc1cccc(c1)Cl b91ebc3860602b7d435fbc25bba120c0 [0,1,0,0,0,1|2,0,0]=4 2176 B12R1.226 CN(C)CNc1cccc(c1)F fabc161cc8935ed63e4bf8f7340eeb1b [0,1,0,0,0,1|2,0,0]=4 2177 B12R1.226 CN(C)CNc1cccc(c1)I 73b573d1bee26bd55249f0d50a8760e1 [0,1,0,0,0,1|2,0,0]=4 2178 B12R1.226 CN(C)CNc1cccc(c1)S 8b408beb2995a69d831e59e74ceea8c7 [0,1,0,0,0,1|2,0,0]=4 2179 B12R1.226 CN(C)CNc1cccc(n1)Br ccfcdbf90112e6553b7656486011cc7f [0,1,0,0,0,1|1,0,0]=3 2180 B12R1.226 CN(C)CNc1cccc(n1)F 123337e28470f78e19a1f62ca8db98b2 [0,1,0,0,0,1|1,0,0]=3 2181 B12R1.226 CN(C)CNc1cccc(n1)I d5cda97c5d5a526481f1d3449c284b0f [0,1,0,0,0,1|1,0,0]=3 2182 B12R1.226 CN(C)CNc1ccnc(n1)Br 3b86bc580f03e9ada5d81b48602c951b [0,1,0,0,0,1|2,0,0]=4 2183 B12R1.226 CN(C)CNc1ccnc(n1)Cl 4f09eef5f254acd26c5f433b5ad97240 [0,1,0,0,0,1|2,0,0]=4 2184 B12R1.226 CN(C)CNc1ccnc(n1)F 79ef2bb3eda80711cb8b2b91e875465e [0,1,0,0,0,1|2,0,0]=4 2185 B12R1.226 CN(C)CNc1ccnc(n1)S 6a97e2b361ed88d442ccd993dcbeab22 [0,1,0,0,0,1|2,0,0]=4 2186 B12R1.226 CN(C)CNc1cncc(n1)F 7ccd42952384b12c904d65b6872faaef [0,1,0,0,0,1|2,0,0]=4 2187 B12R1.226 CN(C)CNc1nccc(=O)[nH]1 e0340e38a187434cad3e34d3d24a30ef [0,1,0,0,0,1|2,0,0]=4 2188 B12R1.226 CN(C)CNc1nccc(n1)Br 269784a09c5021f11aebf7f913dc8c50 [0,1,0,0,0,1|2,0,0]=4 2189 B12R1.226 CN(C)CNc1nccc(n1)Cl 8cd5e86a9f4b9350ee1c1ccd5647a95d [0,1,0,0,0,1|2,0,0]=4 2190 B12R1.226 CN(C)CNc1nccc(n1)F 8560aa98ab8c2faec82256c0587b2b05 [0,1,0,0,0,1|2,0,0]=4 2191 B12R1.226 CN(C)CNc1nccc(n1)I 0b5637cf2c9deed82bc381599cd1d056 [0,1,0,0,0,1|2,0,0]=4 2192 B12R1.226 CN(C)CNc1nccc(n1)S 3354541581da8e1096473e55d146ce3e [0,1,0,0,0,1|2,0,0]=4 2193 B12R1.226 CN(C)COc1cc(ccn1)Br f41fe288aa5216fb85a50012cd4606f5 [0,1,0,0,0,1|1,0,0]=3 2194 B12R1.226 CN(C)COc1cc(ccn1)Cl 2bb662ca1b310162e28c20cecd5952d1 [0,1,0,0,0,1|1,0,0]=3 2195 B12R1.226 CN(C)COc1cc(ccn1)F 19086ce6782dccdc750bbd2f8f29c091 [0,1,0,0,0,1|1,0,0]=3 2196 B12R1.226 CN(C)COc1cc(ncn1)Br db60d3e6278009d979fd67d7ce41877e [0,1,0,0,0,1|2,0,0]=4 2197 B12R1.226 CN(C)COc1cc(ncn1)Cl 526d42d1415591620b4ab138324c86fa [0,1,0,0,0,1|2,0,0]=4 2198 B12R1.226 CN(C)COc1cccc(=O)[nH]1 1d965ebc3a7ef4aa3d2fb0394631fe36 [0,1,0,0,0,1|1,0,1]=4 2199 B12R1.226 CN(C)COc1cccc(c1)Br 58f441b0ca3290c7f2d4537ec22a4d7a [0,1,0,0,0,1|2,0,0]=4 2200 B12R1.226 CN(C)COc1cccc(c1)Cl a81bc88b54f5005184b834642d9d3f86 [0,1,0,0,0,1|2,0,0]=4 2201 B12R1.226 CN(C)COc1cccc(c1)F 58b8398ab333a20e468588e9a1f2ba62 [0,1,0,0,0,1|2,0,0]=4 2202 B12R1.226 CN(C)COc1cccc(c1)I d82dc4d136e4cc08f2e0c8e654992b65 [0,1,0,0,0,1|2,0,0]=4 2203 B12R1.226 CN(C)COc1cccc(c1)S bcd4099b9a40b45e56f4b34dede1ec79 [0,1,0,0,0,1|2,0,0]=4 2204 B12R1.226 CN(C)COc1cccc(n1)Br 5baed04c759d449f38a720160a6f4794 [0,1,0,0,0,1|1,0,0]=3 2205 B12R1.226 CN(C)COc1cccc(n1)F 79db5af47e5849f0e1aa36b00549f4af [0,1,0,0,0,1|1,0,0]=3 2206 B12R1.226 CN(C)COc1ccnc(n1)Cl d25205af5847df8c289f6fb9ee29c8c5 [0,1,0,0,0,1|2,0,0]=4 2207 B12R1.226 CN(C)COc1cncc(n1)Br 036be35f0096b34973b0f51fdd832fe6 [0,1,0,0,0,1|2,0,0]=4 2208 B12R1.226 CN(C)COc1cncc(n1)Cl dae375659f60ec04eba5ca711815ddc0 [0,1,0,0,0,1|2,0,0]=4 2209 B12R1.226 CN(C)COc1nccc(n1)Cl 812d301a4114d4f8b73fbaa190e441f7 [0,1,0,0,0,1|2,0,0]=4 2210 B12R1.226 CN(C)COc1nccc(n1)S d05709516ebae369e5e7272dfe8130cc [0,1,0,0,0,1|2,0,0]=4 2211 B12R1.226 C[C@@H](O)CNc1cc(ccn1)Br fcf580093fbbd52f043e03905b045f63 [0,1,0,0,0,1|1,0,0]=3 2212 B12R1.226 C[C@@H](O)CNc1cc(ccn1)F 7c627a34d8002e71d16001b63a9cbf8d [0,1,0,0,0,1|1,0,0]=3 2213 B12R1.226 C[C@@H](O)CNc1cc(ccn1)I f7b4921822a28b03f652dcfb546b0d56 [0,1,0,0,0,1|1,0,0]=3 2214 B12R1.226 C[C@@H](O)CNc1cc(cnn1)Br a8d5808180712bb8015528e2f65aee73 [0,1,0,0,0,1|2,0,0]=4 2215 B12R1.226 C[C@@H](O)CNc1cc(ncn1)Br bc17912079b69edd1202f4f14c2a1717 [0,1,0,0,0,1|2,0,0]=4 2216 B12R1.226 C[C@@H](O)CNc1cc(ncn1)Cl a54b728ee300da3129634995f1c5fe2c [0,1,0,0,0,1|2,0,0]=4 2217 B12R1.226 C[C@@H](O)CNc1cc(ncn1)F 73bd91f8ac89fddc895b7004db4fa4a9 [0,1,0,0,0,1|2,0,0]=4 2218 B12R1.226 C[C@@H](O)CNc1cc(ncn1)I ba185986f11c97793978c7c43e80b49d [0,1,0,0,0,1|2,0,0]=4 2219 B12R1.226 C[C@@H](O)CNc1cc[nH]c(=O)n1 821d105066072cce4ee7fdf2c1871353 [0,1,0,0,0,1|2,0,0]=4 2220 B12R1.226 C[C@@H](O)CNc1cccc(c1)Br 7f47c7e325073bbe1ddb7b38bff8b932 [0,1,0,0,0,1|2,0,0]=4 2221 B12R1.226 C[C@@H](O)CNc1cccc(c1)Cl 8246dcd52dcd9ed0dbef7338a7f127b3 [0,1,0,0,0,1|2,0,0]=4 2222 B12R1.226 C[C@@H](O)CNc1cccc(c1)F e736be531156c2b7166ca634fb8a70ce [0,1,0,0,0,1|2,0,0]=4 2223 B12R1.226 C[C@@H](O)CNc1cccc(c1)I 4db71a0fd089913b0233a85b00396803 [0,1,0,0,0,1|2,0,0]=4 2224 B12R1.226 C[C@@H](O)CNc1ccnc(n1)Br f992e34b2db4b891f8a71daa9e779e95 [0,1,0,0,0,1|2,0,0]=4 2225 B12R1.226 C[C@@H](O)CNc1ccnc(n1)Cl e2bd0d7b12d0801b5c79f8aae2e96cf4 [0,1,0,0,0,1|2,0,0]=4 2226 B12R1.226 C[C@@H](O)CNc1ccnc(n1)F 78882f218232a3cae5707fbae5a0e309 [0,1,0,0,0,1|2,0,0]=4 2227 B12R1.226 C[C@@H](O)CNc1nccc(=O)[nH]1 92ca9c651120329a81ee0704e43579b3 [0,1,0,0,0,1|2,0,0]=4 2228 B12R1.226 C[C@@H](O)CNc1nccc(n1)Br 92aa515f21878022c87a18469eaae846 [0,1,0,0,0,1|2,0,0]=4 2229 B12R1.226 C[C@@H](O)CNc1nccc(n1)F 3d00121cb1ca9c24fcfad5d4ccc83214 [0,1,0,0,0,1|2,0,0]=4 2230 B12R1.226 C[C@H](O)CNc1cc(ccn1)Br d536e481fe4c90fc963dc23b065e9b43 [0,1,0,0,0,1|1,0,0]=3 2231 B12R1.226 C[C@H](O)CNc1cc(ccn1)Cl 0909db7c52624d39930d8f407ae9ee98 [0,1,0,0,0,1|1,0,0]=3 2232 B12R1.226 C[C@H](O)CNc1cc(ccn1)F a0ed839dbcb0777e4867b4fd0827e01f [0,1,0,0,0,1|1,0,0]=3 2233 B12R1.226 C[C@H](O)CNc1cc(ccn1)I bd8f803a572755a40ed5e2557333ed9a [0,1,0,0,0,1|1,0,0]=3 2234 B12R1.226 C[C@H](O)CNc1cc(cnn1)Br 848d96a1dfb974b900cecfc96ea87be5 [0,1,0,0,0,1|2,0,0]=4 2235 B12R1.226 C[C@H](O)CNc1cc(cnn1)Cl 30a5143cb5621ada39e53c34dc8d9d67 [0,1,0,0,0,1|2,0,0]=4 2236 B12R1.226 C[C@H](O)CNc1cc(ncn1)Br 1adea30bb73162080864d4b52b547ae3 [0,1,0,0,0,1|2,0,0]=4 2237 B12R1.226 C[C@H](O)CNc1cc(ncn1)Cl 042c20d1548b9ffc98fd9d45a39d9fc0 [0,1,0,0,0,1|2,0,0]=4 2238 B12R1.226 C[C@H](O)CNc1cc(ncn1)F 7f3155beda5eff4e11dcb2f794110dae [0,1,0,0,0,1|2,0,0]=4 2239 B12R1.226 C[C@H](O)CNc1cc(ncn1)I 2333c4a65335cc36b5d1ff83c346f9cd [0,1,0,0,0,1|2,0,0]=4 2240 B12R1.226 C[C@H](O)CNc1cc[nH]c(=O)n1 0d965656fe81280b8bfd158366282eca [0,1,0,0,0,1|2,0,0]=4 2241 B12R1.226 C[C@H](O)CNc1cccc(c1)Br a49c8030ae048c6affea28034df1531a [0,1,0,0,0,1|2,0,0]=4 2242 B12R1.226 C[C@H](O)CNc1cccc(c1)Cl 2370f8fa6414cdc9dd596258b1f50ab7 [0,1,0,0,0,1|2,0,0]=4 2243 B12R1.226 C[C@H](O)CNc1cccc(c1)F 81dcc6ac1cc4da1e70d103a206dd18af [0,1,0,0,0,1|2,0,0]=4 2244 B12R1.226 C[C@H](O)CNc1cccc(c1)I f90f80969bfd6ec1423e67f3dd3ecafa [0,1,0,0,0,1|2,0,0]=4 2245 B12R1.226 C[C@H](O)CNc1cccc(c1)S 0421b4bf0fcc630d12159982ed02f691 [0,1,0,0,0,1|2,0,0]=4 2246 B12R1.226 C[C@H](O)CNc1cccc(n1)Br ea4df55d31e5320ffa1278f605e2a2f2 [0,1,0,0,0,1|1,0,0]=3 2247 B12R1.226 C[C@H](O)CNc1cccc(n1)Cl 8745136b6a3f41e6e727975a1b08a5e1 [0,1,0,0,0,1|1,0,0]=3 2248 B12R1.226 C[C@H](O)CNc1cccc(n1)F 05bd3522c8043b7e1283f8782a1976cc [0,1,0,0,0,1|1,0,0]=3 2249 B12R1.226 C[C@H](O)CNc1cccc(n1)I 8127a06ebfe0b430aa70b036cb2f20ce [0,1,0,0,0,1|1,0,0]=3 2250 B12R1.226 C[C@H](O)CNc1ccnc(n1)Br b13960a4f0b8fed7e3f1c290867cc31f [0,1,0,0,0,1|2,0,0]=4 2251 B12R1.226 C[C@H](O)CNc1ccnc(n1)Cl 08dfde2f7837e0b7bf9d5f227434abb2 [0,1,0,0,0,1|2,0,0]=4 2252 B12R1.226 C[C@H](O)CNc1ccnc(n1)F 69f00fb57ef07292a545efe9c4cc85cd [0,1,0,0,0,1|2,0,0]=4 2253 B12R1.226 C[C@H](O)CNc1ccnc(n1)S 38b8c427af08b791cb1572f54ee4af57 [0,1,0,0,0,1|2,0,0]=4 2254 B12R1.226 C[C@H](O)CNc1cncc(n1)Br 451fc0834473310156486ed98936b921 [0,1,0,0,0,1|2,0,0]=4 2255 B12R1.226 C[C@H](O)CNc1cncc(n1)Cl a712814fae992b30c8e05cace850ffab [0,1,0,0,0,1|2,0,0]=4 2256 B12R1.226 C[C@H](O)CNc1cncc(n1)F 2ab95e41d5f8560d00da915943925824 [0,1,0,0,0,1|2,0,0]=4 2257 B12R1.226 C[C@H](O)CNc1nccc(=O)[nH]1 5c040f301524e94cfb6233167fb3b91b [0,1,0,0,0,1|2,0,0]=4 2258 B12R1.226 C[C@H](O)CNc1nccc(n1)Br 53b7ee4305c6d01f4028d6bf7b896534 [0,1,0,0,0,1|2,0,0]=4 2259 B12R1.226 C[C@H](O)CNc1nccc(n1)Cl 661f4280a0431d51fa35496500f5b90f [0,1,0,0,0,1|2,0,0]=4 2260 B12R1.226 C[C@H](O)CNc1nccc(n1)F 125243d0a9f91cca9ab1dd6bd57a37d1 [0,1,0,0,0,1|2,0,0]=4 2261 B12R1.226 C[C@H](O)CNc1nccc(n1)I 63529a2b8b06f65626b0f3d882987286 [0,1,0,0,0,1|2,0,0]=4 2262 B12R1.226 C[C@H](O)CNc1nccc(n1)S 6fc30bf959881c48a6509e58cd3f976d [0,1,0,0,0,1|2,0,0]=4 2263 B12R1.226 Cc1cc(ccn1)CNC(C)C 85e45bfc3c207c3638bd5e2c8259642e [0,1,0,0,0,1|2,0,0]=4 2264 B12R1.226 Cc1cc(ccn1)COC(C)C 01df0a32ec3b2c2a15bb77b36a0acd44 [0,1,0,0,0,1|2,0,0]=4 2265 B12R1.226 Cc1cc(ccn1)NCC(C)C 3fdba0792b03b1655ba47f333666e4eb [0,1,0,0,0,1|2,0,0]=4 2266 B12R1.226 Cc1cc(ccn1)OCC(C)C b5eb16a2ea6a09b6bd3df3b0ea4e9788 [0,1,0,0,0,1|2,0,0]=4 2267 B12R1.226 Cc1cc(ncn1)COC(C)C 0e1ac6110ba104bec41c27b140da7393 [0,1,0,0,0,1|1,0,0]=3 2268 B12R1.226 Cc1cc(ncn1)NCC(C)C ac2fb4f7996dd73ed93b6b7b700afc2e [0,1,0,0,0,1|1,0,0]=3 2269 B12R1.226 Cc1cc(ncn1)NCC(C)O 8497a29766b89fc57ce688cd42497101 [0,1,0,0,0,1|2,0,0]=4 2270 B12R1.226 Cc1cc(ncn1)NCN(C)C de27eb931e46dd79405616bf088d4256 [0,1,0,0,0,1|2,0,0]=4 2271 B12R1.226 Cc1cc(ncn1)NC[C@@H](C)O 74c8b943752a9b18e4c2081cdf8b7a9e [0,1,0,0,0,1|2,0,0]=4 2272 B12R1.226 Cc1cc(ncn1)NC[C@H](C)O af75c9ce220d219b574267b94fd90282 [0,1,0,0,0,1|2,0,0]=4 2273 B12R1.226 Cc1cc(ncn1)OCC(C)C edfe62a380aa9522f116c3a30e2aeaa4 [0,1,0,0,0,1|1,0,0]=3 2274 B12R1.226 Cc1cc(ncn1)OCN(C)C 97a660a8ac9a800b8c8be0ec762a5232 [0,1,0,0,0,1|2,0,0]=4 2275 B12R1.226 Cc1cccc(c1)CNC(C)C 409614b24510f7aec784aa24e2d29ef2 [0,1,0,0,0,1|1,0,0]=3 2276 B12R1.226 Cc1cccc(c1)COC(C)C ac14bed03bb08492372420f353b99c52 [0,1,0,0,0,1|1,0,0]=3 2277 B12R1.226 Cc1cccc(c1)NCC(C)C 4d0c9075dc953be03bb974637f4ee812 [0,1,0,0,0,1|1,0,0]=3 2278 B12R1.226 Cc1cccc(c1)NCC(C)O 6ec20ee81cd6564f027fad7c9046635a [0,1,0,0,0,1|2,0,0]=4 2279 B12R1.226 Cc1cccc(c1)NCN(C)C f60eeb0a22d178d4adde33f0517fefb6 [0,1,0,0,0,1|2,0,0]=4 2280 B12R1.226 Cc1cccc(c1)NC[C@@H](C)O b7ae52517241209d5ba2933489a9a337 [0,1,0,0,0,1|2,0,0]=4 2281 B12R1.226 Cc1cccc(c1)NC[C@H](C)O 1a909dc0c3197c842cec2d227814451e [0,1,0,0,0,1|2,0,0]=4 2282 B12R1.226 Cc1cccc(c1)OCC(C)C a573d64150ab49ed03c4bef1c7ab030b [0,1,0,0,0,1|1,0,0]=3 2283 B12R1.226 Cc1cccc(c1)OCN(C)C c8f371c842f7e29ba772757895b8b2d4 [0,1,0,0,0,1|2,0,0]=4 2284 B12R1.226 Cc1cccc(n1)CNC(C)C 193c586811e8cd7a5541b12d9c26503c [0,1,0,0,0,1|0,0,0]=2 2285 B12R1.226 Cc1cccc(n1)COC(C)C a8c2bc277290339bbc2222ef578b71a7 [0,1,0,0,0,1|0,0,0]=2 2286 B12R1.226 Cc1cccc(n1)NCC(C)C 690c1bd26f6de02ab0577df7d32212ca [0,1,0,0,0,1|0,0,0]=2 2287 B12R1.226 Cc1cccc(n1)NCC(C)O ab7a789a6298d797de7936cb64d58021 [0,1,0,0,0,1|1,0,0]=3 2288 B12R1.226 Cc1cccc(n1)NCC(F)F 99de833cae716288ec6b3ea8586bce09 [0,1,0,0,0,1|2,0,0]=4 2289 B12R1.226 Cc1cccc(n1)NCN(C)C e4bf788b9eab89fe91ce81b51872cf54 [0,1,0,0,0,1|1,0,0]=3 2290 B12R1.226 Cc1cccc(n1)NC[C@H](C)O 53ec20956490ee5f75534d2e8b2a9312 [0,1,0,0,0,1|1,0,0]=3 2291 B12R1.226 Cc1cccc(n1)OCC(C)C af20de35cd01146532ced994d2c6db13 [0,1,0,0,0,1|0,0,0]=2 2292 B12R1.226 Cc1cccc(n1)OCC(F)F 5036bb03bb10f2912279f2515930f925 [0,1,0,0,0,1|2,0,0]=4 2293 B12R1.226 Cc1cccc(n1)OCN(C)C 55d5b462ccd4306bd3910f031b38a33a [0,1,0,0,0,1|1,0,0]=3 2294 B12R1.226 Cc1ccnc(c1)CNC(C)C 99e05fe61e0126c3de92bf40ba9c20cd [0,1,0,0,0,1|0,0,0]=2 2295 B12R1.226 Cc1ccnc(c1)COC(C)C 9cf6c87bb1aeb8968300667a319e43b5 [0,1,0,0,0,1|0,0,0]=2 2296 B12R1.226 Cc1ccnc(c1)NCC(C)C 30516c36b70bbf57d4d6b22c37df495e [0,1,0,0,0,1|0,0,0]=2 2297 B12R1.226 Cc1ccnc(c1)NCC(C)O 8a949be7710933378e8e032c40724451 [0,1,0,0,0,1|1,0,0]=3 2298 B12R1.226 Cc1ccnc(c1)NCC(F)F ff8546a78db9a3b4673d38f230e5409a [0,1,0,0,0,1|2,0,0]=4 2299 B12R1.226 Cc1ccnc(c1)NCN(C)C 2335b0dd4f724d8b200f801c56f0ad84 [0,1,0,0,0,1|1,0,0]=3 2300 B12R1.226 Cc1ccnc(c1)NC[C@@H](C)O 6f8908c07b9e740bad3fded4ee895786 [0,1,0,0,0,1|1,0,0]=3 2301 B12R1.226 Cc1ccnc(c1)NC[C@H](C)O c15c721a5b484d333e68b6cb07a3c97f [0,1,0,0,0,1|1,0,0]=3 2302 B12R1.226 Cc1ccnc(c1)OCC(C)C 321f3a5a160bdb50bed95c845440f7c6 [0,1,0,0,0,1|0,0,0]=2 2303 B12R1.226 Cc1ccnc(c1)OCC(F)F a0b1c6328b4ffbcf35fd3961bc968fb2 [0,1,0,0,0,1|2,0,0]=4 2304 B12R1.226 Cc1ccnc(c1)OCN(C)C cd167f3e42f88a890021f326e430ac40 [0,1,0,0,0,1|1,0,0]=3 2305 B12R1.226 Cc1ccnc(n1)CNC(C)C 64f88864e96139270057b81a8b6f74ac [0,1,0,0,0,1|1,0,0]=3 2306 B12R1.226 Cc1ccnc(n1)COC(C)C 1178c6dd951d2761d5a3bfed7f26df5c [0,1,0,0,0,1|1,0,0]=3 2307 B12R1.226 Cc1ccnc(n1)NCC(C)C 4ab964591c51dfecc5714b68d3477e33 [0,1,0,0,0,1|1,0,0]=3 2308 B12R1.226 Cc1ccnc(n1)NCC(C)O 85784da4666b11af57c307a488db48c7 [0,1,0,0,0,1|2,0,0]=4 2309 B12R1.226 Cc1ccnc(n1)NCN(C)C afffa791db5e29fca574df9ae0987e86 [0,1,0,0,0,1|2,0,0]=4 2310 B12R1.226 Cc1ccnc(n1)NC[C@@H](C)O d4df92075580b9ba9c58a7ee39ddf9bc [0,1,0,0,0,1|2,0,0]=4 2311 B12R1.226 Cc1ccnc(n1)NC[C@H](C)O 8742172e1eed24b29a4627191dc9f56e [0,1,0,0,0,1|2,0,0]=4 2312 B12R1.226 Cc1cncc(c1)COC(C)C e26c34959a591f33a0f083cd95d6cc72 [0,1,0,0,0,1|2,0,0]=4 2313 B12R1.226 Cc1cncc(c1)NCC(C)C b2696ec0572661c2397dd77e1bb90c39 [0,1,0,0,0,1|2,0,0]=4 2314 B12R1.226 Cc1cncc(c1)OCC(C)C 6bdf0e37100da7cddffb0edcd615d3ff [0,1,0,0,0,1|2,0,0]=4 2315 B12R1.226 Cc1cncc(n1)NCC(C)C 4e1a065365e254649cad424ac884ed47 [0,1,0,0,0,1|1,0,0]=3 2316 B12R1.226 Cc1cncc(n1)NCC(C)O cd24f6840b8446c24787af5d1aaecade [0,1,0,0,0,1|2,0,0]=4 2317 B12R1.226 Cc1cncc(n1)NC[C@H](C)O 14132f2e8cd1418960960db1ab71ff3f [0,1,0,0,0,1|2,0,0]=4 2318 B12R1.226 Cc1cncc(n1)OCC(C)C 6832eb67fb1de99f6796800735dca3ad [0,1,0,0,0,1|1,0,0]=3 2319 B12R1.226 Cc1cnnc(c1)COC(C)C 6123149d868b56ef7c72eedc79084244 [0,1,0,0,0,1|1,0,0]=3 2320 B12R1.226 Cc1cnnc(c1)NCC(C)C d4688ab50b4fb5800b8d979acdf2cca8 [0,1,0,0,0,1|1,0,0]=3 2321 B12R1.226 Cc1cnnc(c1)NCC(C)O 11d1ab13f2d12113f91cacfb046c6082 [0,1,0,0,0,1|2,0,0]=4 2322 B12R1.226 Cc1cnnc(c1)NCN(C)C 6f2d9758b5da114e57fd0ac981c3e4c1 [0,1,0,0,0,1|2,0,0]=4 2323 B12R1.226 Cc1cnnc(c1)NC[C@H](C)O b9ad09a01d53c99345768ca1f4990b3b [0,1,0,0,0,1|2,0,0]=4 2324 B12R1.226 Cc1nccc(n1)CNC(C)C ef090e9a876132197fde236454b824ff [0,1,0,0,0,1|1,0,0]=3 2325 B12R1.226 Cc1nccc(n1)COC(C)C 80527ab6f145009b3768b6fde34711e0 [0,1,0,0,0,1|1,0,0]=3 2326 B12R1.226 Cc1nccc(n1)NCC(C)C 91b648ba84282e7348ba00849db9caac [0,1,0,0,0,1|1,0,0]=3 2327 B12R1.226 Cc1nccc(n1)NCC(C)O 38cc9c3ea32e79ec48dcbd18a9d39e6f [0,1,0,0,0,1|2,0,0]=4 2328 B12R1.226 Cc1nccc(n1)NCN(C)C 03c7b068973cc8c181b08966141bc55d [0,1,0,0,0,1|2,0,0]=4 2329 B12R1.226 Cc1nccc(n1)NC[C@@H](C)O fdd675f9e510be77d717c72ea72f0f53 [0,1,0,0,0,1|2,0,0]=4 2330 B12R1.226 Cc1nccc(n1)NC[C@H](C)O 4a15a8dd613e514a21e579bd5b6a4e73 [0,1,0,0,0,1|2,0,0]=4 2331 B12R1.226 Cc1nccc(n1)OCC(C)C 970c503bd29bf82013d90b294681f9c5 [0,1,0,0,0,1|1,0,0]=3 2332 B12R1.226 Cc1nccc(n1)OCN(C)C 231b4201949059370a6b1af4145dfb07 [0,1,0,0,0,1|2,0,0]=4 2333 B12R1.226 Cc1nncc(n1)NCC(C)C 05b35377c21cb815519a5aae497ac0eb [0,1,0,0,0,1|2,0,0]=4 2334 B12R1.226 FC(F)CNc1cc(ccn1)Br a2c156ebeb1c50db22eeae18b20295b6 [0,1,0,0,0,1|2,0,0]=4 2335 B12R1.226 FC(F)CNc1cc(ccn1)Cl 9728892b697eff78c6a7ac9cfd1fb62f [0,1,0,0,0,1|2,0,0]=4 2336 B12R1.226 FC(F)CNc1cc(ccn1)I 41412e2d474adf357361ab0f09ec1ebc [0,1,0,0,0,1|2,0,0]=4 2337 B12R1.226 FC(F)CNc1cccc(n1)Br e579600903154442112541cea361efe5 [0,1,0,0,0,1|2,0,0]=4 2338 B12R1.226 FC(F)CNc1cccc(n1)Cl 56276afc4cb175cc613daa43476d6686 [0,1,0,0,0,1|2,0,0]=4 2339 B12R1.226 FC(F)CNc1cccc(n1)I 93ef7697df82bdacf7672cfd0af0eef9 [0,1,0,0,0,1|2,0,0]=4 2340 B12R1.226 FC(F)COc1cc(ccn1)Br c377233b9dc116e3d6260922d6854992 [0,1,0,0,0,1|2,0,0]=4 2341 B12R1.226 FC(F)COc1cc(ccn1)Cl 6ad1608c54e95a4aa0465dc03923507d [0,1,0,0,0,1|2,0,0]=4 2342 B12R1.226 FC(F)COc1cccc(n1)Br f7b1ff15e564a87f84780986ccb493d3 [0,1,0,0,0,1|2,0,0]=4 2343 B12R1.226 Fc1cccc(n1)NCC(F)F 0732f5423ff4977b611b904bcf482916 [0,1,0,0,0,1|2,0,0]=4 2344 B12R1.226 Fc1cccc(n1)OCC(F)F ca2d2a1b0ccab334de1dbfb194d04fdd [0,1,0,0,0,1|2,0,0]=4 2345 B12R1.226 Fc1ccnc(c1)NCC(F)F 6fe206c8979fddf54faaf085c024e299 [0,1,0,0,0,1|2,0,0]=4 2346 B12R1.226 Fc1ccnc(c1)OCC(F)F 09e1f75284c731264849f4c7ddff5372 [0,1,0,0,0,1|2,0,0]=4 2347 B12R1.891 CC(C)(C)CNc1ccccc1 866f0c000f012585c56b315997251133 [0,1,0,0,0,1|1,0,0]=3 2348 B12R1.891 CC(C)(C)CNc1ccccn1 825c8dcede6c8cbf2339b0b7c7d45e1b [0,1,0,0,0,1|0,0,0]=2 2349 B12R1.891 CC(C)(C)CNc1cccnc1 908c5da89c2bdb3f315cf4e834504505 [0,1,0,0,0,1|2,0,0]=4 2350 B12R1.891 CC(C)(C)CNc1cccnn1 feb033c8c3e79e2ccffefb9616065223 [0,1,0,0,0,1|1,0,0]=3 2351 B12R1.891 CC(C)(C)CNc1ccncc1 c7826f86c82660c7ba287f44da463481 [0,1,0,0,0,1|2,0,0]=4 2352 B12R1.891 CC(C)(C)CNc1ccncn1 a3c5840c7e6e016f4072add1a2cc9458 [0,1,0,0,0,1|1,0,0]=3 2353 B12R1.891 CC(C)(C)CNc1cnccn1 d79b42fd5d409d232fed1ad9655760a1 [0,1,0,0,0,1|1,0,0]=3 2354 B12R1.891 CC(C)(C)CNc1cnncn1 ea925180f6e5fc0f9f59926573ca74ee [0,1,0,0,0,1|2,0,0]=4 2355 B12R1.891 CC(C)(C)CNc1ncccn1 9ab1873f96d145c6799e4d3cffb7c1c4 [0,1,0,0,0,1|1,0,0]=3 2356 B12R1.891 CC(C)(C)CNc1nccnn1 bcf0bf08a34b40ec99e1558273276113 [0,1,0,0,0,1|2,0,0]=4 2357 B12R1.891 CC(C)(C)CNc1ncncn1 fbe63d549d07ce3b5a31d9e1804d8206 [0,1,0,0,0,1|2,0,0]=4 2358 B12R1.891 CC(C)(C)COc1ccccn1 421375595ba5ea063d0532b9ff9e5f28 [0,1,0,0,0,1|0,0,0]=2 2359 B12R1.891 CC(C)(C)COc1cccnc1 2989d2b8310518a29f31f2404a03d6a4 [0,1,0,0,0,1|2,0,0]=4 2360 B12R1.891 CC(C)(C)COc1ccncc1 5e962ee509d4432d5bb927399ceaf559 [0,1,0,0,0,1|2,0,0]=4 2361 B12R1.891 CC(C)(C)COc1cnccn1 08c3e3ac224502668d660c16b5cf7815 [0,1,0,0,0,1|1,0,0]=3 2362 B12R1.891 CC(C)(C)COc1cncnn1 b8dab4fdc17f1152dbb3986d9028bd37 [0,1,0,0,0,1|2,0,0]=4 2363 B12R1.891 CC(C)(C)COc1ncccn1 e6fb4daed699347bfd7fd068a53dc2de [0,1,0,0,0,1|1,0,0]=3 2364 B12R1.891 CC(C)(C)NCc1ccccc1 7201c1c22c9fa04427965e3124c0e1d6 [0,1,0,0,0,1|1,0,0]=3 2365 B12R1.891 CC(C)(C)NCc1ccccn1 0f37804617340fc0b75b0242b29a7097 [0,1,0,0,0,1|0,0,0]=2 2366 B12R1.891 CC(C)(C)NCc1cccnc1 e3606661dec28ebc372974ee9287b956 [0,1,0,0,0,1|2,0,0]=4 2367 B12R1.891 CC(C)(C)NCc1cccnn1 4586f5f0dfa64f2a19896d23b637ba0f [0,1,0,0,0,1|1,0,0]=3 2368 B12R1.891 CC(C)(C)NCc1ccncn1 19f798a159e69b9ce6a212588f11ccf6 [0,1,0,0,0,1|1,0,0]=3 2369 B12R1.891 CC(C)(C)NCc1ncccn1 417baaa94da03106f00a4e2ebaf5a746 [0,1,0,0,0,1|1,0,0]=3 2370 B12R1.891 CC(C)(F)CNc1ccccc1 b0242d6e7e1a9c8e30a280dd6d0dab3d [0,1,0,0,0,1|1,0,0]=3 2371 B12R1.891 CC(C)(F)CNc1ccccn1 fe8adf03c8a78edde4b29e3da49427a0 [0,1,0,0,0,1|0,0,0]=2 2372 B12R1.891 CC(C)(F)CNc1cccnc1 84d6970d460bb9620346fcd71e6d6cff [0,1,0,0,0,1|2,0,0]=4 2373 B12R1.891 CC(C)(F)CNc1cccnn1 3e0a6384fbde010f2c142de5a2e1ad58 [0,1,0,0,0,1|1,0,0]=3 2374 B12R1.891 CC(C)(F)CNc1ccncc1 f43d2174ce529b3faed4f33e7967e657 [0,1,0,0,0,1|2,0,0]=4 2375 B12R1.891 CC(C)(F)CNc1ccncn1 3dd4e0b0d6ced01382ae8c64a2bb38af [0,1,0,0,0,1|1,0,0]=3 2376 B12R1.891 CC(C)(F)CNc1cnccn1 975f522ef2cbaf36230db0523b152f94 [0,1,0,0,0,1|1,0,0]=3 2377 B12R1.891 CC(C)(F)CNc1cnncn1 3cb168fb31427891fdc10c109f856522 [0,1,0,0,0,1|2,0,0]=4 2378 B12R1.891 CC(C)(F)CNc1ncccn1 9dfd5f945101a6622283e416b3433347 [0,1,0,0,0,1|1,0,0]=3 2379 B12R1.891 CC(C)(F)CNc1nccnn1 bc26d2f35464a6ac38a45058d91a97c3 [0,1,0,0,0,1|2,0,0]=4 2380 B12R1.891 CC(C)(F)CNc1ncncn1 809582a53aad2c7ed409962baacf73e6 [0,1,0,0,0,1|2,0,0]=4 2381 B12R1.891 CC(C)(F)COc1ccccn1 d504348a9adfc7199e45e6e9e59837a8 [0,1,0,0,0,1|0,0,0]=2 2382 B12R1.891 CC(C)(F)COc1cccnc1 850aad1ca43014e96566b0a1863b780e [0,1,0,0,0,1|2,0,0]=4 2383 B12R1.891 CC(C)(F)COc1ccncc1 7a538294d43fe85e5079e51e34b00043 [0,1,0,0,0,1|2,0,0]=4 2384 B12R1.891 CC(C)(F)COc1cnccn1 124380c90a563e6a2b783065ba164017 [0,1,0,0,0,1|1,0,0]=3 2385 B12R1.891 CC(C)(F)COc1cncnn1 7e4ebb1b48581973629b80c1b65be86a [0,1,0,0,0,1|2,0,0]=4 2386 B12R1.891 CC(C)(F)COc1ncccn1 e8f7d3b86336b92396aca436bbb6cfcb [0,1,0,0,0,1|1,0,0]=3 2387 B12R1.891 CC(C)(O)CNc1ccccc1 f100447f9f947bdcf8b3cb6f09283ae4 [0,1,0,0,0,1|1,0,0]=3 2388 B12R1.891 CC(C)(O)CNc1ccccn1 cf6912f661b3c01ae5b5537abe66db21 [0,1,0,0,0,1|0,0,0]=2 2389 B12R1.891 CC(C)(O)CNc1cccnc1 71ecef7e440c1fa3a1e1bd94fd82e500 [0,1,0,0,0,1|2,0,0]=4 2390 B12R1.891 CC(C)(O)CNc1cccnn1 7c8c2786f98a35d7b59489f754fe08a7 [0,1,0,0,0,1|1,0,0]=3 2391 B12R1.891 CC(C)(O)CNc1ccncc1 1bed3845b568ed539a76759be48529f6 [0,1,0,0,0,1|2,0,0]=4 2392 B12R1.891 CC(C)(O)CNc1ccncn1 5894abb58b5a59abec771d82d3ee119d [0,1,0,0,0,1|1,0,0]=3 2393 B12R1.891 CC(C)(O)CNc1cnccn1 5f6fad78c4f9acccca78e396e21f481c [0,1,0,0,0,1|1,0,0]=3 2394 B12R1.891 CC(C)(O)CNc1cnncn1 4c45f76348088c14ac37645cb8587a6d [0,1,0,0,0,1|2,0,0]=4 2395 B12R1.891 CC(C)(O)CNc1ncccn1 b06a01a58904da3df936ce403c75b256 [0,1,0,0,0,1|1,0,0]=3 2396 B12R1.891 CC(C)(O)CNc1nccnn1 42fec05b674fb73aea579fc3dc565cf0 [0,1,0,0,0,1|2,0,0]=4 2397 B12R1.891 CC(C)(O)CNc1ncncn1 7d6034ca05e9c415f13fbd99071fad5b [0,1,0,0,0,1|2,0,0]=4 2398 B12R1.891 CC(C)(O)COc1ccccn1 fa2c8c78bdb754150fd86ac274e44221 [0,1,0,0,0,1|0,0,0]=2 2399 B12R1.891 CC(C)(O)COc1cccnc1 a9de8f0e83ed901e6844ff45d51f92a8 [0,1,0,0,0,1|2,0,0]=4 2400 B12R1.891 CC(C)(O)COc1ccncc1 c2673769e1a688b3690e43a7ffdece7f [0,1,0,0,0,1|2,0,0]=4 2401 B12R1.891 CC(C)(O)COc1cnccn1 6a16fcde8baf31ebc1dc609c106714f0 [0,1,0,0,0,1|1,0,0]=3 2402 B12R1.891 CC(C)(O)COc1cncnn1 129d91eb8942e1f8c7c54539c7710995 [0,1,0,0,0,1|2,0,0]=4 2403 B12R1.891 CC(C)(O)COc1ncccn1 d572e850ed4470d4cae6412ce4bf2e1c [0,1,0,0,0,1|1,0,0]=3 2404 B12R1.891 CC(F)(F)CNc1ccccc1 082b0f20fce6d46920eb2d5531e00578 [0,1,0,0,0,1|2,0,0]=4 2405 B12R1.891 CC(F)(F)CNc1ccccn1 75b3d4f73b12b1b55e58e25c1ab8c77e [0,1,0,0,0,1|1,0,0]=3 2406 B12R1.891 CC(F)(F)CNc1cccnn1 656dad4b753ae36fc9d2879f61cae3cd [0,1,0,0,0,1|2,0,0]=4 2407 B12R1.891 CC(F)(F)CNc1ccncn1 7678cf699d98ab29aeb6454946a04ed5 [0,1,0,0,0,1|2,0,0]=4 2408 B12R1.891 CC(F)(F)CNc1cnccn1 00ed338d25ca4692018feaa9b332486f [0,1,0,0,0,1|2,0,0]=4 2409 B12R1.891 CC(F)(F)CNc1ncccn1 c5729c14a4fbc4584a93c5e356bd9ed1 [0,1,0,0,0,1|2,0,0]=4 2410 B12R1.891 CC(F)(F)COc1ccccn1 fae94620e4df48fe84d8e40fd8069ebf [0,1,0,0,0,1|1,0,0]=3 2411 B12R1.891 CC(F)(F)COc1cnccn1 ad138fa1cfd16f5e87e1363f79397397 [0,1,0,0,0,1|2,0,0]=4 2412 B12R1.891 CC(F)(F)COc1ncccn1 640aa56fcf7d1df01bd8494f8aa3071d [0,1,0,0,0,1|2,0,0]=4 2413 B12R1.891 CS(=O)(=O)CNc1ccccn1 6c2d6294b66b80dc4684c953b1637128 [0,1,0,0,0,1|2,0,0]=4 2414 B12R1.891 CS(=O)(=O)COc1ccccn1 602b383f74511420c65807f2974d1f5c [0,1,0,0,0,1|2,0,0]=4 2415 B12R1.891 FC(F)(F)CNc1ccccn1 612a970412a36abeaed09d61bc98b225 [0,1,0,0,0,1|2,0,0]=4 2416 B12R1.891 FC(F)(F)COc1ccccn1 5040c0bb61a9d51eacfd77cb8a8ded91 [0,1,0,0,0,1|2,0,0]=4 2417 B12R1.210 CC(C)Nc1cccccc1=O 2921b4ab837361cc235f2007222e8069 [0,1,0,0,0,1|2,0,0]=4 2418 B12R1.210 CC(C)Oc1cccccc1=O 497fe3f268ff186afcab35cafaea5e0a [0,1,0,0,0,1|2,0,0]=4 2419 B12R1.4 C#Cc1ccc(cc1)NC(C)C faa63853dbda923b2c126c30ff9bfa23 [0,2,0,0,0,0|2,0,0]=4 2420 B12R1.4 C#Cc1ccc(cc1)OC(C)C e3463961332c304b58817ff8d4b0b05b [0,2,0,0,0,0|2,0,0]=4 2421 B12R1.4 C#Cc1ccc(nc1)NC(C)C 96ffe2aa92a1c5973aaeebcdc64a3003 [0,2,0,0,0,0|1,0,0]=3 2422 B12R1.4 C#Cc1ccc(nc1)OC(C)C 4391ceba5f5289a90ee935ea4c3784b7 [0,2,0,0,0,0|1,0,0]=3 2423 B12R1.4 C#Cc1cnc(cn1)NC(C)C 8b2b5daea3cd56cd22f587d6ca5e26a0 [0,2,0,0,0,0|2,0,0]=4 2424 B12R1.4 C#Cc1cnc(nc1)NC(C)C 058703e94aeae17def1df23beff33722 [0,2,0,0,0,0|2,0,0]=4 2425 B12R1.4 C=Cc1ccc(cc1)NC(C)C 21a2df0a267e794d3f3240b8e563ad23 [0,2,0,0,0,0|2,0,0]=4 2426 B12R1.4 C=Cc1ccc(cc1)OC(C)C c83cc47632832c79bb2fdd3080632eb6 [0,2,0,0,0,0|2,0,0]=4 2427 B12R1.4 C=Cc1ccc(nc1)NC(C)C 7e77370acfc8cab93a846382ec375567 [0,2,0,0,0,0|1,0,0]=3 2428 B12R1.4 C=Cc1cnc(nc1)NC(C)C 3d4b05ec864691c7548e287605770495 [0,2,0,0,0,0|2,0,0]=4 2429 B12R1.4 CC(C)Nc1ccc(cc1)C#N 34a536a6643fc1e460a58fed59492391 [0,2,0,0,0,0|2,0,0]=4 2430 B12R1.4 CC(C)Nc1ccc(cc1)C=O 62ba5962698d35c68b71a115e0b568ab [0,2,0,0,0,0|2,0,0]=4 2431 B12R1.4 CC(C)Nc1ccc(cc1)CO 2893829c5855e3498ec30daf5a92b3f9 [0,2,0,0,0,0|2,0,0]=4 2432 B12R1.4 CC(C)Nc1ccc(cn1)C#N ae0198af1597561212db103cfb9e7f9f [0,2,0,0,0,0|1,0,0]=3 2433 B12R1.4 CC(C)Nc1ccc(cn1)C=O c905645683820d20a01ce77b17f9ce6b [0,2,0,0,0,0|1,0,0]=3 2434 B12R1.4 CC(C)Nc1ccc(cn1)CCl 7e3af2c29d05bc9555a7c4d5c90afe70 [0,2,0,0,0,0|1,0,0]=3 2435 B12R1.4 CC(C)Nc1ccc(cn1)CO abb33c51cfa1e5e26bd3cd712f07ef95 [0,2,0,0,0,0|1,0,0]=3 2436 B12R1.4 CC(C)Nc1ccc(nn1)C#N 7703d3adcc544ae2577f170c4262fbf2 [0,2,0,0,0,0|2,0,0]=4 2437 B12R1.4 CC(C)Nc1cnc(cn1)C#N 09756a482a67c0022a3567f9b095064a [0,2,0,0,0,0|2,0,0]=4 2438 B12R1.4 CC(C)Nc1cnc(cn1)C=O 2a326d38420b9bd6be4f89bdc6f8148e [0,2,0,0,0,0|2,0,0]=4 2439 B12R1.4 CC(C)Nc1cnc(cn1)CO fd995c51d350f87f1b4e05af4545004c [0,2,0,0,0,0|2,0,0]=4 2440 B12R1.4 CC(C)Nc1ncc(cn1)C#N faefeecb9200d862c514fd2bef0bd853 [0,2,0,0,0,0|2,0,0]=4 2441 B12R1.4 CC(C)Nc1ncc(cn1)C=O 96427161bd5df79d9b1866f53bfadf55 [0,2,0,0,0,0|2,0,0]=4 2442 B12R1.4 CC(C)Nc1ncc(cn1)CO efb290b66eed7f0ddffee7ee208641f5 [0,2,0,0,0,0|2,0,0]=4 2443 B12R1.4 CC(C)Oc1ccc(cc1)C#N 847015a9d4bd458f57d946e8956cc9c1 [0,2,0,0,0,0|2,0,0]=4 2444 B12R1.4 CC(C)Oc1ccc(cc1)C=O 2397d983c0762938a0582225e128d3b0 [0,2,0,0,0,0|2,0,0]=4 2445 B12R1.4 CC(C)Oc1ccc(cc1)N=O e461c6ac1751e2be8c322e20efd1c111 [0,2,0,0,0,0|2,0,0]=4 2446 B12R1.4 CC(C)Oc1ccc(cn1)C#N 7c9bfc07996e71613d168377ef1bb08c [0,2,0,0,0,0|1,0,0]=3 2447 B12R1.4 CC(C)Oc1ccc(cn1)C=O bd1ce5340c4711a9faef60a6c5e0d92e [0,2,0,0,0,0|1,0,0]=3 2448 B12R1.4 CC(C)Oc1ccc(nn1)C=O 74eb9c0dc7df37a018257696f9c22d2c [0,2,0,0,0,0|2,0,0]=4 2449 B12R1.4 CC(C)Oc1ncc(cn1)C#N c794f4019aa7c7b1231f2b5dcb12099f [0,2,0,0,0,0|2,0,0]=4 2450 B12R1.4 CC(C)Oc1ncc(cn1)C=O ae30e139a7bfab29719cf0691108ca98 [0,2,0,0,0,0|2,0,0]=4 2451 B12R1.4 CCc1ccc(cc1)NC(C)C 3ed99f3debb7261e07191e58d03b9e98 [0,2,0,0,0,0|2,0,0]=4 2452 B12R1.4 CCc1ccc(cc1)OC(C)C c47fe5ab2b90199662fd8ab843de2974 [0,2,0,0,0,0|2,0,0]=4 2453 B12R1.4 CCc1ccc(nc1)NC(C)C dd63af80aa1271de99e01e6619c2e3f7 [0,2,0,0,0,0|1,0,0]=3 2454 B12R1.4 CCc1ccc(nc1)OC(C)C 85b55bfa1c4b791a2b861f6df3adb4e6 [0,2,0,0,0,0|1,0,0]=3 2455 B12R1.4 CCc1ccc(nn1)NC(C)C 7fc27cc5bac5fe9a3e6d76c2ed8f2f6d [0,2,0,0,0,0|2,0,0]=4 2456 B12R1.4 CCc1cnc(cn1)NC(C)C 750596f2a0e7379325055f3929385f78 [0,2,0,0,0,0|2,0,0]=4 2457 B12R1.4 CCc1cnc(cn1)OC(C)C 20caacddf763bec918fd143942402fa7 [0,2,0,0,0,0|2,0,0]=4 2458 B12R1.4 COc1ccc(cc1)NC(C)C ad2f50ef0d3f01d7a0822fd855d76ce7 [0,2,0,0,0,0|2,0,0]=4 2459 B12R1.4 COc1ccc(cc1)OC(C)C 8ab9bf357f184746ac612b947f092324 [0,2,0,0,0,0|2,0,0]=4 2460 B12R1.4 COc1ccc(nc1)NC(C)C d8b283d3974bedaeccfeb1897f8e542c [0,2,0,0,0,0|1,0,0]=3 2461 B12R1.4 COc1ccc(nc1)OC(C)C c7cef5a8d6d24506e98d43f994220db1 [0,2,0,0,0,0|1,0,0]=3 2462 B12R1.4 COc1ccc(nn1)NC(C)C af381bd1c32e87b563d69c2476b744cb [0,2,0,0,0,0|2,0,0]=4 2463 B12R1.4 COc1cnc(cn1)NC(C)C 286d2081fda8d783edf2f49819ab1d2a [0,2,0,0,0,0|2,0,0]=4 2464 B12R1.4 COc1cnc(nc1)NC(C)C 6640d86911a47b9554cbe37130f1b698 [0,2,0,0,0,0|2,0,0]=4 2465 B12R1.4 CSc1ccc(cc1)NC(C)C 8046d202268d2a850a12d3ac6096b479 [0,2,0,0,0,0|2,0,0]=4 2466 B12R1.4 CSc1ccc(cc1)OC(C)C e0501229b5d29bc5e4bd3d8921e409c4 [0,2,0,0,0,0|2,0,0]=4 2467 B12R1.4 CSc1ccc(nc1)NC(C)C d27e4c74853a74d904af4b85d2431fa4 [0,2,0,0,0,0|1,0,0]=3 2468 B12R1.4 CSc1cnc(cn1)NC(C)C 004fff7f017e787e4d42e63e0002be92 [0,2,0,0,0,0|2,0,0]=4 2469 B12R1.19 CC(C)Nc1cc(=O)n(cn1)C 5e1a4c0ee1bcce49edcc539f181d8080 [0,2,0,0,0,0|2,0,0]=4 2470 B12R1.19 CC(C)Nc1cc(c(cn1)Br)Cl ce421fa305a34fe65b9ddade4a1ec86b [0,2,0,0,0,0|1,0,0]=3 2471 B12R1.19 CC(C)Nc1cc(c(cn1)Cl)Cl 1828726a2223a189858d12999be9ce9d [0,2,0,0,0,0|1,0,0]=3 2472 B12R1.19 CC(C)Nc1cc(c(cn1)Cl)I 94a8fcd0b0e344391e5de70fc0d14acb [0,2,0,0,0,0|1,0,0]=3 2473 B12R1.19 CC(C)Nc1cc(c(cn1)F)Br 3085784b04d2a3d371dcc1d7005c9b3f [0,2,0,0,0,0|1,0,0]=3 2474 B12R1.19 CC(C)Nc1cc(c(cn1)F)Cl baac673602f14e10e410930c52f360e6 [0,2,0,0,0,0|1,0,0]=3 2475 B12R1.19 CC(C)Nc1cc(c(cn1)F)F 2c413f9d37babbdbcbc5e5479dc4b168 [0,2,0,0,0,0|1,0,0]=3 2476 B12R1.19 CC(C)Nc1cc(c(cn1)F)I 03f9eb02f57d0d32e987904bd8c52bd1 [0,2,0,0,0,0|1,0,0]=3 2477 B12R1.19 CC(C)Nc1cc(c(cn1)I)Cl 8d463b416b2098c4a4e9f63b28169dec [0,2,0,0,0,0|1,0,0]=3 2478 B12R1.19 CC(C)Nc1cc(c(cn1)I)F 430670dff57749c0a4773fb219b9eb31 [0,2,0,0,0,0|1,0,0]=3 2479 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)Br b369ed5242326319de549041b448327c [0,2,0,0,0,0|2,0,0]=4 2480 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)Cl 22d4ee5821101ae8df64d2c85dd7a714 [0,2,0,0,0,0|2,0,0]=4 2481 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)F d77fb612ec04987b4a2d7a4d8bae5ccd [0,2,0,0,0,0|2,0,0]=4 2482 B12R1.19 CC(C)Nc1ccc(c(c1)Cl)I 77046461f5cf13e1ba1521b50cacaf97 [0,2,0,0,0,0|2,0,0]=4 2483 B12R1.19 CC(C)Nc1ccc(c(c1)F)F 5c5b02bedc482e4b3497b329f1f671fb [0,2,0,0,0,0|2,0,0]=4 2484 B12R1.19 CC(C)Nc1ccc(c(c1)I)Cl f96253bb05b12ab575df7a5ee9153550 [0,2,0,0,0,0|2,0,0]=4 2485 B12R1.19 CC(C)Nc1ccc(c(c1)I)F 611912689dfdfb6725c6a13ccb26d19a [0,2,0,0,0,0|2,0,0]=4 2486 B12R1.19 CC(C)Nc1ccc(c(n1)Br)Cl cb819bc3bc086297243d967baa387469 [0,2,0,0,0,0|1,0,0]=3 2487 B12R1.19 CC(C)Nc1ccc(c(n1)Br)I 03d50f57d2c3374b21ee710a36358853 [0,2,0,0,0,0|1,0,0]=3 2488 B12R1.19 CC(C)Nc1ccc(c(n1)Cl)Cl 8d1e28e254240adec0000885a0655634 [0,2,0,0,0,0|1,0,0]=3 2489 B12R1.19 CC(C)Nc1ccc(c(n1)F)I e54065db381875feee63cc895274c84a [0,2,0,0,0,0|1,0,0]=3 2490 B12R1.19 CC(C)Nc1ccc(c(n1)I)F 603180d7a5de8f7562f72d84f0b9f356 [0,2,0,0,0,0|1,0,0]=3 2491 B12R1.19 CC(C)Nc1ccn(c(=O)n1)C c88d8aa986068dea5a0958e06ab2e412 [0,2,0,0,0,0|2,0,0]=4 2492 B12R1.19 CC(C)Nc1cnc(c(n1)Br)Br cae667325664b9cb8ad166c9d6522749 [0,2,0,0,0,0|2,0,0]=4 2493 B12R1.19 CC(C)Nc1cnc(c(n1)Br)Cl bb44a92477674261548d190939520bcd [0,2,0,0,0,0|2,0,0]=4 2494 B12R1.19 CC(C)Nc1cnc(c(n1)Cl)Cl bfb8c656df0c6ceb6376ad7039ea5d65 [0,2,0,0,0,0|2,0,0]=4 2495 B12R1.19 CC(C)Nc1cnc(c(n1)Cl)I 11d5356054d645cff23b455e07370fb5 [0,2,0,0,0,0|2,0,0]=4 2496 B12R1.19 CC(C)Nc1ncc(c(=O)[nH]1)I dde9a70618baf81af58e78bc2bfe3562 [0,2,0,0,0,0|2,0,0]=4 2497 B12R1.19 CC(C)Nc1ncc(c(n1)I)Cl cb1ed06cfb4cf117fab045b86f4737a7 [0,2,0,0,0,0|2,0,0]=4 2498 B12R1.19 CC(C)Oc1cc(c(cn1)Br)Br de465d57fb7e3fa7d792e7f61034a840 [0,2,0,0,0,0|1,0,0]=3 2499 B12R1.19 CC(C)Oc1cc(c(cn1)Br)Cl 06785bae17c8e361b1bb5431ea751d71 [0,2,0,0,0,0|1,0,0]=3 2500 B12R1.19 CC(C)Oc1cc(c(cn1)Br)F 03448f1289e03417b736585c7b60d28b [0,2,0,0,0,0|1,0,0]=3 2501 B12R1.19 CC(C)Oc1cc(c(cn1)F)Br 09b7eafc59a2a562cada4498c2aa1001 [0,2,0,0,0,0|1,0,0]=3 2502 B12R1.19 CC(C)Oc1cc(c(cn1)F)I 3c599a97e1126f0a3a03e9e92f48fa79 [0,2,0,0,0,0|1,0,0]=3 2503 B12R1.19 CC(C)Oc1cc(c(cn1)I)Cl 5c8b05d968c6a5609c8a47d07c25fd8a [0,2,0,0,0,0|1,0,0]=3 2504 B12R1.19 CC(C)Oc1ccc(=O)n(n1)C 4ab681fa406637dd4668e3cf12a5df34 [0,2,0,0,0,0|2,0,0]=4 2505 B12R1.19 CC(C)Oc1ccc(c(c1)Br)F 12eb2f9753091ba98626f62906e34e37 [0,2,0,0,0,0|2,0,0]=4 2506 B12R1.19 CC(C)Oc1ccc(c(c1)Br)I aeae001b4f2b70e76888779d1cf0575d [0,2,0,0,0,0|2,0,0]=4 2507 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Br 41796fe73b9344a6304772b13f64377f [0,2,0,0,0,0|2,0,0]=4 2508 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)Cl 3ece42e9595a4a4ef84158ba453f7259 [0,2,0,0,0,0|2,0,0]=4 2509 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)F 2cdd96dcb84bb1e444173482c2bd231a [0,2,0,0,0,0|2,0,0]=4 2510 B12R1.19 CC(C)Oc1ccc(c(c1)Cl)I 363ed77c7fe91ebfc1bf1ff0db68fd49 [0,2,0,0,0,0|2,0,0]=4 2511 B12R1.19 CC(C)Oc1ccc(c(c1)F)Br c57e1d6b89e6f99f48625b01da44367c [0,2,0,0,0,0|2,0,0]=4 2512 B12R1.19 CC(C)Oc1ccc(c(c1)F)Cl d2b161123989ec1c2d9ff6fd03edc77e [0,2,0,0,0,0|2,0,0]=4 2513 B12R1.19 CC(C)Oc1ccc(c(c1)F)F 53b94052b09010f9ba67debc97cf50e5 [0,2,0,0,0,0|2,0,0]=4 2514 B12R1.19 CC(C)Oc1ccc(c(c1)F)I cad1e4d0d62c4b58333033a0e064f714 [0,2,0,0,0,0|2,0,0]=4 2515 B12R1.19 CC(C)Oc1ccc(c(c1)I)Cl cf373709cdc6a1f28422bf10509ded55 [0,2,0,0,0,0|2,0,0]=4 2516 B12R1.19 CC(C)Oc1ccc(c(c1)I)F a92da1970aa6d34f8a8cd19988bbabc6 [0,2,0,0,0,0|2,0,0]=4 2517 B12R1.19 CC(C)Oc1ccc(c(n1)Br)Cl f35268b0f6b42ce4b08932205547c0c7 [0,2,0,0,0,0|1,0,0]=3 2518 B12R1.19 CC(C)Oc1ccc(c(n1)Br)F c47ae4fe0273ddd049cccc2aaf8eb657 [0,2,0,0,0,0|1,0,0]=3 2519 B12R1.19 CC(C)Oc1ccc(c(n1)Cl)Cl d51f7ca323a90b8788858df9d02c1f78 [0,2,0,0,0,0|1,0,0]=3 2520 B12R1.19 CC(C)Oc1ccc(c(n1)F)Br b751fe41586bd75dabc15727e4986e9f [0,2,0,0,0,0|1,0,0]=3 2521 B12R1.19 CC(C)Oc1ccc(c(n1)F)I 4d447f6d6d633e53735ef506c22cffd7 [0,2,0,0,0,0|1,0,0]=3 2522 B12R1.19 CC(C)Oc1cnc(c(n1)Cl)Br c0ba58f1a628e19965291ac7ddd49f4c [0,2,0,0,0,0|2,0,0]=4 2523 B12R1.19 Cc1cc(ccc1Cl)NC(C)C 16e3a4f814a1abbf691b1a554461c211 [0,2,0,0,0,0|2,0,0]=4 2524 B12R1.19 Cc1cc(ccc1Cl)OC(C)C 3878fd89bcf660e16550571c18963284 [0,2,0,0,0,0|2,0,0]=4 2525 B12R1.19 Cc1cc(ccc1F)NC(C)C 499842be1c12b1135dfacd69895a2cca [0,2,0,0,0,0|2,0,0]=4 2526 B12R1.19 Cc1cc(ccc1F)OC(C)C 8ba02ff0b11eb0633f2e0f390e0abf0a [0,2,0,0,0,0|2,0,0]=4 2527 B12R1.19 Cc1cc(ccc1I)NC(C)C 62d71e4810c8d4fbbc6d3a26c7c79821 [0,2,0,0,0,0|2,0,0]=4 2528 B12R1.19 Cc1cc(ccc1I)OC(C)C 14f20e8650ff7b5db04ec1861653ab89 [0,2,0,0,0,0|2,0,0]=4 2529 B12R1.19 Cc1cc(ncc1Br)NC(C)C 0e4d94eb74e7df8fa6ea37873b8eca83 [0,2,0,0,0,0|1,0,0]=3 2530 B12R1.19 Cc1cc(ncc1Br)OC(C)C bbb033fa23115302458c847a75408c58 [0,2,0,0,0,0|1,0,0]=3 2531 B12R1.19 Cc1cc(ncc1Cl)OC(C)C 326a991e96d85c436fcf0b5d130ab5a4 [0,2,0,0,0,0|1,0,0]=3 2532 B12R1.19 Cc1cc(ncc1F)NC(C)C 985d37f96efb181a10f36e7c33ad7d88 [0,2,0,0,0,0|1,0,0]=3 2533 B12R1.19 Cc1cc(ncc1F)OC(C)C 6b51e6c5f80b68ebca53c4bd684fecdf [0,2,0,0,0,0|1,0,0]=3 2534 B12R1.19 Cc1cc(ncc1I)NC(C)C c86e983e51ff1b2b95f00003599c10fe [0,2,0,0,0,0|1,0,0]=3 2535 B12R1.19 Cc1cc(ncc1I)OC(C)C de9613f660fccff794c2a8bb8f3c4e04 [0,2,0,0,0,0|1,0,0]=3 2536 B12R1.19 Cc1cc(nnc1Cl)NC(C)C 68bd6b673dbbf6c128a7009794e8ea7f [0,2,0,0,0,0|2,0,0]=4 2537 B12R1.19 Cc1ccc(cc1Br)OC(C)C 48e2c36b3f8a3e1510a45e4801cd7635 [0,2,0,0,0,0|2,0,0]=4 2538 B12R1.19 Cc1ccc(cc1C)NC(C)C e4751a96d9568eaa5a2dcd25f8d61305 [0,2,0,0,0,0|2,0,0]=4 2539 B12R1.19 Cc1ccc(cc1C)OC(C)C f234b68a68ae452039f940a2d00ccb8a [0,2,0,0,0,0|2,0,0]=4 2540 B12R1.19 Cc1ccc(cc1Cl)NC(C)C fd633490d2ff2f9221f61ce9791df4d9 [0,2,0,0,0,0|2,0,0]=4 2541 B12R1.19 Cc1ccc(cc1Cl)OC(C)C fe675a90fb8bba04b727e29add6472ea [0,2,0,0,0,0|2,0,0]=4 2542 B12R1.19 Cc1ccc(cc1F)NC(C)C 33608cba90c31a0a726e2554d574bab3 [0,2,0,0,0,0|2,0,0]=4 2543 B12R1.19 Cc1ccc(cc1F)OC(C)C 8a4dc41dac23453bb24010bb9a1a9523 [0,2,0,0,0,0|2,0,0]=4 2544 B12R1.19 Cc1ccc(cc1I)NC(C)C 8890cefeca6b8dbb795bd737a74a1e6d [0,2,0,0,0,0|2,0,0]=4 2545 B12R1.19 Cc1ccc(cc1I)OC(C)C 3b8932395a5e9b211ec6d650a41e634f [0,2,0,0,0,0|2,0,0]=4 2546 B12R1.19 Cc1ccc(nc1Br)NC(C)C 691e8cf658286de695946951a003496f [0,2,0,0,0,0|1,0,0]=3 2547 B12R1.19 Cc1ccc(nc1Br)OC(C)C d9798124ec1daa9068c56eea6829e454 [0,2,0,0,0,0|1,0,0]=3 2548 B12R1.19 Cc1ccc(nc1C)NC(C)C 726a005dd1f81483cdac5f858fa44b24 [0,2,0,0,0,0|1,0,0]=3 2549 B12R1.19 Cc1ccc(nc1Cl)NC(C)C c595d0f8b771752c7f66b883a1087207 [0,2,0,0,0,0|1,0,0]=3 2550 B12R1.19 Cc1ccc(nc1F)NC(C)C 10d79ef16ed0cddc23b993f928a521be [0,2,0,0,0,0|1,0,0]=3 2551 B12R1.19 Cc1cnc(cc1Br)OC(C)C bc9d5ddec1f363a54107c1589c71b5cc [0,2,0,0,0,0|1,0,0]=3 2552 B12R1.19 Cc1cnc(cc1C)OC(C)C 59269433f2021aa87d4f6e666a429d4c [0,2,0,0,0,0|1,0,0]=3 2553 B12R1.19 Cc1cnc(cc1Cl)NC(C)C eb936efd2066cd656e60e4f67712e518 [0,2,0,0,0,0|1,0,0]=3 2554 B12R1.19 Cc1cnc(cc1F)NC(C)C 9f853ccec55611d6bb5c9b4898b7b511 [0,2,0,0,0,0|1,0,0]=3 2555 B12R1.19 Cc1cnc(cc1I)NC(C)C fbe51546043766ba4d5567124e0c2f77 [0,2,0,0,0,0|1,0,0]=3 2556 B12R1.19 Cc1cnc(cc1I)OC(C)C bb9846b0a1940fc3bab0b935f0fc4c2a [0,2,0,0,0,0|1,0,0]=3 2557 B12R1.19 Cc1cnc(nc1C)NC(C)C 94934d6de8c152279a5f91ce5a41d377 [0,2,0,0,0,0|2,0,0]=4 2558 B12R1.19 Cc1nc(ccc1Cl)NC(C)C 7267b3b3e044ff28548bf2960cb939f3 [0,2,0,0,0,0|1,0,0]=3 2559 B12R1.19 Cc1nc(ccc1Cl)OC(C)C c6de8144911fdcf5532b191dc9e431b4 [0,2,0,0,0,0|1,0,0]=3 2560 B12R1.19 Cc1nc(ccc1F)NC(C)C 4f03de673dbdc13eaa2244eadfb1f347 [0,2,0,0,0,0|1,0,0]=3 2561 B12R1.19 Cc1nc(ccc1I)NC(C)C d2969e958516fefbf00d3da9cf5eff7a [0,2,0,0,0,0|1,0,0]=3 2562 B12R1.19 Cc1nc(cnc1Br)NC(C)C a0dd7f3d9162e0be08f038850e2dc8c4 [0,2,0,0,0,0|2,0,0]=4 2563 B12R1.19 Cc1nc(cnc1Br)OC(C)C 9c64ffdbc6fbba803ba2711495249218 [0,2,0,0,0,0|2,0,0]=4 2564 B12R1.19 Cc1nc(cnc1Cl)NC(C)C fc8604b8f4c51d60a287b53865f2a4f2 [0,2,0,0,0,0|2,0,0]=4 2565 B12R1.19 Cc1nc(ncc1Cl)NC(C)C c76ed2b61bc3300bb52be3cb554f0a00 [0,2,0,0,0,0|2,0,0]=4 2566 B12R1.19 Cc1nc(ncc1F)NC(C)C 2f6bd166271c651aa96b9d95757c2af1 [0,2,0,0,0,0|2,0,0]=4 2567 B12R1.19 Cc1nc(ncc1I)NC(C)C c2afd5e5e70482ad16bcfed0d7efabc7 [0,2,0,0,0,0|2,0,0]=4 2568 B12R1.19 Cc1ncc(nc1Br)NC(C)C b3884f868ff0e785792625451f157e3d [0,2,0,0,0,0|2,0,0]=4 2569 B12R1.19 Cc1ncc(nc1C)NC(C)C 69d01ac449ecfb40d633fcedbfe9199d [0,2,0,0,0,0|2,0,0]=4 2570 B12R1.19 Cc1ncc(nc1C)OC(C)C 2e9e1be34f1f6c175cb38a35edc181e7 [0,2,0,0,0,0|2,0,0]=4 2571 B12R1.20 CC(C)N(C)c1ccc(cc1)S 724cc7d86a6eca1c3614ec86435eba77 [0,2,0,0,0,0|2,0,0]=4 2572 B12R1.20 CC(C)N(C)c1ccc(cn1)Br 8217c0bdab52b1cac81439a8d85662db [0,2,0,0,0,0|1,0,0]=3 2573 B12R1.20 CC(C)N(C)c1ccc(cn1)Cl 703dd26e97dd67d85c17fbd89526346b [0,2,0,0,0,0|1,0,0]=3 2574 B12R1.20 CC(C)N(C)c1ccc(cn1)F 7b59b013bca44bda84fd35a392fcf767 [0,2,0,0,0,0|1,0,0]=3 2575 B12R1.20 CC(C)N(C)c1ccc(cn1)I 8cfe9abdb69f7f13afbafcfc70fe726b [0,2,0,0,0,0|1,0,0]=3 2576 B12R1.20 CC(C)N(C)c1ncc(cn1)Br 84c438014856643d055621e6a46733e8 [0,2,0,0,0,0|2,0,0]=4 2577 B12R1.20 CC(C)N(C)c1ncc(cn1)Cl 9af0a305df48678df6439dc22adc7cfd [0,2,0,0,0,0|2,0,0]=4 2578 B12R1.20 CC(C)N(C)c1ncc(cn1)F 86ea208450f51cf8797eca10e2b24c7a [0,2,0,0,0,0|2,0,0]=4 2579 B12R1.20 Cc1ccc(nc1)N(C)C(C)C 630341309b6203e631ff389334bef17f [0,2,0,0,0,0|1,0,0]=3 2580 B12R1.20 Cc1cnc(nc1)N(C)C(C)C 6fe9a48a3cded4f24fb19ce0dbc2fa3c [0,2,0,0,0,0|2,0,0]=4 2581 B12R1.49 C#CC(C)Nc1ccc(cn1)C e5706d8e6d3d96adac13862700c497b1 [0,2,0,0,0,0|1,0,1]=4 2582 B12R1.49 C#CC(C)Nc1ccc(cn1)Cl 093456bff8f78b72dbc454c4761d0eda [0,2,0,0,0,0|1,0,1]=4 2583 B12R1.49 C#CC(C)Nc1ccc(cn1)I a6f5f96e80d4fb37fd75ba5484dab80c [0,2,0,0,0,0|1,0,1]=4 2584 B12R1.49 C=CC(C)Nc1ccc(cn1)Br a3d01240bc9885ee24f4d4fc7455ad09 [0,2,0,0,0,0|1,0,1]=4 2585 B12R1.49 C=CC(C)Nc1ccc(cn1)C 417b9adf2c8c2b34a7987fe4d0a1f7ac [0,2,0,0,0,0|1,0,1]=4 2586 B12R1.49 C=CC(C)Nc1ccc(cn1)Cl e8892f03548d2fcad0074a355ad60177 [0,2,0,0,0,0|1,0,1]=4 2587 B12R1.49 C=CC(C)Nc1ccc(cn1)F 09fc7d3c122134b6413b2cdf05600c99 [0,2,0,0,0,0|1,0,1]=4 2588 B12R1.49 C=CC(C)Nc1ccc(cn1)I 8336bc4814c0c41ec0eb4503463c8a47 [0,2,0,0,0,0|1,0,1]=4 2589 B12R1.49 C=CC(C)Nc1ccc(cn1)O 61e2aebb9a3b722ce84566081cf9edad [0,2,0,0,0,0|1,0,1]=4 2590 B12R1.49 C=CC(C)Nc1ccc(cn1)S 549386dd4aa4d32d4228a4f395c4aeb3 [0,2,0,0,0,0|1,0,1]=4 2591 B12R1.49 C=CC(C)Oc1ccc(cn1)C 805c92d04e4c6e74d00c75f5d59d237e [0,2,0,0,0,0|1,0,1]=4 2592 B12R1.49 C=CC(C)Oc1ccc(cn1)Cl 803966402dba76a4e43426efacda6295 [0,2,0,0,0,0|1,0,1]=4 2593 B12R1.49 C=CC(C)Oc1ccc(cn1)F 4687bf9dd6e743e8d9c470312c6df722 [0,2,0,0,0,0|1,0,1]=4 2594 B12R1.49 C=CC(C)Oc1ccc(cn1)I 1877cba9b2cf486fac3615c04a41cb78 [0,2,0,0,0,0|1,0,1]=4 2595 B12R1.49 CC(C#N)Oc1ccc(cn1)I 4e36af8b25639be2fc2daba89f600dcd [0,2,0,0,0,0|1,0,1]=4 2596 B12R1.49 CC(C=O)Nc1ccc(cn1)Br ac9c8af552e6651f439cce0da8c236b2 [0,2,0,0,0,0|1,0,1]=4 2597 B12R1.49 CC(C=O)Nc1ccc(cn1)Cl 326f01f30efadf4e8f0771e0a33034b9 [0,2,0,0,0,0|1,0,1]=4 2598 B12R1.49 CC(C=O)Nc1ccc(cn1)F 403c1594635a4ff33e5b5d0f0f03405b [0,2,0,0,0,0|1,0,1]=4 2599 B12R1.49 CC(C=O)Nc1ccc(cn1)I f9ae8727a6b2de1fc07b54a0d7dffaad [0,2,0,0,0,0|1,0,1]=4 2600 B12R1.49 CC(C=O)Oc1ccc(cn1)Cl 33dd34b6d303b129969e6fcf7f480ada [0,2,0,0,0,0|1,0,1]=4 2601 B12R1.49 CC(C=O)Oc1ccc(cn1)F 4473f53d4a8829165ba20ef50aa8bbe7 [0,2,0,0,0,0|1,0,1]=4 2602 B12R1.49 CC(C=O)Oc1ccc(cn1)I c4120974e8ec0c51e8e2bac63c0e62c3 [0,2,0,0,0,0|1,0,1]=4 2603 B12R1.49 CC(CO)Nc1ccc(cc1)Br 592ef5953e06db03ec99416b117263ef [0,2,0,0,0,0|2,0,0]=4 2604 B12R1.49 CC(CO)Nc1ccc(cc1)Cl 6e245977f2eddb60c0247b5c843b676d [0,2,0,0,0,0|2,0,0]=4 2605 B12R1.49 CC(CO)Nc1ccc(cc1)F 4b0578096f484cca12cad3c022131099 [0,2,0,0,0,0|2,0,0]=4 2606 B12R1.49 CC(CO)Nc1ccc(cc1)I 774ceb747df2f9a4ee3d7a744cbb4ea7 [0,2,0,0,0,0|2,0,0]=4 2607 B12R1.49 CC(CO)Nc1ccc(cc1)S 6476a5e0718364a34b1792ef13298738 [0,2,0,0,0,0|2,0,0]=4 2608 B12R1.49 CC(CO)Nc1ccc(cn1)Br 94606cb94945a2ef3e8ee090cfd9fb45 [0,2,0,0,0,0|1,0,0]=3 2609 B12R1.49 CC(CO)Nc1ccc(cn1)Cl 961bd8aa0a2ddf29f9396ecadb7fd2f5 [0,2,0,0,0,0|1,0,0]=3 2610 B12R1.49 CC(CO)Nc1ccc(cn1)F a1103ee0673aa700a41ed9a8336c78cf [0,2,0,0,0,0|1,0,0]=3 2611 B12R1.49 CC(CO)Nc1ccc(cn1)I a28e0745d894d147daa75862cd393987 [0,2,0,0,0,0|1,0,0]=3 2612 B12R1.49 CC(CO)Nc1ccc(nn1)Br 2f32c86d8b4558f8d840685bb4e42c85 [0,2,0,0,0,0|2,0,0]=4 2613 B12R1.49 CC(CO)Nc1ccc(nn1)Cl dd485c91931d54406c04387ffffc5260 [0,2,0,0,0,0|2,0,0]=4 2614 B12R1.49 CC(CO)Nc1ccc(nn1)F 9b3f3ed5e12234d30bb543cd9f580851 [0,2,0,0,0,0|2,0,0]=4 2615 B12R1.49 CC(CO)Nc1cnc(cn1)Cl f467f73d603a786732dd2488fda8df14 [0,2,0,0,0,0|2,0,0]=4 2616 B12R1.49 CC(CO)Nc1ncc(cn1)Br 9a51e19adefa121ca3160e8314fb82cb [0,2,0,0,0,0|2,0,0]=4 2617 B12R1.49 CC(CO)Nc1ncc(cn1)Cl 7b9724bb87ccc62282cc8f6348b98aa0 [0,2,0,0,0,0|2,0,0]=4 2618 B12R1.49 CC(CO)Nc1ncc(cn1)F f8dfdf6ed4b16158e34099b3f617d5ca [0,2,0,0,0,0|2,0,0]=4 2619 B12R1.49 CC(CO)Nc1ncc(cn1)I 7909e859a069ff36b925ea0ab1c52dec [0,2,0,0,0,0|2,0,0]=4 2620 B12R1.49 CCC(C)Nc1ccc(cc1)Br 4d1c483cf4afbfba9a2f8d3db94bec3f [0,2,0,0,0,0|2,0,0]=4 2621 B12R1.49 CCC(C)Nc1ccc(cc1)C 3b1fa0514d720f4b3db404292b778124 [0,2,0,0,0,0|2,0,0]=4 2622 B12R1.49 CCC(C)Nc1ccc(cc1)Cl 76d63efd5fc59378ea17379a47e7b19f [0,2,0,0,0,0|2,0,0]=4 2623 B12R1.49 CCC(C)Nc1ccc(cc1)F e00a92636e95efc27604581ea177b931 [0,2,0,0,0,0|2,0,0]=4 2624 B12R1.49 CCC(C)Nc1ccc(cc1)I 442f4ce893379ae3f70afc3980567446 [0,2,0,0,0,0|2,0,0]=4 2625 B12R1.49 CCC(C)Nc1ccc(cc1)S d4e426a89d91db8144c9fb2dff511b9d [0,2,0,0,0,0|2,0,0]=4 2626 B12R1.49 CCC(C)Nc1ccc(cn1)Br aaca4ce415a7931961931f78f98ab278 [0,2,0,0,0,0|1,0,0]=3 2627 B12R1.49 CCC(C)Nc1ccc(cn1)C 3974fbee8e41b47cf8e28862ad4333fe [0,2,0,0,0,0|1,0,0]=3 2628 B12R1.49 CCC(C)Nc1ccc(cn1)Cl 66ff8b89026469a8e38c6095deb6d916 [0,2,0,0,0,0|1,0,0]=3 2629 B12R1.49 CCC(C)Nc1ccc(cn1)F 1726cfb6c29c4023149de22239fc486c [0,2,0,0,0,0|1,0,0]=3 2630 B12R1.49 CCC(C)Nc1ccc(cn1)I 34f181f4c3129e8b65847ab4adfa052b [0,2,0,0,0,0|1,0,0]=3 2631 B12R1.49 CCC(C)Nc1ccc(nn1)Br d4849dab0565c56749255e59e2f9a5c2 [0,2,0,0,0,0|2,0,0]=4 2632 B12R1.49 CCC(C)Nc1ccc(nn1)C 68f9c5eb09de5962714edb1736327137 [0,2,0,0,0,0|2,0,0]=4 2633 B12R1.49 CCC(C)Nc1ccc(nn1)Cl 7a86200804c93450ea71ecff4d8fb9f7 [0,2,0,0,0,0|2,0,0]=4 2634 B12R1.49 CCC(C)Nc1ccc(nn1)F 7b2c147a436d5c14a7e4a3cac45c47e8 [0,2,0,0,0,0|2,0,0]=4 2635 B12R1.49 CCC(C)Nc1ccc(nn1)I 9353c1fcc60e5adffa339651f74ce429 [0,2,0,0,0,0|2,0,0]=4 2636 B12R1.49 CCC(C)Nc1cnc(cn1)Br 9b393e0f3faee9a00b417a269a86bca3 [0,2,0,0,0,0|2,0,0]=4 2637 B12R1.49 CCC(C)Nc1cnc(cn1)C 661f7def9a19dba6a7bdd5cc2ba39930 [0,2,0,0,0,0|2,0,0]=4 2638 B12R1.49 CCC(C)Nc1cnc(cn1)Cl 696eac7e7c757ae43c9aaaba9631eb85 [0,2,0,0,0,0|2,0,0]=4 2639 B12R1.49 CCC(C)Nc1ncc(cn1)Br d70bd80b585e83e3c03701d4f54e3d16 [0,2,0,0,0,0|2,0,0]=4 2640 B12R1.49 CCC(C)Nc1ncc(cn1)C c69d99f7179b0af5baed027f96eb6d37 [0,2,0,0,0,0|2,0,0]=4 2641 B12R1.49 CCC(C)Nc1ncc(cn1)Cl 096e739ac96b3ccc6d9f08144acb7ca0 [0,2,0,0,0,0|2,0,0]=4 2642 B12R1.49 CCC(C)Nc1ncc(cn1)F 38f0e2d37018674fa59e5a68a06ee925 [0,2,0,0,0,0|2,0,0]=4 2643 B12R1.49 CCC(C)Nc1ncc(cn1)I 9b6da02627710d03ec331bc9fd816fea [0,2,0,0,0,0|2,0,0]=4 2644 B12R1.49 CCC(C)Oc1ccc(cc1)Br e9ac760eb966c46626ad8cc78ce8ab95 [0,2,0,0,0,0|2,0,0]=4 2645 B12R1.49 CCC(C)Oc1ccc(cc1)C 7e96b7f640ec60a64eac66e0769be3a7 [0,2,0,0,0,0|2,0,0]=4 2646 B12R1.49 CCC(C)Oc1ccc(cc1)Cl e4591e0baef7f8d77d4837bf4d9fdb37 [0,2,0,0,0,0|2,0,0]=4 2647 B12R1.49 CCC(C)Oc1ccc(cc1)F c16cd2d17d48a9601c3d676d21db62eb [0,2,0,0,0,0|2,0,0]=4 2648 B12R1.49 CCC(C)Oc1ccc(cc1)I 1f03b3dddba16cff63099651f2c3fd3b [0,2,0,0,0,0|2,0,0]=4 2649 B12R1.49 CCC(C)Oc1ccc(cc1)S d9f5a2f73690dbd57408915a8a39b443 [0,2,0,0,0,0|2,0,0]=4 2650 B12R1.49 CCC(C)Oc1ccc(cn1)C 86885d95e1bb6039e358749c7fcfdfa1 [0,2,0,0,0,0|1,0,0]=3 2651 B12R1.49 CCC(C)Oc1ccc(cn1)Cl 595bbd3cd42cdab404b4be664ed271c9 [0,2,0,0,0,0|1,0,0]=3 2652 B12R1.49 CCC(C)Oc1ccc(cn1)F a952b0d45add5cc8619832f121e6479a [0,2,0,0,0,0|1,0,0]=3 2653 B12R1.49 CCC(C)Oc1ccc(cn1)I 59c9a3e88e3dcecd675196783f853b2e [0,2,0,0,0,0|1,0,0]=3 2654 B12R1.49 CCC(C)Oc1ccc(nn1)Br c7c75d6f10a3752a93dd5b447bfd8783 [0,2,0,0,0,0|2,0,0]=4 2655 B12R1.49 CCC(C)Oc1ccc(nn1)C 00329babc6e99a877eeedb9cb1e04e1a [0,2,0,0,0,0|2,0,0]=4 2656 B12R1.49 CCC(C)Oc1ccc(nn1)Cl 5cd4ec893f56cf8b5f893c91e3edbb5f [0,2,0,0,0,0|2,0,0]=4 2657 B12R1.49 CCC(C)Oc1cnc(cn1)Br 202a1b01c38ba0381ac4fdac1f07c0a2 [0,2,0,0,0,0|2,0,0]=4 2658 B12R1.49 CCC(C)Oc1cnc(cn1)C 6531528ec949b8c9ed6d2a8d83525ec6 [0,2,0,0,0,0|2,0,0]=4 2659 B12R1.49 CCC(C)Oc1cnc(cn1)Cl 55770d8e45cc91dcd011f50832d7233b [0,2,0,0,0,0|2,0,0]=4 2660 B12R1.49 CCC(C)Oc1cnc(cn1)I a48d2e908f80a65c88c1eccf293bc5a5 [0,2,0,0,0,0|2,0,0]=4 2661 B12R1.49 CCC(C)Oc1ncc(cn1)Br 4eaa58227de6b96284c6cebed7aac15f [0,2,0,0,0,0|2,0,0]=4 2662 B12R1.49 CCC(C)Oc1ncc(cn1)C 9ceec2e8ebdaa9273d9b93430062db93 [0,2,0,0,0,0|2,0,0]=4 2663 B12R1.49 CCC(C)Oc1ncc(cn1)F 2034239e8df8b360ca1c0d9d59c26a40 [0,2,0,0,0,0|2,0,0]=4 2664 B12R1.49 CCC(C)Oc1ncc(cn1)I 57a9e30bb3f80087dfdfbc3ef391cd7b [0,2,0,0,0,0|2,0,0]=4 2665 B12R1.49 CCN(C)Cc1ccc(cc1)Br 1cd45e4ca45fae9e98f9fb1c46e39cc6 [0,2,0,0,0,0|2,0,0]=4 2666 B12R1.49 CCN(C)Cc1ccc(cc1)C 055291017524f626e0726902d4240145 [0,2,0,0,0,0|2,0,0]=4 2667 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 44a860069a7f680293c76e814fd41a95 [0,2,0,0,0,0|2,0,0]=4 2668 B12R1.49 CCN(C)Cc1ccc(cc1)F 54dace8f30df290c27637058b77ffe21 [0,2,0,0,0,0|2,0,0]=4 2669 B12R1.49 CCN(C)Cc1ccc(cc1)I 5d72761060d288ad1c94906cd08bd152 [0,2,0,0,0,0|2,0,0]=4 2670 B12R1.49 CCN(C)Cc1ccc(cn1)Cl a7d769b605d10ba86078bfc5777feb75 [0,2,0,0,0,0|1,0,0]=3 2671 B12R1.49 CCN(C)Cc1ccc(cn1)F deaa7cb0dd62d5306df08ae188a7e264 [0,2,0,0,0,0|1,0,0]=3 2672 B12R1.49 CCN(C)Cc1ncc(cn1)Br 3eb4bf450f2a8ac389386806d787e6a5 [0,2,0,0,0,0|2,0,0]=4 2673 B12R1.49 CCN(C)Cc1ncc(cn1)Cl 0868367af6437d794da73b5f5fc9dbab [0,2,0,0,0,0|2,0,0]=4 2674 B12R1.49 CC[C@@H](C)Nc1ccc(cc1)S cbd8e9c1c5acf2775569733e10999d98 [0,2,0,0,0,0|2,0,0]=4 2675 B12R1.49 CC[C@H](C)Nc1ccc(cc1)S fffd6af76aaef88a5e0ba51aece02cfc [0,2,0,0,0,0|2,0,0]=4 2676 B12R1.49 CN(CF)Cc1ccc(cc1)Br 1c98aaf588285d3dd9f73536ec902634 [0,2,0,0,0,0|2,0,0]=4 2677 B12R1.49 CN(CF)Cc1ccc(cc1)Cl 1a19e37accbfa35c145aa7afd68f1e35 [0,2,0,0,0,0|2,0,0]=4 2678 B12R1.49 CN(CF)Cc1ccc(cc1)F cb4a8bfaf28fb4375125182c6f95b1a1 [0,2,0,0,0,0|2,0,0]=4 2679 B12R1.49 CN(CF)Cc1ccc(cc1)I a40135575e4a37cd9b5d74c27cd08e30 [0,2,0,0,0,0|2,0,0]=4 2680 B12R1.49 CN(CO)Cc1ccc(cc1)Br 5e55a925cd3dce7e6241436ae8c54919 [0,2,0,0,0,0|2,0,0]=4 2681 B12R1.49 CN(CO)Cc1ccc(cc1)Cl dab1af0d42fcee1a60d38378d8e8efce [0,2,0,0,0,0|2,0,0]=4 2682 B12R1.49 CN(CO)Cc1ccc(cc1)F 7fd3b80fbdb09310d5fe39719fff8ba6 [0,2,0,0,0,0|2,0,0]=4 2683 B12R1.49 CN(CO)Cc1ccc(cc1)I 586b1a870616a315f891e0fa55e04ab9 [0,2,0,0,0,0|2,0,0]=4 2684 B12R1.49 C[C@@H](CO)Nc1ccc(cc1)Br 81ff9fcc021a132282f1894c27228443 [0,2,0,0,0,0|2,0,0]=4 2685 B12R1.49 C[C@@H](CO)Nc1ccc(cc1)Cl 895f70fe0dbe38715df711db55f41f0c [0,2,0,0,0,0|2,0,0]=4 2686 B12R1.49 C[C@@H](CO)Nc1ccc(cc1)F 9b79cc3b0525c5fa5f4e86071dc6a6d4 [0,2,0,0,0,0|2,0,0]=4 2687 B12R1.49 C[C@@H](CO)Nc1ccc(cc1)I f030c452e948f44d3d2e91d60b707da3 [0,2,0,0,0,0|2,0,0]=4 2688 B12R1.49 C[C@@H](CO)Nc1ccc(cc1)S 43c8b001202cbd567805dbe271a67550 [0,2,0,0,0,0|2,0,0]=4 2689 B12R1.49 C[C@@H](CO)Nc1ccc(cn1)Cl e67bfa07435b47ff49285cb7e422b815 [0,2,0,0,0,0|1,0,0]=3 2690 B12R1.49 C[C@@H](CO)Nc1ccc(cn1)F b9faaf94908e1ba89b64f00f41c0cafd [0,2,0,0,0,0|1,0,0]=3 2691 B12R1.49 C[C@@H](CO)Nc1ccc(cn1)I 9e756c7f0a06e4bbfa5760c604f5a5bf [0,2,0,0,0,0|1,0,0]=3 2692 B12R1.49 C[C@@H](CO)Nc1ccc(nn1)Br fa0762a595ead73fcfc3698da0b42014 [0,2,0,0,0,0|2,0,0]=4 2693 B12R1.49 C[C@@H](CO)Nc1ccc(nn1)Cl 81f8057ee0b0622198a1194fb1dce053 [0,2,0,0,0,0|2,0,0]=4 2694 B12R1.49 C[C@@H](CO)Nc1ccc(nn1)F 07fd3e51189a2efd9a83388a34981213 [0,2,0,0,0,0|2,0,0]=4 2695 B12R1.49 C[C@@H](CO)Nc1cnc(cn1)Cl 74b42a1e34ded74d58daa8553d55afbb [0,2,0,0,0,0|2,0,0]=4 2696 B12R1.49 C[C@@H](CO)Nc1ncc(cn1)Br 80a08effe5c97d4b99224a0d7a24393d [0,2,0,0,0,0|2,0,0]=4 2697 B12R1.49 C[C@@H](CO)Nc1ncc(cn1)Cl 2cbfbb7218c12025144f70510f459fdb [0,2,0,0,0,0|2,0,0]=4 2698 B12R1.49 C[C@@H](CO)Nc1ncc(cn1)F 77c214c47568d8f3bbe0782051091fc7 [0,2,0,0,0,0|2,0,0]=4 2699 B12R1.49 C[C@@H](CO)Nc1ncc(cn1)I 856fec9eecf9ea32eefe3f2d9c11e95d [0,2,0,0,0,0|2,0,0]=4 2700 B12R1.49 C[C@H](C=O)Nc1ccc(cn1)Br 33f88d9b3dad9f01da3213680c80ca58 [0,2,0,0,0,0|1,0,1]=4 2701 B12R1.49 C[C@H](C=O)Nc1ccc(cn1)Cl 40b11c36621b42e90489df0135418b24 [0,2,0,0,0,0|1,0,1]=4 2702 B12R1.49 C[C@H](C=O)Nc1ccc(cn1)F 1d356f0b69cac89a26fbb7770543e15b [0,2,0,0,0,0|1,0,1]=4 2703 B12R1.49 C[C@H](C=O)Nc1ccc(cn1)I a9ae8a592aaad7636d6a445aeb7ee2dc [0,2,0,0,0,0|1,0,1]=4 2704 B12R1.49 C[C@H](C=O)Oc1ccc(cn1)Cl 4f2c921606b2ce3187ba95aa2ee87874 [0,2,0,0,0,0|1,0,1]=4 2705 B12R1.49 C[C@H](C=O)Oc1ccc(cn1)F 1d9e7c904d25e00f8a41b60dd85457d8 [0,2,0,0,0,0|1,0,1]=4 2706 B12R1.49 C[C@H](C=O)Oc1ccc(cn1)I c32cdd838bd44c0969cf56d6e43d87fa [0,2,0,0,0,0|1,0,1]=4 2707 B12R1.49 C[C@H](CO)Nc1ccc(cc1)Br af8120a15198da801643963289e3f0b4 [0,2,0,0,0,0|2,0,0]=4 2708 B12R1.49 C[C@H](CO)Nc1ccc(cc1)Cl 356f51342fc5e10d8fb2b3371a2ed97a [0,2,0,0,0,0|2,0,0]=4 2709 B12R1.49 C[C@H](CO)Nc1ccc(cc1)F 1f77c87bbae95423a93fe876d033eefc [0,2,0,0,0,0|2,0,0]=4 2710 B12R1.49 C[C@H](CO)Nc1ccc(cc1)I a3869a49772cee44011ad8dc480d5c9d [0,2,0,0,0,0|2,0,0]=4 2711 B12R1.49 C[C@H](CO)Nc1ccc(cc1)S 85732fce8faa73b572919e248911292a [0,2,0,0,0,0|2,0,0]=4 2712 B12R1.49 C[C@H](CO)Nc1ccc(cn1)Cl fa103daf569fee75f32b9a3bdc0e5351 [0,2,0,0,0,0|1,0,0]=3 2713 B12R1.49 C[C@H](CO)Nc1ccc(cn1)F fb7a7b0eb34e8e21554f2fa3ea8e01da [0,2,0,0,0,0|1,0,0]=3 2714 B12R1.49 C[C@H](CO)Nc1ccc(cn1)I 679ff13e01eb0f3278882532678b4245 [0,2,0,0,0,0|1,0,0]=3 2715 B12R1.49 C[C@H](CO)Nc1ccc(nn1)Br 8bfda4f44875319285117b535d38adf6 [0,2,0,0,0,0|2,0,0]=4 2716 B12R1.49 C[C@H](CO)Nc1ccc(nn1)Cl 856000918303584de02cf5ef679b86ce [0,2,0,0,0,0|2,0,0]=4 2717 B12R1.49 C[C@H](CO)Nc1ccc(nn1)F 96eb2d21ce3d18b3e91c5a938d62a50e [0,2,0,0,0,0|2,0,0]=4 2718 B12R1.49 C[C@H](CO)Nc1cnc(cn1)Cl a0c8d659ff688c329c23bbca243a57aa [0,2,0,0,0,0|2,0,0]=4 2719 B12R1.49 C[C@H](CO)Nc1ncc(cn1)Br 3147f97497ae266df5f679d92caf1db2 [0,2,0,0,0,0|2,0,0]=4 2720 B12R1.49 C[C@H](CO)Nc1ncc(cn1)Cl 0265a4827dc58f4857241552ef8c0400 [0,2,0,0,0,0|2,0,0]=4 2721 B12R1.49 C[C@H](CO)Nc1ncc(cn1)F 3183297a40408d84682f4ea3bf77e8e9 [0,2,0,0,0,0|2,0,0]=4 2722 B12R1.49 C[C@H](CO)Nc1ncc(cn1)I e615b361e032711233f192b7f34b20b0 [0,2,0,0,0,0|2,0,0]=4 2723 B12R1.49 Cc1ccc(cc1)CN(C)CF c0df0a0174bffac791963bd2047037d3 [0,2,0,0,0,0|2,0,0]=4 2724 B12R1.49 Cc1ccc(cc1)CN(C)CO ed474c07bd59a560c88e17955d9c9bb2 [0,2,0,0,0,0|2,0,0]=4 2725 B12R1.49 Cc1ccc(cc1)NC(C)CO 3a65f703743c7582d59d27c4b911a046 [0,2,0,0,0,0|2,0,0]=4 2726 B12R1.49 Cc1ccc(cc1)N[C@@H](C)CO 2d26d3567e3cf630da5665d889609cd2 [0,2,0,0,0,0|2,0,0]=4 2727 B12R1.49 Cc1ccc(cc1)N[C@H](C)CO ef5026ef31ef684c9c9940edc6a6ea55 [0,2,0,0,0,0|2,0,0]=4 2728 B12R1.49 Cc1ccc(nc1)CN(C)C=O a50468879e0fda2147f8b8adf9d863c7 [0,2,0,0,0,0|1,0,1]=4 2729 B12R1.49 Cc1ccc(nc1)CN(C)CF 52e720916e297a8c0519f7504100aba3 [0,2,0,0,0,0|1,0,0]=3 2730 B12R1.49 Cc1ccc(nc1)CN(C)CO cf8e946fd101dabd0147cba3aa0c257a [0,2,0,0,0,0|1,0,0]=3 2731 B12R1.49 Cc1ccc(nc1)NC(C)C=O 8ee8731692aebcbdfe9b8f8bc430bc7a [0,2,0,0,0,0|1,0,1]=4 2732 B12R1.49 Cc1ccc(nc1)NC(C)CO 8be71426a89f9b3fc19771a9bea3710c [0,2,0,0,0,0|1,0,0]=3 2733 B12R1.49 Cc1ccc(nc1)N[C@@H](C)CO 1200aaaac454694027214749085732b8 [0,2,0,0,0,0|1,0,0]=3 2734 B12R1.49 Cc1ccc(nc1)N[C@H](C)C=O fd8f7fc13cdfa6ed955ad9dfccaa691b [0,2,0,0,0,0|1,0,1]=4 2735 B12R1.49 Cc1ccc(nc1)N[C@H](C)CO d86670f1ba12ed4085cdf6903f8b6525 [0,2,0,0,0,0|1,0,0]=3 2736 B12R1.49 Cc1ccc(nc1)OC(C)C=O c45ef749cd7dffe2249f211fc96cbb68 [0,2,0,0,0,0|1,0,1]=4 2737 B12R1.49 Cc1ccc(nc1)O[C@H](C)C=O bcfd8a8ac60d4a7720853da3ead56605 [0,2,0,0,0,0|1,0,1]=4 2738 B12R1.49 Cc1ccc(nn1)NC(C)CO 2030a6ce10a03a28a75c2b4362a33461 [0,2,0,0,0,0|2,0,0]=4 2739 B12R1.49 Cc1ccc(nn1)N[C@@H](C)CO ec349fa438a3b4e9fffb89d182813ea4 [0,2,0,0,0,0|2,0,0]=4 2740 B12R1.49 Cc1ccc(nn1)N[C@H](C)CO 81ced8c4dbbacacdc3a1832fa80ad5b1 [0,2,0,0,0,0|2,0,0]=4 2741 B12R1.49 Cc1cnc(cn1)NC(C)CO 6572a77442fdb83bc4f066d34208a9e3 [0,2,0,0,0,0|2,0,0]=4 2742 B12R1.49 Cc1cnc(nc1)NC(C)CO 8c4a1a7c265de51d09408430189cb9b5 [0,2,0,0,0,0|2,0,0]=4 2743 B12R1.49 Cc1cnc(nc1)N[C@@H](C)CO f77f787368cce41ec0b13ef867b30b2e [0,2,0,0,0,0|2,0,0]=4 2744 B12R1.49 Cc1cnc(nc1)N[C@H](C)CO 0ec26173f22e5737e0326da17b292ae7 [0,2,0,0,0,0|2,0,0]=4 2745 B12R1.106 CC(C)(C)Nc1ccc(cc1)S 2ec5ab3e6affd22e7ed5789e1b8162ec [0,2,0,0,0,0|2,0,0]=4 2746 B12R1.233 CC(C)Nc1ccc(cc1Cl)Br ff919c0ad3056af10ba9c99b4ea82055 [0,2,0,0,0,0|2,0,0]=4 2747 B12R1.233 CC(C)Nc1ccc(cc1Cl)Cl d1517c0fce56f81cf78148b7de51776d [0,2,0,0,0,0|2,0,0]=4 2748 B12R1.233 CC(C)Nc1ccc(cc1Cl)F d8ef3677f35c72a8f6f5dca9199fc2c3 [0,2,0,0,0,0|2,0,0]=4 2749 B12R1.233 CC(C)Nc1ccc(cc1Cl)I 4361f4661b5f0cba4785f8e2ca782c19 [0,2,0,0,0,0|2,0,0]=4 2750 B12R1.233 CC(C)Nc1ccc(cc1F)Cl 82efef7ff26d46a5b0e0798eba56802c [0,2,0,0,0,0|2,0,0]=4 2751 B12R1.233 CC(C)Nc1ccc(cc1F)F a4394b8df0fae769ea9c11bd31860873 [0,2,0,0,0,0|2,0,0]=4 2752 B12R1.233 CC(C)Nc1ccc(cc1F)I 9abcdcc568918d4aa07a418528ab4ca2 [0,2,0,0,0,0|2,0,0]=4 2753 B12R1.233 CC(C)Nc1ccc(cc1I)Br a4509cab73cd82154d898797d431222c [0,2,0,0,0,0|2,0,0]=4 2754 B12R1.233 CC(C)Nc1ccc(cc1I)Cl 87f4f12fd7c8970dcece6a6b382d1d38 [0,2,0,0,0,0|2,0,0]=4 2755 B12R1.233 CC(C)Nc1ccc(cc1I)F 4a7066161200e173e0f2cc0591cf397e [0,2,0,0,0,0|2,0,0]=4 2756 B12R1.233 CC(C)Nc1ccc(cc1I)I e27c541bbd98b68e1b7105942d7745b8 [0,2,0,0,0,0|2,0,0]=4 2757 B12R1.233 CC(C)Nc1ccc(cc1S)Br 6426ef744c7ab58c8b1c163224372bc0 [0,2,0,0,0,0|2,0,0]=4 2758 B12R1.233 CC(C)Nc1ccc(cc1S)F f8bdf9d452f73effcd585217d28e02b6 [0,2,0,0,0,0|2,0,0]=4 2759 B12R1.233 CC(C)Nc1ncc([nH]c1=O)Br 4ac2ba5f6ea1beeec607360e531341e1 [0,2,0,0,0,0|2,0,0]=4 2760 B12R1.233 CC(C)Nc1ncc(cc1Br)Cl 8971872b073db5411c6e3da26d44be30 [0,2,0,0,0,0|1,0,0]=3 2761 B12R1.233 CC(C)Nc1ncc(cc1Br)F 71c2854a30da22e5c8e22976de79ee04 [0,2,0,0,0,0|1,0,0]=3 2762 B12R1.233 CC(C)Nc1ncc(cc1Br)I 549576b107df5a9e2d696a89fdd8c071 [0,2,0,0,0,0|1,0,0]=3 2763 B12R1.233 CC(C)Nc1ncc(cc1Cl)Br 539db33fb5df4ccc8bc64aaec9fee736 [0,2,0,0,0,0|1,0,0]=3 2764 B12R1.233 CC(C)Nc1ncc(cc1Cl)Cl 5a9cbb8532349e8fdc9c7ec300e27b34 [0,2,0,0,0,0|1,0,0]=3 2765 B12R1.233 CC(C)Nc1ncc(cc1Cl)F e43863a3164c386cbab8f0fc383f01a6 [0,2,0,0,0,0|1,0,0]=3 2766 B12R1.233 CC(C)Nc1ncc(cc1Cl)I 35568b9b207af3b7d9e5e8227b3abb2d [0,2,0,0,0,0|1,0,0]=3 2767 B12R1.233 CC(C)Nc1ncc(cc1F)Br 571871f950b70c0b2c959dc8dea6ef5c [0,2,0,0,0,0|1,0,0]=3 2768 B12R1.233 CC(C)Nc1ncc(cc1F)Cl 6a414eb66c94cf19a60658929ac50b3c [0,2,0,0,0,0|1,0,0]=3 2769 B12R1.233 CC(C)Nc1ncc(cc1F)F 4fa184fa03401caef8bf0d88f4e7f49c [0,2,0,0,0,0|1,0,0]=3 2770 B12R1.233 CC(C)Nc1ncc(cc1F)I 1df3a882ffcabfeb30d2e4281d376027 [0,2,0,0,0,0|1,0,0]=3 2771 B12R1.233 CC(C)Nc1ncc(cc1I)Br 2634c4e58ff3e35b25fdd4285a4d445d [0,2,0,0,0,0|1,0,0]=3 2772 B12R1.233 CC(C)Nc1ncc(cc1I)Cl 0839f367e6017c463472db5b2d223322 [0,2,0,0,0,0|1,0,0]=3 2773 B12R1.233 CC(C)Nc1ncc(cc1I)F c60ab6153c35f494fc0dd5b4a0e1676e [0,2,0,0,0,0|1,0,0]=3 2774 B12R1.233 CC(C)Nc1ncc(cc1I)I 4f113738f3bc5a27fb8c25cda20aa96d [0,2,0,0,0,0|1,0,0]=3 2775 B12R1.233 CC(C)Nc1ncc(nc1Br)Br 18607e3d62c9f45a9e93ee2914435c9c [0,2,0,0,0,0|2,0,0]=4 2776 B12R1.233 CC(C)Nc1ncc(nc1Br)Cl 8458ca5e15e5fc69319c113e78d98f8e [0,2,0,0,0,0|2,0,0]=4 2777 B12R1.233 CC(C)Nc1ncc(nc1Br)I 9a563640b62b7fa1bcb2f3d9c6cc4afd [0,2,0,0,0,0|2,0,0]=4 2778 B12R1.233 CC(C)Nc1ncc(nc1Cl)Br ee064a15dc0446f0c027e41fe3f7af59 [0,2,0,0,0,0|2,0,0]=4 2779 B12R1.233 CC(C)Nc1ncc(nc1Cl)Cl d22e8182716f590394c236ad271c62c0 [0,2,0,0,0,0|2,0,0]=4 2780 B12R1.233 CC(C)Nc1ncc(nc1Cl)I 140a355de3e9448d8169b7b97dc11ce2 [0,2,0,0,0,0|2,0,0]=4 2781 B12R1.233 CC(C)Nc1ncc(nc1I)Br 338f7f0907c048c4c65d8b77c50fddc4 [0,2,0,0,0,0|2,0,0]=4 2782 B12R1.233 CC(C)Nc1nnc(cc1Br)Cl a30bb2d752fad8b5ddc448d983503538 [0,2,0,0,0,0|2,0,0]=4 2783 B12R1.233 CC(C)Nc1nnc(cc1Cl)Cl d95dafe088336b3077f4c717cb936740 [0,2,0,0,0,0|2,0,0]=4 2784 B12R1.233 CC(C)Oc1ccc(cc1Br)Br 098bdda5ed3fd6c93ff98ab52d458091 [0,2,0,0,0,0|2,0,0]=4 2785 B12R1.233 CC(C)Oc1ccc(cc1Br)Cl ca4eb5111a12aed13c28e8bb97fcf48d [0,2,0,0,0,0|2,0,0]=4 2786 B12R1.233 CC(C)Oc1ccc(cc1Br)F 97e1736e74f240ac55b376c57b45193d [0,2,0,0,0,0|2,0,0]=4 2787 B12R1.233 CC(C)Oc1ccc(cc1Br)I 725d987224c564d02fd2a7586c357d08 [0,2,0,0,0,0|2,0,0]=4 2788 B12R1.233 CC(C)Oc1ccc(cc1Cl)Br dc4ef45e98f1b68c8cb850430304e943 [0,2,0,0,0,0|2,0,0]=4 2789 B12R1.233 CC(C)Oc1ccc(cc1Cl)Cl 94c7c3e065e890b54c4447cc73815b18 [0,2,0,0,0,0|2,0,0]=4 2790 B12R1.233 CC(C)Oc1ccc(cc1Cl)F 61e88ade12a0d475f74ef71c60bf1904 [0,2,0,0,0,0|2,0,0]=4 2791 B12R1.233 CC(C)Oc1ccc(cc1Cl)I aa67498d8bf030decc175fbbc918deb8 [0,2,0,0,0,0|2,0,0]=4 2792 B12R1.233 CC(C)Oc1ccc(cc1F)Br c19a64299d57df40c2c8843fac24aea1 [0,2,0,0,0,0|2,0,0]=4 2793 B12R1.233 CC(C)Oc1ccc(cc1F)Cl ebaeec894da229891250f137b6a763c0 [0,2,0,0,0,0|2,0,0]=4 2794 B12R1.233 CC(C)Oc1ccc(cc1F)F a0d488c173b8c6c0fb4f73c5a7d54376 [0,2,0,0,0,0|2,0,0]=4 2795 B12R1.233 CC(C)Oc1ccc(cc1F)I ec63e069bd6f7821c8a1c0bec4ef0722 [0,2,0,0,0,0|2,0,0]=4 2796 B12R1.233 CC(C)Oc1ccc(cc1I)Br 317f84f710da89a2e7084bf20f32752a [0,2,0,0,0,0|2,0,0]=4 2797 B12R1.233 CC(C)Oc1ccc(cc1I)Cl 8bc4c9a0ef318d0787cdaa02aa022c33 [0,2,0,0,0,0|2,0,0]=4 2798 B12R1.233 CC(C)Oc1ccc(cc1I)F b77dba761b711162cdd09284c1d5f664 [0,2,0,0,0,0|2,0,0]=4 2799 B12R1.233 CC(C)Oc1ccc(cc1I)I 4135bae58d5760016b284b3625a3d0cc [0,2,0,0,0,0|2,0,0]=4 2800 B12R1.233 CC(C)Oc1ncc(cc1Br)I f7d977cb7fb02556ed001a6305116025 [0,2,0,0,0,0|1,0,0]=3 2801 B12R1.233 CC(C)Oc1ncc(cc1Cl)Cl fe5feca07a1632c7c3f66cc946caeafa [0,2,0,0,0,0|1,0,0]=3 2802 B12R1.233 CC(C)Oc1ncc(cc1Cl)F 13b06c37c499c37dc7dc3a8e56997b93 [0,2,0,0,0,0|1,0,0]=3 2803 B12R1.233 CC(C)Oc1ncc(cc1Cl)I 3666d0a11663d24082ba2d4af228c0e2 [0,2,0,0,0,0|1,0,0]=3 2804 B12R1.233 CC(C)Oc1ncc(cc1F)F b80184de0036bf55e565f26bb6c58493 [0,2,0,0,0,0|1,0,0]=3 2805 B12R1.233 CC(C)Oc1ncc(cc1I)Br 893efe39a144d251a3308ea53fd0e326 [0,2,0,0,0,0|1,0,0]=3 2806 B12R1.233 CC(C)Oc1ncc(cc1I)Cl ea8ee9f097717ad5706d826ea15ed772 [0,2,0,0,0,0|1,0,0]=3 2807 B12R1.233 CC(C)Oc1ncc(cc1I)F 653a5d85a00bac035463bca8b71629c6 [0,2,0,0,0,0|1,0,0]=3 2808 B12R1.233 CC(C)Oc1ncc(cc1I)I 9c5e0de409d75853e54021fd572f7423 [0,2,0,0,0,0|1,0,0]=3 2809 B12R1.233 CC(C)Oc1ncc(nc1Br)Br 308b9ae9de35549583c1b3b7dcbfa8fe [0,2,0,0,0,0|2,0,0]=4 2810 B12R1.233 Cc1cc(c(nn1)NC(C)C)Br 10e073411c15607233380582e356bae7 [0,2,0,0,0,0|2,0,0]=4 2811 B12R1.233 Cc1cc(c(nn1)NC(C)C)C 3cf78f2a0ce756b6aadcb16acf292d43 [0,2,0,0,0,0|2,0,0]=4 2812 B12R1.233 Cc1cc(c(nn1)NC(C)C)Cl b1c055a97c2550d3b42350bc29fccd71 [0,2,0,0,0,0|2,0,0]=4 2813 B12R1.233 Cc1cc(ccc1NC(C)C)Cl 1eedc78e616cc8ffded0524dc00b358a [0,2,0,0,0,0|2,0,0]=4 2814 B12R1.233 Cc1cc(ccc1NC(C)C)F d6986148e6ff374f2a3effaaddcffc37 [0,2,0,0,0,0|2,0,0]=4 2815 B12R1.233 Cc1cc(ccc1OC(C)C)Br c6d764738edf5fc36a9cf8a028e41de0 [0,2,0,0,0,0|2,0,0]=4 2816 B12R1.233 Cc1cc(ccc1OC(C)C)Cl 97be465d047359724cf67eaae0b2c906 [0,2,0,0,0,0|2,0,0]=4 2817 B12R1.233 Cc1cc(ccc1OC(C)C)F 653f6e353a8cd508674520d2b66f5895 [0,2,0,0,0,0|2,0,0]=4 2818 B12R1.233 Cc1cc(ccc1OC(C)C)I 53cb0000d54633c155e04ec97c3ba650 [0,2,0,0,0,0|2,0,0]=4 2819 B12R1.233 Cc1cc(ccc1OC(C)C)S 7f319052b88783c96afd5300f75fe918 [0,2,0,0,0,0|2,0,0]=4 2820 B12R1.233 Cc1cc(cnc1NC(C)C)Br 34e93a4414a34feaf9cf230b2a36c59a [0,2,0,0,0,0|1,0,0]=3 2821 B12R1.233 Cc1cc(cnc1NC(C)C)Cl 1f1b77acc630726331931098f0cc3065 [0,2,0,0,0,0|1,0,0]=3 2822 B12R1.233 Cc1cc(cnc1NC(C)C)F 60adb3f1f50bf7c6f1316a9eadcd213e [0,2,0,0,0,0|1,0,0]=3 2823 B12R1.233 Cc1cc(cnc1NC(C)C)I 87c0715365b78498859deaa8001f10d8 [0,2,0,0,0,0|1,0,0]=3 2824 B12R1.233 Cc1cc(cnc1OC(C)C)Br bf46c24ab6f6c4cef72b42bcc949ba81 [0,2,0,0,0,0|1,0,0]=3 2825 B12R1.233 Cc1cc(cnc1OC(C)C)Cl 8cbf7d9d2a0c738e2869109ee6c09168 [0,2,0,0,0,0|1,0,0]=3 2826 B12R1.233 Cc1cc(cnc1OC(C)C)F 440bee68380d8d91bbf268089bd85384 [0,2,0,0,0,0|1,0,0]=3 2827 B12R1.233 Cc1cc(cnc1OC(C)C)I c61aa1b0e1ecc0e0c514958d7c9f99d9 [0,2,0,0,0,0|1,0,0]=3 2828 B12R1.233 Cc1cc(nnc1NC(C)C)Cl 80f1de91961bf80ad36a2367f5b205ee [0,2,0,0,0,0|2,0,0]=4 2829 B12R1.233 Cc1ccc(c(c1)Br)OC(C)C a6acb72565c1996c7186d52ef233977e [0,2,0,0,0,0|2,0,0]=4 2830 B12R1.233 Cc1ccc(c(c1)C)OC(C)C e8a1dd9cf22f9f189889c6759f3d2597 [0,2,0,0,0,0|2,0,0]=4 2831 B12R1.233 Cc1ccc(c(c1)Cl)NC(C)C f5ebe6c3a2cb7d1f602e21c7615eb132 [0,2,0,0,0,0|2,0,0]=4 2832 B12R1.233 Cc1ccc(c(c1)Cl)OC(C)C 00259539b9ee20d1eed7c19321176a91 [0,2,0,0,0,0|2,0,0]=4 2833 B12R1.233 Cc1ccc(c(c1)F)OC(C)C 238a88c0f3172d14bfc80d688936a5ee [0,2,0,0,0,0|2,0,0]=4 2834 B12R1.233 Cc1ccc(c(c1)I)OC(C)C 1d1600ad5412c16151912850934cf2ae [0,2,0,0,0,0|2,0,0]=4 2835 B12R1.233 Cc1cnc(c(=O)[nH]1)NC(C)C 7ead780a9048e31fa10ec3126cdf677d [0,2,0,0,0,0|2,0,0]=4 2836 B12R1.233 Cc1cnc(c(c1)C)NC(C)C b83b0ecf3bb676b47086c3951545b965 [0,2,0,0,0,0|1,0,0]=3 2837 B12R1.233 Cc1cnc(c(c1)F)NC(C)C 219a61a2183b32b35a1bea1ecf49fd3c [0,2,0,0,0,0|1,0,0]=3 2838 B12R1.233 Cc1cnc(c(c1)I)NC(C)C 79ade03c85550736e06e7754c388b490 [0,2,0,0,0,0|1,0,0]=3 2839 B12R1.233 Cc1cnc(c(n1)Br)NC(C)C f57706b22f76404b76ca477229f4e0e1 [0,2,0,0,0,0|2,0,0]=4 2840 B12R1.233 Cc1cnc(c(n1)C)NC(C)C a0bc0e50fc2c1361755bda3ace36f10f [0,2,0,0,0,0|2,0,0]=4 2841 B12R1.233 Cc1cnc(c(n1)C)OC(C)C a68788cc0e7db020c13bd07671b423e5 [0,2,0,0,0,0|2,0,0]=4 2842 B12R1.233 Cc1cnc(c(n1)Cl)NC(C)C 7e700f7c690e87a5c5f9a80935b8299c [0,2,0,0,0,0|2,0,0]=4 2843 B12R1.233 Cc1nc(cnc1NC(C)C)Br 357d206a663c91528294b2c23dc04167 [0,2,0,0,0,0|2,0,0]=4 2844 B12R1.233 Cc1nc(cnc1NC(C)C)Cl 7890bbabf0183862cb878a8f83d09f04 [0,2,0,0,0,0|2,0,0]=4 2845 B12R1.233 Cc1nc(cnc1NC(C)C)I 258e9a3d5980861e6b57a5f5ef42aef6 [0,2,0,0,0,0|2,0,0]=4 2846 B12R1.233 Cc1nc(cnc1OC(C)C)Br 1321bc26b6524119ce0f26bf33655b0d [0,2,0,0,0,0|2,0,0]=4 2847 B12R1.34 C=CC(C)N(C)c1ccccn1 6d4f7f91d5f351fe174016c7d754c1da [0,2,0,0,0,0|1,0,1]=4 2848 B12R1.34 CC(C=O)N(C)c1ccccn1 94915b6492b4e76dca45cd811d5eb49b [0,2,0,0,0,0|1,0,1]=4 2849 B12R1.34 CC(CO)N(C)c1ccccc1 a7ee7abf471efad76d65ff005aacf1dd [0,2,0,0,0,0|2,0,0]=4 2850 B12R1.34 CC(CO)N(C)c1ccncn1 337489f5b3fac8ecd3dc29b208577d89 [0,2,0,0,0,0|2,0,0]=4 2851 B12R1.34 CC(CO)N(C)c1cnccn1 f2d36f16f61fbc1fd3a32a721e16011d [0,2,0,0,0,0|2,0,0]=4 2852 B12R1.34 CC(CO)N(C)c1ncccn1 84d6fce7e65d07cadfbfb820520197f1 [0,2,0,0,0,0|2,0,0]=4 2853 B12R1.34 CC(c1ccccn1)N(C)C=O 4eb4bc1866f07e76246e9aecbb839680 [0,2,0,0,0,0|1,0,1]=4 2854 B12R1.34 CC(c1ccccn1)N(C)CF 650bcbad752d4ed2c6e5b45bdc1475da [0,2,0,0,0,0|1,0,0]=3 2855 B12R1.34 CC(c1ccccn1)N(C)CO 3d9a740e19e6f0528378c7eda90c604c [0,2,0,0,0,0|1,0,0]=3 2856 B12R1.34 CC(c1ccncn1)N(C)CF 6c0ac3794c722fafde77e07660e4e869 [0,2,0,0,0,0|2,0,0]=4 2857 B12R1.34 CC(c1ccncn1)N(C)CO 32cd431f7fe621dcf9de47cb4615498b [0,2,0,0,0,0|2,0,0]=4 2858 B12R1.34 CCC(C)N(C)c1ccncn1 855925732a5da72410492aac845e9109 [0,2,0,0,0,0|2,0,0]=4 2859 B12R1.34 CCC(C)N(C)c1cnccn1 59b4a069b8f13d00562d6394d339bfc9 [0,2,0,0,0,0|2,0,0]=4 2860 B12R1.34 CCC(C)N(C)c1ncccn1 dfa83819e04a17e4b542de5283f71069 [0,2,0,0,0,0|2,0,0]=4 2861 B12R1.34 CCN(C)C(=O)c1ccccn1 2559b2d554e52a086f82b5c26ad39451 [0,2,0,0,0,0|1,0,1]=4 2862 B12R1.34 CCN(C)C(C)c1ccccn1 e1b322344e042da4d3c870ba415567e2 [0,2,0,0,0,0|1,0,0]=3 2863 B12R1.34 C[C@@H](CO)N(C)c1ccccc1 96b24e6691fa0d3459c276c6ca2c2615 [0,2,0,0,0,0|2,0,0]=4 2864 B12R1.34 C[C@@H](CO)N(C)c1ccncn1 9f4a21f3006717439b342a51ed83e1fb [0,2,0,0,0,0|2,0,0]=4 2865 B12R1.34 C[C@@H](CO)N(C)c1cnccn1 c76578656b36ba09be62a69d95a4aa3f [0,2,0,0,0,0|2,0,0]=4 2866 B12R1.34 C[C@@H](CO)N(C)c1ncccn1 ba97ac21202365d0cdd665fd91f43ab3 [0,2,0,0,0,0|2,0,0]=4 2867 B12R1.34 C[C@H](C=O)N(C)c1ccccn1 bc7070375f1cf74303a3ad8f39ae1734 [0,2,0,0,0,0|1,0,1]=4 2868 B12R1.34 C[C@H](CO)N(C)c1ccccc1 a37c707a1c025793f08fdf6588fbc88b [0,2,0,0,0,0|2,0,0]=4 2869 B12R1.34 C[C@H](CO)N(C)c1ccncn1 d7a956f8f076af4ce359781cff106437 [0,2,0,0,0,0|2,0,0]=4 2870 B12R1.34 C[C@H](CO)N(C)c1cnccn1 1ee016cba17582560a5d5a18edd07a6e [0,2,0,0,0,0|2,0,0]=4 2871 B12R1.34 C[C@H](CO)N(C)c1ncccn1 cef19df16b5aa370815f0232a4e56b4e [0,2,0,0,0,0|2,0,0]=4 2872 B12R1.124 CC(C)N(C)c1ncccc1Cl 78ecddc76ba439d5c6bb8b8265b3c95a [0,2,0,0,0,0|1,0,0]=3 2873 B12R1.124 CC(C)N(C)c1ncccc1F 0b38a30ef6a638aad07d20f9bc8a4c7b [0,2,0,0,0,0|1,0,0]=3 2874 B12R1.124 CC(C)N(C)c1ncccc1I f0732c3afcf8b7d4b1b0af435b9cbf1f [0,2,0,0,0,0|1,0,0]=3 2875 B12R1.124 CC(C)N(C)c1nccnc1Cl 79195fba27c39d8d341e87c8d767a0bb [0,2,0,0,0,0|2,0,0]=4 2876 B12R1.124 CC(C)N(C)c1ncncc1Br 12925c8c0aa2c30d37eeae24e2d0a53a [0,2,0,0,0,0|2,0,0]=4 2877 B12R1.124 CC(C)N(C)c1ncncc1Cl 881518e08caf1e71a8176672c4d5775c [0,2,0,0,0,0|2,0,0]=4 2878 B12R1.124 Cc1cccnc1N(C)C(C)C 3c341e5e045cd3de7a90d543a0ed361f [0,2,0,0,0,0|1,0,0]=3 2879 B12R1.124 Cc1nccnc1N(C)C(C)C abc1b3eae9adeab92a992595a4a066e3 [0,2,0,0,0,0|2,0,0]=4 2880 B12R1.225 CC(C)N(C)c1cc(ccn1)Br 22ce545c08b2564ed315b3149894d129 [0,2,0,0,0,0|1,0,0]=3 2881 B12R1.225 CC(C)N(C)c1cc(ccn1)Cl 8eb9bfc9f059beeef7d2fabdc4ddf60b [0,2,0,0,0,0|1,0,0]=3 2882 B12R1.225 CC(C)N(C)c1cc(ccn1)F 8b92efa817ee1c7b641669f40c8faf3b [0,2,0,0,0,0|1,0,0]=3 2883 B12R1.225 CC(C)N(C)c1cc(ccn1)I 51155caba762da465af875f0c364f5bf [0,2,0,0,0,0|1,0,0]=3 2884 B12R1.225 CC(C)N(C)c1cc(ncn1)Br faf21dd22b7bc5905b5c211ad73ce9c2 [0,2,0,0,0,0|2,0,0]=4 2885 B12R1.225 CC(C)N(C)c1cc(ncn1)Cl 3a900bacc91cd1ec5b60b5a150bc88e4 [0,2,0,0,0,0|2,0,0]=4 2886 B12R1.225 CC(C)N(C)c1cccc(c1)Br 404c236cddda68afae2a72dcb1e91c48 [0,2,0,0,0,0|2,0,0]=4 2887 B12R1.225 CC(C)N(C)c1cccc(c1)I 4d85a7a31cabd784005d5d22697530e3 [0,2,0,0,0,0|2,0,0]=4 2888 B12R1.225 CC(C)N(C)c1ccnc(n1)Br 4b7b84720d2564107fa8f8c5a9823795 [0,2,0,0,0,0|2,0,0]=4 2889 B12R1.225 CC(C)N(C)c1ccnc(n1)Cl 64378edb33805cb210a0a7e472ce5c5d [0,2,0,0,0,0|2,0,0]=4 2890 B12R1.225 CC(C)N(C)c1nccc(n1)Cl 6066f85b20af65dfe562536e780aabb8 [0,2,0,0,0,0|2,0,0]=4 2891 B12R1.225 Cc1ccnc(c1)N(C)C(C)C 61503f3640449e46af8c1cc82de8056f [0,2,0,0,0,0|1,0,0]=3 2892 B12R1.225 Cc1ccnc(n1)N(C)C(C)C 88913651fca96cd422bd69fbba92bd3c [0,2,0,0,0,0|2,0,0]=4 2893 B12R1.478 CC(C)N(C#N)c1ccccc1 791504caa838a69af0259636516d458c [0,2,0,0,0,0|2,0,0]=4 2894 B12R1.478 CC(C)N(C=O)c1ccccn1 bf9e5e4b2ec097904780d85032eb08ab [0,2,0,0,0,0|1,0,0]=3 2895 B12R1.478 CC(C)N(C=O)c1cccnn1 d52a5cfcc9e384168fc8e6a2e7894347 [0,2,0,0,0,0|2,0,0]=4 2896 B12R1.478 CC(C)N(CF)c1ncccn1 039bfa3891e1a283d6d528ef036467b8 [0,2,0,0,0,0|2,0,0]=4 2897 B12R1.478 CC(C)N(CO)c1cccnn1 30ec963eef42ab94a3686c4cb5a172b3 [0,2,0,0,0,0|2,0,0]=4 2898 B12R1.478 CC(C)N(CO)c1ncccn1 023a2a9ff0cb2b37ac876eb7eea2a385 [0,2,0,0,0,0|2,0,0]=4 2899 B12R1.478 CCN(c1ncccn1)C(C)C 4bf12f712704fb9d365ee5a613251f91 [0,2,0,0,0,0|2,0,0]=4 2900 B12R1.564 CN(c1ccccc1)C(C)(C)C e80532fb4161df898c2fab27c7c13676 [0,2,0,0,0,0|2,0,0]=4 2901 B12R1.32 C#CCN(C)Cc1ccccc1 e56580931f8cdab6398e6e077f7d4a03 [0,2,0,0,0,0|2,0,0]=4 2902 B12R1.32 C#CCN(C)Cc1ccccn1 f145763fba53098f3e320f234a5cab86 [0,2,0,0,0,0|1,0,0]=3 2903 B12R1.32 C#CCN(C)Cc1cccnn1 d21a028e18ff26853281160ae7c85df0 [0,2,0,0,0,0|2,0,0]=4 2904 B12R1.32 C#CCN(C)Cc1ccncn1 090c87957a7b6151ea5accc8e140c611 [0,2,0,0,0,0|2,0,0]=4 2905 B12R1.32 C#CCN(C)Cc1cnccn1 a3371f0a3abc18f3f65b437dc25e146e [0,2,0,0,0,0|2,0,0]=4 2906 B12R1.32 C#CCN(C)Cc1ncccn1 fedfad2b28f0022cca47ffb55e178de7 [0,2,0,0,0,0|2,0,0]=4 2907 B12R1.32 C=CCN(C)Cc1ccccc1 f858c6ed41b995ef747d3394b7bc7ac3 [0,2,0,0,0,0|2,0,0]=4 2908 B12R1.32 C=CCN(C)Cc1ccccn1 44b06cd074db6bd74af193897540a655 [0,2,0,0,0,0|1,0,0]=3 2909 B12R1.32 C=CCN(C)Cc1cccnn1 56be708c5c7546cf352124755e2fae59 [0,2,0,0,0,0|2,0,0]=4 2910 B12R1.32 C=CCN(C)Cc1ccncn1 da4c4e498cc8b90bf10c1844ce4b55db [0,2,0,0,0,0|2,0,0]=4 2911 B12R1.32 C=CCN(C)Cc1cnccn1 54aa520209b7a3d593d00acdd5735177 [0,2,0,0,0,0|2,0,0]=4 2912 B12R1.32 C=CCN(C)Cc1ncccn1 b3dff47d680458f92d93a50088111eb5 [0,2,0,0,0,0|2,0,0]=4 2913 B12R1.32 CC(CC#N)Nc1ccccc1 9d497ef86eee6b3cf19732b73151dfc5 [0,2,0,0,0,0|2,0,0]=4 2914 B12R1.32 CC(CC#N)Nc1ccccn1 c0975d61d9d4bf949e198e459316e5ac [0,2,0,0,0,0|1,0,0]=3 2915 B12R1.32 CC(CC#N)Nc1cccnn1 99062f4824efd5b073499e8324a4fcaf [0,2,0,0,0,0|2,0,0]=4 2916 B12R1.32 CC(CC#N)Nc1ccncn1 ab726f3007eeaee8d5076ffcbb1b638a [0,2,0,0,0,0|2,0,0]=4 2917 B12R1.32 CC(CC#N)Nc1cnccn1 aaff2e85ff8d52b96492f9c56167b29e [0,2,0,0,0,0|2,0,0]=4 2918 B12R1.32 CC(CC#N)Nc1ncccn1 1f2a411054673fef98bd33785d07a21b [0,2,0,0,0,0|2,0,0]=4 2919 B12R1.32 CC(CC#N)Oc1ccccn1 fe6032779d6cdf64ba95d6c8168ddd56 [0,2,0,0,0,0|1,0,0]=3 2920 B12R1.32 CC(CC#N)Oc1cnccn1 ddccc8d6712f9d823d620c0e8a8bfcaf [0,2,0,0,0,0|2,0,0]=4 2921 B12R1.32 CC(CC#N)Oc1ncccn1 d8f5e7274ae10ec68bd7a4fcf668ef07 [0,2,0,0,0,0|2,0,0]=4 2922 B12R1.32 CC(CCO)Nc1ccccc1 9bf70c52b6fbdda0acbad0fbf8bda5d0 [0,2,0,0,0,0|2,0,0]=4 2923 B12R1.32 CC(CCO)Nc1cccnn1 ce8006e1e3ad3601ec2d3176ae8a0baa [0,2,0,0,0,0|2,0,0]=4 2924 B12R1.32 CC(CCO)Nc1ccncn1 55d7ca76b5ed044f06c0dd71d8dbf294 [0,2,0,0,0,0|2,0,0]=4 2925 B12R1.32 CC(CCO)Nc1cnccn1 fbe36d708c6f04f3ad9b566890739f82 [0,2,0,0,0,0|2,0,0]=4 2926 B12R1.32 CC(CCO)Nc1ncccn1 3094a827b9644842a2e3bc29e115d213 [0,2,0,0,0,0|2,0,0]=4 2927 B12R1.32 CC(Cc1ccccn1)NC=O a741ecaffa437be6e161ee51f0aaadec [0,2,0,0,0,0|0,0,1]=3 2928 B12R1.32 CC(Cc1ccccn1)NCF d5fdd6b98c347b6317b5d0d8cf3c28b6 [0,2,0,0,0,0|0,0,0]=2 2929 B12R1.32 CC(Cc1ccccn1)NCO eb641c414d0b15108bf9321647b7890c [0,2,0,0,0,0|0,0,0]=2 2930 B12R1.32 CC(Cc1ccccn1)OCF d6c424851ea201f763a1418247a6eb34 [0,2,0,0,0,0|0,0,0]=2 2931 B12R1.32 CC(Cc1cccnc1)NCF 0a8331e6b65f8d98e5c22c4682170fe6 [0,2,0,0,0,0|2,0,0]=4 2932 B12R1.32 CC(Cc1cccnc1)NCO 2d1e9d214ab4e58b5282fe30111314e4 [0,2,0,0,0,0|2,0,0]=4 2933 B12R1.32 CC(Cc1ccncc1)NCF 552d22a85f958469339986039ae7dce3 [0,2,0,0,0,0|2,0,0]=4 2934 B12R1.32 CC(Cc1ccncc1)NCO def23991f96c3f6436149b61afb90490 [0,2,0,0,0,0|2,0,0]=4 2935 B12R1.32 CC(Cc1cnccn1)NC=O dcd5f2baed34d8ef11366ea1e9d2d9eb [0,2,0,0,0,0|1,0,1]=4 2936 B12R1.32 CC(Cc1cnccn1)NCF 162ba9574e5d80553a18bb0728d80865 [0,2,0,0,0,0|1,0,0]=3 2937 B12R1.32 CC(Cc1cnccn1)NCO f86cc27b8a2719a3865d7f92ea5b3f87 [0,2,0,0,0,0|1,0,0]=3 2938 B12R1.32 CC(Cc1cnccn1)OCF 19c4f4c9a50c77974aa8cdac147d1ec7 [0,2,0,0,0,0|1,0,0]=3 2939 B12R1.32 CCCC(C)Nc1ccccc1 0980d123cfa1556625b2cd315916fb5f [0,2,0,0,0,0|2,0,0]=4 2940 B12R1.32 CCCC(C)Nc1ccccn1 2669f8567b938ac2a918e85bd69bb770 [0,2,0,0,0,0|1,0,0]=3 2941 B12R1.32 CCCC(C)Nc1cccnn1 4a3b3a4f6b8f10fdeb3fd5d91ccf093d [0,2,0,0,0,0|2,0,0]=4 2942 B12R1.32 CCCC(C)Nc1ccncn1 bf09bd647cc46ecda3ce4818cf198305 [0,2,0,0,0,0|2,0,0]=4 2943 B12R1.32 CCCC(C)Nc1cnccn1 5e0ac452f66c3352f66df0a830175170 [0,2,0,0,0,0|2,0,0]=4 2944 B12R1.32 CCCC(C)Nc1ncccn1 f5359d73c3bdd7abf380648d4f2a798d [0,2,0,0,0,0|2,0,0]=4 2945 B12R1.32 CCCC(C)Oc1ccccn1 f14a322e30e4491e36792a6fd64a30e7 [0,2,0,0,0,0|1,0,0]=3 2946 B12R1.32 CCCC(C)Oc1cnccn1 1992d4e0d8a70e195f806a9236813dfa [0,2,0,0,0,0|2,0,0]=4 2947 B12R1.32 CCCC(C)Oc1ncccn1 d3295436c2eb03b3c01a07b1fcfb9cf9 [0,2,0,0,0,0|2,0,0]=4 2948 B12R1.32 CCCN(C)Cc1ccccc1 4eed5f3692a34dc05deac3e14f757f4f [0,2,0,0,0,0|2,0,0]=4 2949 B12R1.32 CCCN(C)Cc1ccccn1 2ba7f31870dc6781d668ec555cfac4b5 [0,2,0,0,0,0|1,0,0]=3 2950 B12R1.32 CCCN(C)Cc1cccnn1 de5c0eb74cd9abbe9449532ba3643c60 [0,2,0,0,0,0|2,0,0]=4 2951 B12R1.32 CCCN(C)Cc1ccncn1 78a7bf5a92439733e2b906d9c64899e7 [0,2,0,0,0,0|2,0,0]=4 2952 B12R1.32 CCCN(C)Cc1cnccn1 3b47eeecf77069f5bfd14dcb1d5a3e6b [0,2,0,0,0,0|2,0,0]=4 2953 B12R1.32 CCCN(C)Cc1ncccn1 91898f0226343ba16725efb2855aaaa9 [0,2,0,0,0,0|2,0,0]=4 2954 B12R1.32 CCC[C@H](C)Nc1ccccc1 14114dc7aca9a95d33818d8f8cfafa73 [0,2,0,0,0,0|2,0,0]=4 2955 B12R1.32 CCNC(C)Cc1ccccn1 3f739570fdaf944ffb41444c69149a83 [0,2,0,0,0,0|0,0,0]=2 2956 B12R1.32 CCNC(C)Cc1cccnc1 1c73ce06501092b14624237b8eaa830e [0,2,0,0,0,0|2,0,0]=4 2957 B12R1.32 CCNC(C)Cc1ccncc1 1ac39eab33f6c8633237d01993a17382 [0,2,0,0,0,0|2,0,0]=4 2958 B12R1.32 CCNC(C)Cc1cnccn1 bda15725b23b5e321786fab09c3daddb [0,2,0,0,0,0|1,0,0]=3 2959 B12R1.32 CCOC(C)Cc1ccccc1 37a2c2b5ef50b1a7cf2088b7456e4451 [0,2,0,0,0,0|1,0,0]=3 2960 B12R1.32 CCOC(C)Cc1ccccn1 144eae020541eabb52d7b3534ceef0a4 [0,2,0,0,0,0|0,0,0]=2 2961 B12R1.32 CCOC(C)Cc1cnccn1 3ecdf3d8e361b30d87e2f6f581391495 [0,2,0,0,0,0|1,0,0]=3 2962 B12R1.32 CCO[C@@H](C)Cc1ccccc1 19276107fa4d022850aeee4089dafd0c [0,2,0,0,0,0|1,0,0]=3 2963 B12R1.32 CCO[C@H](C)Cc1ccccc1 2f8e91d1dc9d2f9667dcff63e87e082c [0,2,0,0,0,0|1,0,0]=3 2964 B12R1.32 CN(CC#N)Cc1ccccc1 5c32846a8b8f40e8ba55bc3d3a77884c [0,2,0,0,0,0|2,0,0]=4 2965 B12R1.32 CN(CC#N)Cc1ccccn1 2b328196452f779fb0aa2a69f9df754d [0,2,0,0,0,0|1,0,0]=3 2966 B12R1.32 CN(CC#N)Cc1cccnn1 cdaa769c6dabf858adf75fb970de54c4 [0,2,0,0,0,0|2,0,0]=4 2967 B12R1.32 CN(CC#N)Cc1ccncn1 05937d5d8b274014ca347817c3b849d9 [0,2,0,0,0,0|2,0,0]=4 2968 B12R1.32 CN(CC#N)Cc1cnccn1 8c45329f6a5a83507e7b15ce254e7233 [0,2,0,0,0,0|2,0,0]=4 2969 B12R1.32 CN(CC#N)Cc1ncccn1 19aaae54be0e8b03e55b0a9a9f4d8471 [0,2,0,0,0,0|2,0,0]=4 2970 B12R1.32 CN(CC=O)Cc1ccccc1 7580b9a13b83ef7e7f2ffe8dfb9a649a [0,2,0,0,0,0|2,0,0]=4 2971 B12R1.32 CN(CC=O)Cc1ccccn1 3cb19ec3f58df3186949ce7fc1c48ebf [0,2,0,0,0,0|1,0,0]=3 2972 B12R1.32 CN(CC=O)Cc1cnccn1 198cef1b66f6af3b2e4f7d26f003610c [0,2,0,0,0,0|2,0,0]=4 2973 B12R1.32 CN(CC=O)Cc1ncccn1 d0bf960499befe7cf20cc0ccf3ebcd81 [0,2,0,0,0,0|2,0,0]=4 2974 B12R1.32 CN(CCF)Cc1ccccc1 c2bce3f6897fd6361961da43db186c6c [0,2,0,0,0,0|2,0,0]=4 2975 B12R1.32 CN(CCF)Cc1ccccn1 e5e3987aa096f716f04001ec62a0de3c [0,2,0,0,0,0|1,0,0]=3 2976 B12R1.32 CN(CCF)Cc1cccnn1 01cafd5e183c78f25edc0f5b45769d27 [0,2,0,0,0,0|2,0,0]=4 2977 B12R1.32 CN(CCF)Cc1ccncn1 9f53e88507cbab33797c49e88211f8c2 [0,2,0,0,0,0|2,0,0]=4 2978 B12R1.32 CN(CCF)Cc1cnccn1 fbfce4e42f774aa0592e2d34ac42fa5f [0,2,0,0,0,0|2,0,0]=4 2979 B12R1.32 CN(CCF)Cc1ncccn1 0a5e75118dcdd835fdbe14626f6f3cd4 [0,2,0,0,0,0|2,0,0]=4 2980 B12R1.32 CN(CCO)Cc1ccccc1 757bf36fdf4b02517da3241e86467be6 [0,2,0,0,0,0|2,0,0]=4 2981 B12R1.32 CN(CCO)Cc1ccccn1 e6506de41dc1aa2a0101e326b7b68e93 [0,2,0,0,0,0|1,0,0]=3 2982 B12R1.32 CN(CCO)Cc1cccnn1 7ec1319ca1cdee0b7fbbec8ca65b84b4 [0,2,0,0,0,0|2,0,0]=4 2983 B12R1.32 CN(CCO)Cc1ccncn1 442473b76f52d002f5db55edcca25e5b [0,2,0,0,0,0|2,0,0]=4 2984 B12R1.32 CN(CCO)Cc1cnccn1 975c82527d963422732ef53161de26e5 [0,2,0,0,0,0|2,0,0]=4 2985 B12R1.32 CN(CCO)Cc1ncccn1 8b6b166d4fd536e99dd0071a0c265abd [0,2,0,0,0,0|2,0,0]=4 2986 B12R1.32 CN(CCS)Cc1ccccc1 8e8f744accb260bbf35bc2715f513a4e [0,2,0,0,0,0|2,0,0]=4 2987 B12R1.32 CN(CCS)Cc1ccccn1 738efb58845b6d328d324778a901dac1 [0,2,0,0,0,0|1,0,0]=3 2988 B12R1.32 CN(CCS)Cc1cnccn1 71023342df27587d4aedac6471fae373 [0,2,0,0,0,0|2,0,0]=4 2989 B12R1.32 CN(CCS)Cc1ncccn1 32fbb77863d3629492d4e6a82b2b72b2 [0,2,0,0,0,0|2,0,0]=4 2990 B12R1.32 COCC(C)Nc1ccccc1 918c3e9faef698920f78ca93350fda53 [0,2,0,0,0,0|2,0,0]=4 2991 B12R1.32 COCC(C)Nc1ccccn1 b87c4274a798014c5caa22801a140abd [0,2,0,0,0,0|1,0,0]=3 2992 B12R1.32 COCC(C)Nc1cccnn1 706a02eb6ddc599c7da65191d8bff4aa [0,2,0,0,0,0|2,0,0]=4 2993 B12R1.32 COCC(C)Nc1ccncn1 5f719d5ba83ffe96b94fa9664f636602 [0,2,0,0,0,0|2,0,0]=4 2994 B12R1.32 COCC(C)Nc1cnccn1 889b7cc55a844b93564b89b38cf0517e [0,2,0,0,0,0|2,0,0]=4 2995 B12R1.32 COCC(C)Nc1ncccn1 ed074a007ddb3aaecb983c3f1308f4eb [0,2,0,0,0,0|2,0,0]=4 2996 B12R1.32 COCC(C)Oc1ccccn1 668fa5e1f0515f975b72eaca09bba005 [0,2,0,0,0,0|1,0,0]=3 2997 B12R1.32 COCC(C)Oc1cnccn1 0c9552f56f369faf7edd37c2f274a26c [0,2,0,0,0,0|2,0,0]=4 2998 B12R1.32 COCC(C)Oc1ncccn1 ac382cecf32b2f838ef531f80c1fdd40 [0,2,0,0,0,0|2,0,0]=4 2999 B12R1.32 COCN(C)Cc1ccccc1 4d05c3d6ddf3ecec9a6b681c1068023b [0,2,0,0,0,0|2,0,0]=4 3000 B12R1.32 COCN(C)Cc1ccccn1 be6855095994cc4fb8e97c0a5352a8a9 [0,2,0,0,0,0|1,0,0]=3 3001 B12R1.32 COCN(C)Cc1cnccn1 b71aa0573c49daf69cc2f163b159c115 [0,2,0,0,0,0|2,0,0]=4 3002 B12R1.32 COCN(C)Cc1ncccn1 809c437b916af26b6a2bcc039099351b [0,2,0,0,0,0|2,0,0]=4 3003 B12R1.32 COC[C@@H](C)Nc1ccccc1 b6337fbd6f770477a80a235354ba550b [0,2,0,0,0,0|2,0,0]=4 3004 B12R1.32 COC[C@@H](C)Nc1cccnn1 ccee5bf26bb2372a5999a0b0af733626 [0,2,0,0,0,0|2,0,0]=4 3005 B12R1.32 COC[C@@H](C)Nc1ccncn1 e5a429e6965c597cb7c868a083c3ea07 [0,2,0,0,0,0|2,0,0]=4 3006 B12R1.32 COC[C@H](C)Nc1ccccc1 6b0bb5bdf147fc56918f57a798a463a2 [0,2,0,0,0,0|2,0,0]=4 3007 B12R1.32 COC[C@H](C)Nc1cccnn1 9fd5102cd92dfa039072b660fc3d61c4 [0,2,0,0,0,0|2,0,0]=4 3008 B12R1.32 COC[C@H](C)Nc1ccncn1 c8f27b99cc25e16a1494f4e3f4ad4898 [0,2,0,0,0,0|2,0,0]=4 3009 B12R1.32 CSCN(C)Cc1ccccc1 d9791fc92d257d5436d9d59fe9a2c04e [0,2,0,0,0,0|2,0,0]=4 3010 B12R1.32 CSCN(C)Cc1ccccn1 800949e21971faefc87feb49b8f46bb4 [0,2,0,0,0,0|1,0,0]=3 3011 B12R1.32 CSCN(C)Cc1cnccn1 22c787cc661e446c84cc5d566a7816b6 [0,2,0,0,0,0|2,0,0]=4 3012 B12R1.32 CSCN(C)Cc1ncccn1 dc7a8709f445866cd59b4006be085050 [0,2,0,0,0,0|2,0,0]=4 3013 B12R1.32 C[C@@H](CCO)Nc1ccccc1 fc83b26b05d5bb1e6a4de978429a6aa3 [0,2,0,0,0,0|2,0,0]=4 3014 B12R1.32 C[C@H](CCO)Nc1ccccc1 83604672ebfdf7df8b733c8cb4f2aa8a [0,2,0,0,0,0|2,0,0]=4 3015 B12R1.50 C=CC(C)Nc1cc(ccn1)Br a79d5a34249357509fdf76236bec6f59 [0,2,0,0,0,0|1,0,1]=4 3016 B12R1.50 C=CC(C)Nc1cc(ccn1)C 5dcd3c6e2fd90cc1035ecc9d033dab27 [0,2,0,0,0,0|1,0,1]=4 3017 B12R1.50 C=CC(C)Nc1cc(ccn1)Cl 4054f6465b759545f9b2ff8ddd421584 [0,2,0,0,0,0|1,0,1]=4 3018 B12R1.50 C=CC(C)Nc1cc(ccn1)F 6a9ec655b0ea6f3e244954bdc9e34821 [0,2,0,0,0,0|1,0,1]=4 3019 B12R1.50 C=CC(C)Nc1cc(ccn1)I 4aad70a9c64217a130bcaffc8ed67525 [0,2,0,0,0,0|1,0,1]=4 3020 B12R1.50 C=CC(C)Nc1cc(ccn1)O fa76b925c8cf603dbbde337ce74b2de8 [0,2,0,0,0,0|1,0,1]=4 3021 B12R1.50 C=CC(C)Nc1cccc(n1)Br dfdcd447f0b1f8e17091bc1d0fd9e45b [0,2,0,0,0,0|1,0,1]=4 3022 B12R1.50 C=CC(C)Nc1cccc(n1)C 73b8756292e86d522652c8e51dbfa30e [0,2,0,0,0,0|1,0,1]=4 3023 B12R1.50 C=CC(C)Nc1cccc(n1)Cl 522a05d7d38d1a3fa8faab4388106504 [0,2,0,0,0,0|1,0,1]=4 3024 B12R1.50 C=CC(C)Nc1cccc(n1)F 2aef94fbb32b729eec29791334234239 [0,2,0,0,0,0|1,0,1]=4 3025 B12R1.50 C=CC(C)Nc1cccc(n1)I cfc5b67b9e697a4f4c7b5689c29214b2 [0,2,0,0,0,0|1,0,1]=4 3026 B12R1.50 C=CC(C)Oc1cc(ccn1)Br f439854f9feab04a2edef6b71cc6c11c [0,2,0,0,0,0|1,0,1]=4 3027 B12R1.50 C=CC(C)Oc1cc(ccn1)C e7add3f067adec3918d7fc18881c942f [0,2,0,0,0,0|1,0,1]=4 3028 B12R1.50 C=CC(C)Oc1cc(ccn1)Cl 51ea4c2f046da69c8af4f58690881fc1 [0,2,0,0,0,0|1,0,1]=4 3029 B12R1.50 C=CC(C)Oc1cc(ccn1)F 17bed4d37492c11969fa470966f77da0 [0,2,0,0,0,0|1,0,1]=4 3030 B12R1.50 C=CC(C)Oc1cccc(n1)Br c71fc104e9b467f01933d015dfc5a860 [0,2,0,0,0,0|1,0,1]=4 3031 B12R1.50 C=CC(C)Oc1cccc(n1)C a264692aa8f415e84a64f0f751c3d3dc [0,2,0,0,0,0|1,0,1]=4 3032 B12R1.50 C=CC(C)Oc1cccc(n1)F 94d94b03910235104f3ed2c5bd8f8f67 [0,2,0,0,0,0|1,0,1]=4 3033 B12R1.50 CC(C#N)Oc1cc(ccn1)Br 3d8061a78873b762928f52e643ba45fd [0,2,0,0,0,0|1,0,1]=4 3034 B12R1.50 CC(C=O)Nc1cc(ccn1)Br c2e9081713ed42ddab209778fbfaef22 [0,2,0,0,0,0|1,0,1]=4 3035 B12R1.50 CC(C=O)Nc1cc(ccn1)Cl f6476dba64a929a32ac4c1fe1e1c2b34 [0,2,0,0,0,0|1,0,1]=4 3036 B12R1.50 CC(C=O)Nc1cc(ccn1)F dc0e5484940b3d6f2b9f4ec362bf074a [0,2,0,0,0,0|1,0,1]=4 3037 B12R1.50 CC(C=O)Nc1cc(ccn1)I 0a391d48fd03b7fcf39c8da7f807ee81 [0,2,0,0,0,0|1,0,1]=4 3038 B12R1.50 CC(C=O)Nc1cccc(n1)Br a3ab83f17802c01d8fb944252443ff0c [0,2,0,0,0,0|1,0,1]=4 3039 B12R1.50 CC(C=O)Nc1cccc(n1)Cl a773e57ae05d6bd09e27a97220463ec9 [0,2,0,0,0,0|1,0,1]=4 3040 B12R1.50 CC(C=O)Nc1cccc(n1)F 0ed996a4cd78b706461d993b4bc1061f [0,2,0,0,0,0|1,0,1]=4 3041 B12R1.50 CC(C=O)Nc1cccc(n1)I 47a92d1b5914c7dfc2ac061132ec7882 [0,2,0,0,0,0|1,0,1]=4 3042 B12R1.50 CC(C=O)Oc1cc(ccn1)Br 7ee55ef14eebd43c093ed168eee97254 [0,2,0,0,0,0|1,0,1]=4 3043 B12R1.50 CC(C=O)Oc1cc(ccn1)Cl 8e388f64dcb0cfdaddce3e50db756d16 [0,2,0,0,0,0|1,0,1]=4 3044 B12R1.50 CC(C=O)Oc1cc(ccn1)F 31fd7c5cabb09c5b3347e37906c7a3dd [0,2,0,0,0,0|1,0,1]=4 3045 B12R1.50 CC(C=O)Oc1cccc(n1)Br 10e5904b9cdddc5b03ae981090b6d1fa [0,2,0,0,0,0|1,0,1]=4 3046 B12R1.50 CC(C=O)Oc1cccc(n1)F 5c32951e9bafe76b18c349973f2de5a7 [0,2,0,0,0,0|1,0,1]=4 3047 B12R1.50 CC(CO)Nc1cc(ccn1)Br 2db262ee0de2e007f8a5dec2eb9292a5 [0,2,0,0,0,0|1,0,0]=3 3048 B12R1.50 CC(CO)Nc1cc(ccn1)Cl 6b823c91ff296c296a64a30b8f5b3e62 [0,2,0,0,0,0|1,0,0]=3 3049 B12R1.50 CC(CO)Nc1cc(ccn1)F 62e1b4be9c844ddeeed8f04265df3073 [0,2,0,0,0,0|1,0,0]=3 3050 B12R1.50 CC(CO)Nc1cc(ccn1)I 5660c296509b0f04f2a652236d75a831 [0,2,0,0,0,0|1,0,0]=3 3051 B12R1.50 CC(CO)Nc1cc(cnn1)Br 0799bb81f69fbf9deebcbe53dc24f327 [0,2,0,0,0,0|2,0,0]=4 3052 B12R1.50 CC(CO)Nc1cc(cnn1)Cl b8f01f30da8a1d51993b3f3fa461b2ce [0,2,0,0,0,0|2,0,0]=4 3053 B12R1.50 CC(CO)Nc1cc(ncn1)Br 5e30598078d50dc952c2ce6150f0dc5a [0,2,0,0,0,0|2,0,0]=4 3054 B12R1.50 CC(CO)Nc1cc(ncn1)Cl 5071b669998bfd6ac788a8021bbc68ce [0,2,0,0,0,0|2,0,0]=4 3055 B12R1.50 CC(CO)Nc1cc(ncn1)F 532fb6932267379dc2ca0666c0ab2777 [0,2,0,0,0,0|2,0,0]=4 3056 B12R1.50 CC(CO)Nc1cc(ncn1)I 33d9d917fa6ba78cd3b1fc0af093dfe1 [0,2,0,0,0,0|2,0,0]=4 3057 B12R1.50 CC(CO)Nc1cc[nH]c(=O)n1 de3d102fad9d9df68296438546f57977 [0,2,0,0,0,0|2,0,0]=4 3058 B12R1.50 CC(CO)Nc1cccc(c1)Br 576ec4f6677be1f0394edeaf258b38fe [0,2,0,0,0,0|2,0,0]=4 3059 B12R1.50 CC(CO)Nc1cccc(c1)Cl bd22220cbe1e26dbecd73c43bc0875f8 [0,2,0,0,0,0|2,0,0]=4 3060 B12R1.50 CC(CO)Nc1cccc(c1)F 61b69c3784d43bb9b9681ef8141ee922 [0,2,0,0,0,0|2,0,0]=4 3061 B12R1.50 CC(CO)Nc1cccc(c1)I 6634a846fe603d296254a7ec9e7b692c [0,2,0,0,0,0|2,0,0]=4 3062 B12R1.50 CC(CO)Nc1cccc(n1)I 31b2740522a5abc0b28216a96a08f828 [0,2,0,0,0,0|1,0,0]=3 3063 B12R1.50 CC(CO)Nc1ccnc(n1)Br 3318c60ea5eed858a6c5ace8248e8a8d [0,2,0,0,0,0|2,0,0]=4 3064 B12R1.50 CC(CO)Nc1ccnc(n1)Cl ea0df05d6f39b59bf337eec7f46a5624 [0,2,0,0,0,0|2,0,0]=4 3065 B12R1.50 CC(CO)Nc1ccnc(n1)F 21a7091f64dd7098e8262495dfb962eb [0,2,0,0,0,0|2,0,0]=4 3066 B12R1.50 CC(CO)Nc1cncc(n1)Br bf81599e19f06b1df451ff66cf160f2c [0,2,0,0,0,0|2,0,0]=4 3067 B12R1.50 CC(CO)Nc1cncc(n1)Cl a6187495715880f309280da1220d7f9a [0,2,0,0,0,0|2,0,0]=4 3068 B12R1.50 CC(CO)Nc1cncc(n1)F 1fcfd48ed8042efaff487b37678eb7c6 [0,2,0,0,0,0|2,0,0]=4 3069 B12R1.50 CC(CO)Nc1nccc(=O)[nH]1 a69fef8de694927ee2174923014b682a [0,2,0,0,0,0|2,0,0]=4 3070 B12R1.50 CC(CO)Nc1nccc(n1)Br 1ce112dd115210228b2410962d8249b9 [0,2,0,0,0,0|2,0,0]=4 3071 B12R1.50 CC(CO)Nc1nccc(n1)Cl cf649c62e1d14e81bacb38deaa7ef02c [0,2,0,0,0,0|2,0,0]=4 3072 B12R1.50 CC(CO)Nc1nccc(n1)F 5c8ea1b17dec26fcda9d0a0a780a6cab [0,2,0,0,0,0|2,0,0]=4 3073 B12R1.50 CC(CO)Nc1nccc(n1)I 8cef3b393ec53adc81a7bd47c40e442d [0,2,0,0,0,0|2,0,0]=4 3074 B12R1.50 CCC(C)Nc1cc(ccn1)Br 594e6ed63689a65d4a0c6fc159c9e517 [0,2,0,0,0,0|1,0,0]=3 3075 B12R1.50 CCC(C)Nc1cc(ccn1)C 81ee07239cb203358014a073f1e632ff [0,2,0,0,0,0|1,0,0]=3 3076 B12R1.50 CCC(C)Nc1cc(ccn1)Cl 8093c1dc42b9a1ce87c476e26f12f224 [0,2,0,0,0,0|1,0,0]=3 3077 B12R1.50 CCC(C)Nc1cc(ccn1)F a49a6f9aca7266ce3f010141e3df96cd [0,2,0,0,0,0|1,0,0]=3 3078 B12R1.50 CCC(C)Nc1cc(ccn1)I 9a8c8d9b737531a6388ece43ef69dbcd [0,2,0,0,0,0|1,0,0]=3 3079 B12R1.50 CCC(C)Nc1cc(cnn1)Br 11c111a74a7492637f9c08d22aa7fa33 [0,2,0,0,0,0|2,0,0]=4 3080 B12R1.50 CCC(C)Nc1cc(cnn1)C 84a98b9128dbd21104cc8b68c63ffc88 [0,2,0,0,0,0|2,0,0]=4 3081 B12R1.50 CCC(C)Nc1cc(cnn1)Cl 375688fd98e83dcbb2558b2d89af69e5 [0,2,0,0,0,0|2,0,0]=4 3082 B12R1.50 CCC(C)Nc1cc(ncn1)Br 1bef163cd515d260302be35b27ba1dfe [0,2,0,0,0,0|2,0,0]=4 3083 B12R1.50 CCC(C)Nc1cc(ncn1)C 6184d789f4c811519a957bad469a0c8c [0,2,0,0,0,0|2,0,0]=4 3084 B12R1.50 CCC(C)Nc1cc(ncn1)Cl 9c8574c38fb7796dcc43d222e7bf08c4 [0,2,0,0,0,0|2,0,0]=4 3085 B12R1.50 CCC(C)Nc1cc(ncn1)F 494e6bfa1f822f2ef58fee789ae9ff05 [0,2,0,0,0,0|2,0,0]=4 3086 B12R1.50 CCC(C)Nc1cc(ncn1)I 8164e982a781b7693c0e3be2247e9d8b [0,2,0,0,0,0|2,0,0]=4 3087 B12R1.50 CCC(C)Nc1cc[nH]c(=O)n1 d8420bca368505c25e52f44559a3923c [0,2,0,0,0,0|2,0,0]=4 3088 B12R1.50 CCC(C)Nc1cccc(c1)Br 1d66578ce06ff9734ac9091e085e6a07 [0,2,0,0,0,0|2,0,0]=4 3089 B12R1.50 CCC(C)Nc1cccc(c1)C d7cf6e3b62030f874de6f1eb9d16cf4f [0,2,0,0,0,0|2,0,0]=4 3090 B12R1.50 CCC(C)Nc1cccc(c1)Cl 08bdcd143bf3141bf35886f1a7a48241 [0,2,0,0,0,0|2,0,0]=4 3091 B12R1.50 CCC(C)Nc1cccc(c1)F abc1ee7f668b8358dc6ca8fd4a50a6d5 [0,2,0,0,0,0|2,0,0]=4 3092 B12R1.50 CCC(C)Nc1cccc(c1)I bc6d04f9805b80597b81c6888c542900 [0,2,0,0,0,0|2,0,0]=4 3093 B12R1.50 CCC(C)Nc1cccc(c1)S 2cd18a9ced79be6a90be5bf41232bef9 [0,2,0,0,0,0|2,0,0]=4 3094 B12R1.50 CCC(C)Nc1cccc(n1)Br 1b80b2884dc3ef58e1e29baaa3fced62 [0,2,0,0,0,0|1,0,0]=3 3095 B12R1.50 CCC(C)Nc1cccc(n1)C 02f6945e301e5f640cb0c4d8447bbcde [0,2,0,0,0,0|1,0,0]=3 3096 B12R1.50 CCC(C)Nc1cccc(n1)F ce3dbcda0cb4b82b1a9c3eb4b0fca195 [0,2,0,0,0,0|1,0,0]=3 3097 B12R1.50 CCC(C)Nc1cccc(n1)I af587b2d186b1981e1db504b2936c2d3 [0,2,0,0,0,0|1,0,0]=3 3098 B12R1.50 CCC(C)Nc1ccnc(n1)Br 7d33f2bc2df046e83c117577dc9e3c0c [0,2,0,0,0,0|2,0,0]=4 3099 B12R1.50 CCC(C)Nc1ccnc(n1)C 7cd14b1b82a1ed401b0fcd5aaf46e400 [0,2,0,0,0,0|2,0,0]=4 3100 B12R1.50 CCC(C)Nc1ccnc(n1)Cl 4eede2b3cab8ad474db37dea1b0545ff [0,2,0,0,0,0|2,0,0]=4 3101 B12R1.50 CCC(C)Nc1ccnc(n1)F fb8aa232708e9ddb6b00793052c86201 [0,2,0,0,0,0|2,0,0]=4 3102 B12R1.50 CCC(C)Nc1ccnc(n1)S f2bb9ef1eb1fec270aeb966197b3b31f [0,2,0,0,0,0|2,0,0]=4 3103 B12R1.50 CCC(C)Nc1cncc(n1)Br f7ff480eb1324c083c90b1ef9d2b94f8 [0,2,0,0,0,0|2,0,0]=4 3104 B12R1.50 CCC(C)Nc1cncc(n1)C 78a6edb9f41342c20beb9ff0531cecda [0,2,0,0,0,0|2,0,0]=4 3105 B12R1.50 CCC(C)Nc1cncc(n1)F 9c34b959d4a8f49e110b7c0ab52cc1e8 [0,2,0,0,0,0|2,0,0]=4 3106 B12R1.50 CCC(C)Nc1nccc(=O)[nH]1 f386733f5f16e5bedcad21aadece67ce [0,2,0,0,0,0|2,0,0]=4 3107 B12R1.50 CCC(C)Nc1nccc(n1)Br 2501ba26f223970b3d94457f620c89ba [0,2,0,0,0,0|2,0,0]=4 3108 B12R1.50 CCC(C)Nc1nccc(n1)C 5299244ab73b665a944237e0d4eefc06 [0,2,0,0,0,0|2,0,0]=4 3109 B12R1.50 CCC(C)Nc1nccc(n1)Cl 91b8467bc1244bb8224e2f0023458a74 [0,2,0,0,0,0|2,0,0]=4 3110 B12R1.50 CCC(C)Nc1nccc(n1)F 37e210e758b8060d35b2715c5fe08a98 [0,2,0,0,0,0|2,0,0]=4 3111 B12R1.50 CCC(C)Nc1nccc(n1)I b4fdcc1e60239dc0cb873ca46cfde50d [0,2,0,0,0,0|2,0,0]=4 3112 B12R1.50 CCC(C)Nc1nccc(n1)S d3c466e1c080b737c59bbea77c180356 [0,2,0,0,0,0|2,0,0]=4 3113 B12R1.50 CCC(C)Oc1cc(ccn1)Br 028aeba17a276b5d68e0c3910a92a015 [0,2,0,0,0,0|1,0,0]=3 3114 B12R1.50 CCC(C)Oc1cc(ccn1)C 0c59f69bf438fad3881c8cf68db492f1 [0,2,0,0,0,0|1,0,0]=3 3115 B12R1.50 CCC(C)Oc1cc(ccn1)Cl b70af3679db70e9128636896a00fd4fc [0,2,0,0,0,0|1,0,0]=3 3116 B12R1.50 CCC(C)Oc1cc(ccn1)F 03ae7f5980d0b550991f1275c0cafacb [0,2,0,0,0,0|1,0,0]=3 3117 B12R1.50 CCC(C)Oc1cc(ncn1)Br c3ab89bc7cd53c22714e4b4890780e22 [0,2,0,0,0,0|2,0,0]=4 3118 B12R1.50 CCC(C)Oc1cc(ncn1)C f5e8d6f3df22196151eddb6461a0207c [0,2,0,0,0,0|2,0,0]=4 3119 B12R1.50 CCC(C)Oc1cc(ncn1)Cl 4abe2ca062a19d371ffef409bc35501f [0,2,0,0,0,0|2,0,0]=4 3120 B12R1.50 CCC(C)Oc1cccc(=O)[nH]1 2f2f4d448d4abe1030945ebab86c3839 [0,2,0,0,0,0|1,0,1]=4 3121 B12R1.50 CCC(C)Oc1cccc(c1)Br 11f5b596601cd571c59ff2afebc8ce7a [0,2,0,0,0,0|2,0,0]=4 3122 B12R1.50 CCC(C)Oc1cccc(c1)C 9cbbc47209d16c8e877df0d39e5bcab2 [0,2,0,0,0,0|2,0,0]=4 3123 B12R1.50 CCC(C)Oc1cccc(c1)Cl 3dfa34a86dfbb1225b2fc77d38aaa045 [0,2,0,0,0,0|2,0,0]=4 3124 B12R1.50 CCC(C)Oc1cccc(c1)F 11c1cebedbe6e61c8d433bebe0c72b96 [0,2,0,0,0,0|2,0,0]=4 3125 B12R1.50 CCC(C)Oc1cccc(c1)I 7ed5e0b105802053e06ca681572fa199 [0,2,0,0,0,0|2,0,0]=4 3126 B12R1.50 CCC(C)Oc1cccc(c1)S 4218a788a21d0fc160d2648a272c1309 [0,2,0,0,0,0|2,0,0]=4 3127 B12R1.50 CCC(C)Oc1cccc(n1)Br 5e51c0ee115824bdb7404a2b4678fc74 [0,2,0,0,0,0|1,0,0]=3 3128 B12R1.50 CCC(C)Oc1cccc(n1)C 378f6d8983d81f2e553e3ceddf6f5528 [0,2,0,0,0,0|1,0,0]=3 3129 B12R1.50 CCC(C)Oc1cccc(n1)F 46239b9700f039405da1d416ed1cb61b [0,2,0,0,0,0|1,0,0]=3 3130 B12R1.50 CCC(C)Oc1ccnc(n1)C 6483206f0bf220f80fa0a57e7639f74c [0,2,0,0,0,0|2,0,0]=4 3131 B12R1.50 CCC(C)Oc1ccnc(n1)Cl 4efeed540885552d10a74bb036e4ed6c [0,2,0,0,0,0|2,0,0]=4 3132 B12R1.50 CCC(C)Oc1cncc(n1)Br 9f1cd0d3da6e0d1855de66410cf2e088 [0,2,0,0,0,0|2,0,0]=4 3133 B12R1.50 CCC(C)Oc1cncc(n1)Cl 6ecbd2a87346d537c90c32fab2e0037e [0,2,0,0,0,0|2,0,0]=4 3134 B12R1.50 CCC(C)Oc1nccc(n1)Cl 730de58c50a1a50fb184b824617f4b7f [0,2,0,0,0,0|2,0,0]=4 3135 B12R1.50 CCC(C)Oc1nccc(n1)S 23ddccc7ee95b9062c4a485f4022fe7b [0,2,0,0,0,0|2,0,0]=4 3136 B12R1.50 CCN(C)Cc1cc(ccn1)Br 1fb06d19f610cab21b552ab6c3205555 [0,2,0,0,0,0|1,0,0]=3 3137 B12R1.50 CCN(C)Cc1cc(ccn1)C 552da8f98b85339246b76346d4f7bfd8 [0,2,0,0,0,0|1,0,0]=3 3138 B12R1.50 CCN(C)Cc1cc(ccn1)Cl 01eed5e27d9e193dcd916e7199d3cd2c [0,2,0,0,0,0|1,0,0]=3 3139 B12R1.50 CCN(C)Cc1cccc(c1)Br 0cfb611857c5cb7cc30f39c3873140b0 [0,2,0,0,0,0|2,0,0]=4 3140 B12R1.50 CCN(C)Cc1cccc(c1)C 53ad3a118e4ee122b8b7018696871a03 [0,2,0,0,0,0|2,0,0]=4 3141 B12R1.50 CCN(C)Cc1cccc(c1)Cl e6a716bb03372171d841e30f8f33fb19 [0,2,0,0,0,0|2,0,0]=4 3142 B12R1.50 CCN(C)Cc1cccc(c1)F f82e676ee923805ac44e861b9bf86187 [0,2,0,0,0,0|2,0,0]=4 3143 B12R1.50 CCN(C)Cc1cccc(c1)I e43924ee04038b2970f0d94ad73ebdd0 [0,2,0,0,0,0|2,0,0]=4 3144 B12R1.50 CCN(C)Cc1cccc(n1)Br 5b151f3a2dbfaf2167899a274fe63356 [0,2,0,0,0,0|1,0,0]=3 3145 B12R1.50 CCN(C)Cc1cccc(n1)C 15c62de6b5104fbd3e6be1d011ce253c [0,2,0,0,0,0|1,0,0]=3 3146 B12R1.50 CCN(C)Cc1cccc(n1)Cl 63dab0c51d3fc5293130846677bf01ea [0,2,0,0,0,0|1,0,0]=3 3147 B12R1.50 CCN(C)Cc1cccc(n1)F 52dc19a6c15da45b30b96f4620b5f065 [0,2,0,0,0,0|1,0,0]=3 3148 B12R1.50 CCN(C)Cc1ccnc(n1)Cl 956dc4e9e09a4c64bfead7a24b0da02c [0,2,0,0,0,0|2,0,0]=4 3149 B12R1.50 CCN(C)Cc1nccc(n1)C 346e15f599ca64998788bc2b1e0ed05f [0,2,0,0,0,0|2,0,0]=4 3150 B12R1.50 CC[C@@H](C)Nc1cccc(c1)C 45d939f81c7b7d38cc39ca453cc6d8b9 [0,2,0,0,0,0|2,0,0]=4 3151 B12R1.50 CC[C@H](C)Nc1cccc(c1)C 5181036d0ad680b57bb138220216ae0c [0,2,0,0,0,0|2,0,0]=4 3152 B12R1.50 CN(C=O)Cc1cc(ccn1)Cl ec9cbf3758162a86020967befac156ee [0,2,0,0,0,0|1,0,1]=4 3153 B12R1.50 CN(C=O)Cc1cccc(n1)Br 3ca7c0da6755b324a1f0ce8f37bf410a [0,2,0,0,0,0|1,0,1]=4 3154 B12R1.50 CN(CF)Cc1cc(ccn1)Cl 7164149dcf0e947fdf9cb03cc55e7aa7 [0,2,0,0,0,0|1,0,0]=3 3155 B12R1.50 CN(CF)Cc1cccc(c1)Br 6775fcdab4ed66eef72cf962bfbcd2bd [0,2,0,0,0,0|2,0,0]=4 3156 B12R1.50 CN(CF)Cc1cccc(c1)Cl 47b8e773794dda913d7489d774847e23 [0,2,0,0,0,0|2,0,0]=4 3157 B12R1.50 CN(CF)Cc1cccc(c1)F fddef7f62e811634383c4be44d3ad4c2 [0,2,0,0,0,0|2,0,0]=4 3158 B12R1.50 CN(CF)Cc1cccc(c1)I ba46f25f84a9adbaee66606d056f8d9f [0,2,0,0,0,0|2,0,0]=4 3159 B12R1.50 CN(CO)Cc1cc(ccn1)Cl f11bb6e783514016814a663278294af9 [0,2,0,0,0,0|1,0,0]=3 3160 B12R1.50 CN(CO)Cc1cccc(c1)Br 598209607c72aa6d8108b132f4b46d7e [0,2,0,0,0,0|2,0,0]=4 3161 B12R1.50 CN(CO)Cc1cccc(c1)Cl 2945da4e469cee97956e9210dfcdfe64 [0,2,0,0,0,0|2,0,0]=4 3162 B12R1.50 CN(CO)Cc1cccc(c1)F 6a7f560609911b9b7b05731cdc2a168a [0,2,0,0,0,0|2,0,0]=4 3163 B12R1.50 CN(CO)Cc1cccc(c1)I f120238df6abba66af1a68aaee18110e [0,2,0,0,0,0|2,0,0]=4 3164 B12R1.50 CN(CO)Cc1cccc(n1)Br d3ae22e02e1855166dd2fa95834d7f8b [0,2,0,0,0,0|1,0,0]=3 3165 B12R1.50 C[C@@H](CO)Nc1cc(ccn1)Br ad61851c051c125d5694d6a575c498ad [0,2,0,0,0,0|1,0,0]=3 3166 B12R1.50 C[C@@H](CO)Nc1cc(ccn1)F b5b2f8636267af7c9663189207d797c9 [0,2,0,0,0,0|1,0,0]=3 3167 B12R1.50 C[C@@H](CO)Nc1cc(ccn1)I 32f7d49c7fdb0f6ee00927febb40e03c [0,2,0,0,0,0|1,0,0]=3 3168 B12R1.50 C[C@@H](CO)Nc1cc(cnn1)Br 9b19974d1f86547bc391777711f2bf61 [0,2,0,0,0,0|2,0,0]=4 3169 B12R1.50 C[C@@H](CO)Nc1cc(cnn1)Cl e7bd8fe085cb8dfe1576fe000e91a355 [0,2,0,0,0,0|2,0,0]=4 3170 B12R1.50 C[C@@H](CO)Nc1cc(ncn1)Br ffad70f7b56886985432b2a0650180eb [0,2,0,0,0,0|2,0,0]=4 3171 B12R1.50 C[C@@H](CO)Nc1cc(ncn1)Cl c896423550262d24f4a36c84ad981046 [0,2,0,0,0,0|2,0,0]=4 3172 B12R1.50 C[C@@H](CO)Nc1cc(ncn1)F aaac879797d3806afdafb10eecc41b05 [0,2,0,0,0,0|2,0,0]=4 3173 B12R1.50 C[C@@H](CO)Nc1cc(ncn1)I 7d99fa60be1ea3491db2630cb0cb7776 [0,2,0,0,0,0|2,0,0]=4 3174 B12R1.50 C[C@@H](CO)Nc1cc[nH]c(=O)n1 be3f5c5acb314e8dc3acb40d4556ffef [0,2,0,0,0,0|2,0,0]=4 3175 B12R1.50 C[C@@H](CO)Nc1cccc(c1)Br e12c135b7138e7c817f229b4b8639d64 [0,2,0,0,0,0|2,0,0]=4 3176 B12R1.50 C[C@@H](CO)Nc1cccc(c1)Cl b6aa20cbf8f24853667a022c40a8057e [0,2,0,0,0,0|2,0,0]=4 3177 B12R1.50 C[C@@H](CO)Nc1cccc(c1)F c93de07c16abf3a73ffced01d0a7bfc9 [0,2,0,0,0,0|2,0,0]=4 3178 B12R1.50 C[C@@H](CO)Nc1cccc(c1)I 63762b133b4c8dcbd72ab2f4bdb23f98 [0,2,0,0,0,0|2,0,0]=4 3179 B12R1.50 C[C@@H](CO)Nc1ccnc(n1)Br 5df734d72d3184d51a818fb877c816d2 [0,2,0,0,0,0|2,0,0]=4 3180 B12R1.50 C[C@@H](CO)Nc1ccnc(n1)Cl 798a13f359b939a01f1aaf967ce1e17f [0,2,0,0,0,0|2,0,0]=4 3181 B12R1.50 C[C@@H](CO)Nc1ccnc(n1)F 70614edaf15e6be6144c3f421c6ffebc [0,2,0,0,0,0|2,0,0]=4 3182 B12R1.50 C[C@@H](CO)Nc1cncc(n1)F 51e18f40d342707d7d54e8f643f5c266 [0,2,0,0,0,0|2,0,0]=4 3183 B12R1.50 C[C@@H](CO)Nc1nccc(=O)[nH]1 a136a91335743d7781fab033629aa626 [0,2,0,0,0,0|2,0,0]=4 3184 B12R1.50 C[C@@H](CO)Nc1nccc(n1)Br 68877cd5e49f8f71c2008ecc6335350e [0,2,0,0,0,0|2,0,0]=4 3185 B12R1.50 C[C@@H](CO)Nc1nccc(n1)Cl 945d4c973da71e796cff61a9865c5036 [0,2,0,0,0,0|2,0,0]=4 3186 B12R1.50 C[C@@H](CO)Nc1nccc(n1)F 2e15b0488d27e513aa5b459b40e78dd0 [0,2,0,0,0,0|2,0,0]=4 3187 B12R1.50 C[C@@H](CO)Nc1nccc(n1)I e64b5191d87bff48364f3dcdd854fe1a [0,2,0,0,0,0|2,0,0]=4 3188 B12R1.50 C[C@H](C=O)Nc1cc(ccn1)Br b0e6ee2822e84708be9a4c7ac32cb08d [0,2,0,0,0,0|1,0,1]=4 3189 B12R1.50 C[C@H](C=O)Nc1cc(ccn1)Cl 307f89a1d21c957e28cd3c10220c6447 [0,2,0,0,0,0|1,0,1]=4 3190 B12R1.50 C[C@H](C=O)Nc1cc(ccn1)F b3fafd2d629ab9bc2f17c40afd4d1e26 [0,2,0,0,0,0|1,0,1]=4 3191 B12R1.50 C[C@H](C=O)Nc1cc(ccn1)I cbc4971768024f3a6033c8a1fc5541f5 [0,2,0,0,0,0|1,0,1]=4 3192 B12R1.50 C[C@H](C=O)Nc1cccc(n1)Br 164898cd703fd53ed8e6f25161acfad0 [0,2,0,0,0,0|1,0,1]=4 3193 B12R1.50 C[C@H](C=O)Nc1cccc(n1)Cl da8a400a6edb522535f5408a9cb12eba [0,2,0,0,0,0|1,0,1]=4 3194 B12R1.50 C[C@H](C=O)Nc1cccc(n1)F 5078a43bdd4335449006f10738b7d80b [0,2,0,0,0,0|1,0,1]=4 3195 B12R1.50 C[C@H](C=O)Nc1cccc(n1)I 9ab2b8636be613a29851bc4a3da18dc2 [0,2,0,0,0,0|1,0,1]=4 3196 B12R1.50 C[C@H](C=O)Oc1cc(ccn1)Br c914581255a0ff83ee1e191d8fbfbeb8 [0,2,0,0,0,0|1,0,1]=4 3197 B12R1.50 C[C@H](C=O)Oc1cc(ccn1)Cl 063f7d50fd07561db9a0148dd6ae4068 [0,2,0,0,0,0|1,0,1]=4 3198 B12R1.50 C[C@H](C=O)Oc1cc(ccn1)F 1d1f93360ea85ddd393b94760a46e6ed [0,2,0,0,0,0|1,0,1]=4 3199 B12R1.50 C[C@H](C=O)Oc1cccc(n1)Br 9b3cbfccbebbf0382dd43e2a4bd58cc6 [0,2,0,0,0,0|1,0,1]=4 3200 B12R1.50 C[C@H](C=O)Oc1cccc(n1)F b42bbe9b6fff33bdcd648be0f89a51de [0,2,0,0,0,0|1,0,1]=4 3201 B12R1.50 C[C@H](CO)Nc1cc(ccn1)Br d99999c237948d766fb7d5fdc8e6adbc [0,2,0,0,0,0|1,0,0]=3 3202 B12R1.50 C[C@H](CO)Nc1cc(ccn1)F d90d1d34a7312c3add16362237114a7f [0,2,0,0,0,0|1,0,0]=3 3203 B12R1.50 C[C@H](CO)Nc1cc(ccn1)I d7fb66eb22eb6d55215ed51cece958c1 [0,2,0,0,0,0|1,0,0]=3 3204 B12R1.50 C[C@H](CO)Nc1cc(cnn1)Br a57db20979a8bb81f06fb8a6b3a4828a [0,2,0,0,0,0|2,0,0]=4 3205 B12R1.50 C[C@H](CO)Nc1cc(cnn1)Cl af96b56f51f820119c0bb5d83bac6a4a [0,2,0,0,0,0|2,0,0]=4 3206 B12R1.50 C[C@H](CO)Nc1cc(ncn1)Br 347aaa0dd5051754cfab5312f8b84153 [0,2,0,0,0,0|2,0,0]=4 3207 B12R1.50 C[C@H](CO)Nc1cc(ncn1)Cl 9163ff68b6c6e69071f919393af02ffc [0,2,0,0,0,0|2,0,0]=4 3208 B12R1.50 C[C@H](CO)Nc1cc(ncn1)F 3ae18c40abd8f3b0283bc1e452be486c [0,2,0,0,0,0|2,0,0]=4 3209 B12R1.50 C[C@H](CO)Nc1cc(ncn1)I 41e822cb6c0edfca6af8623e1a673073 [0,2,0,0,0,0|2,0,0]=4 3210 B12R1.50 C[C@H](CO)Nc1cc[nH]c(=O)n1 8c44dd11aa893088c49a98a6812d3309 [0,2,0,0,0,0|2,0,0]=4 3211 B12R1.50 C[C@H](CO)Nc1cccc(c1)Br caa603dbf3d611872408e6a5a99c2208 [0,2,0,0,0,0|2,0,0]=4 3212 B12R1.50 C[C@H](CO)Nc1cccc(c1)Cl d80340fe9b92189a6899bc5d360147f0 [0,2,0,0,0,0|2,0,0]=4 3213 B12R1.50 C[C@H](CO)Nc1cccc(c1)F 8c3d08c899d303dc21916719c2ded833 [0,2,0,0,0,0|2,0,0]=4 3214 B12R1.50 C[C@H](CO)Nc1cccc(c1)I e332daa1e085ab96b6afa02650eceef0 [0,2,0,0,0,0|2,0,0]=4 3215 B12R1.50 C[C@H](CO)Nc1ccnc(n1)Br b34fc9376cfaf9a6a87d85fa7b24f4ba [0,2,0,0,0,0|2,0,0]=4 3216 B12R1.50 C[C@H](CO)Nc1ccnc(n1)Cl abc33e12b6b83ea8ed47487d75b08ac2 [0,2,0,0,0,0|2,0,0]=4 3217 B12R1.50 C[C@H](CO)Nc1ccnc(n1)F a1b572d8135f44ce55900ee0353d9447 [0,2,0,0,0,0|2,0,0]=4 3218 B12R1.50 C[C@H](CO)Nc1cncc(n1)F 71e34ea1665dc811c735da5caeb596fd [0,2,0,0,0,0|2,0,0]=4 3219 B12R1.50 C[C@H](CO)Nc1nccc(=O)[nH]1 f057bbaa532b816123a38b45b270bfc9 [0,2,0,0,0,0|2,0,0]=4 3220 B12R1.50 C[C@H](CO)Nc1nccc(n1)Br 4c77178dd8e6c33e6d0697dea4485c89 [0,2,0,0,0,0|2,0,0]=4 3221 B12R1.50 C[C@H](CO)Nc1nccc(n1)Cl 1248ac0128f19aa6ff391e579f6ec0c0 [0,2,0,0,0,0|2,0,0]=4 3222 B12R1.50 C[C@H](CO)Nc1nccc(n1)F d1d56aaad8ba8b32436690e542eb0583 [0,2,0,0,0,0|2,0,0]=4 3223 B12R1.50 C[C@H](CO)Nc1nccc(n1)I c2bc75c5e7628bae9846307dcf5512b2 [0,2,0,0,0,0|2,0,0]=4 3224 B12R1.50 Cc1cc(ncn1)NC(C)CO 4801dfe2b12a87c18fbd55bbf3fc107a [0,2,0,0,0,0|2,0,0]=4 3225 B12R1.50 Cc1cc(ncn1)N[C@@H](C)CO a3809db2b080a5c58fe31fc3dd85eff9 [0,2,0,0,0,0|2,0,0]=4 3226 B12R1.50 Cc1cc(ncn1)N[C@H](C)CO 96516fcce4113460c7e756b509da6fb8 [0,2,0,0,0,0|2,0,0]=4 3227 B12R1.50 Cc1cccc(c1)CN(C)CF 609d411a38c58a3e2228564e503d49d3 [0,2,0,0,0,0|2,0,0]=4 3228 B12R1.50 Cc1cccc(c1)CN(C)CO 9ce835e7a7f8a76d68ac785fdcc22b43 [0,2,0,0,0,0|2,0,0]=4 3229 B12R1.50 Cc1cccc(c1)NC(C)CO c23f82ac252bf3ee5441826bde19dba5 [0,2,0,0,0,0|2,0,0]=4 3230 B12R1.50 Cc1cccc(c1)N[C@@H](C)CO b575cd99ac56e48b2608cbaccd98fff4 [0,2,0,0,0,0|2,0,0]=4 3231 B12R1.50 Cc1cccc(c1)N[C@H](C)CO 8c38b6b94b7f7840ff18f43638e4f1b0 [0,2,0,0,0,0|2,0,0]=4 3232 B12R1.50 Cc1cccc(n1)CN(C)C=O 3281b7fd78359b7634177c7cfae85f90 [0,2,0,0,0,0|1,0,1]=4 3233 B12R1.50 Cc1cccc(n1)CN(C)CF 3d017f15b6cce60c29a68141d49c139a [0,2,0,0,0,0|1,0,0]=3 3234 B12R1.50 Cc1cccc(n1)CN(C)CO 8bd5bb4e8b9ae489a1030c646b528e3a [0,2,0,0,0,0|1,0,0]=3 3235 B12R1.50 Cc1cccc(n1)NC(C)C=O dce4d1919fa605d890ed4cce740ea36d [0,2,0,0,0,0|1,0,1]=4 3236 B12R1.50 Cc1cccc(n1)NC(C)CO 45bab502bddd24a4fe806c81b040a3c6 [0,2,0,0,0,0|1,0,0]=3 3237 B12R1.50 Cc1cccc(n1)N[C@H](C)C=O fd7b368eb79b70997252331f9cf3e4d1 [0,2,0,0,0,0|1,0,1]=4 3238 B12R1.50 Cc1cccc(n1)OC(C)C=O 29b8b8d01f683373da9311ecf9aecdd1 [0,2,0,0,0,0|1,0,1]=4 3239 B12R1.50 Cc1cccc(n1)O[C@H](C)C=O e7ad74965e42692dea93967fed153496 [0,2,0,0,0,0|1,0,1]=4 3240 B12R1.50 Cc1ccnc(c1)CN(C)C=O df39001c5abea9e3f24ec884ca490e84 [0,2,0,0,0,0|1,0,1]=4 3241 B12R1.50 Cc1ccnc(c1)CN(C)CF 82100b01a2e38e871a3ce2745f366fd1 [0,2,0,0,0,0|1,0,0]=3 3242 B12R1.50 Cc1ccnc(c1)CN(C)CO e7b9333f2a8ba87271a9d6bb4164b7c9 [0,2,0,0,0,0|1,0,0]=3 3243 B12R1.50 Cc1ccnc(c1)NC(C)C=O 5eea0242ce4b4bd6764679b0321b8350 [0,2,0,0,0,0|1,0,1]=4 3244 B12R1.50 Cc1ccnc(c1)NC(C)CO e96b903edfe1b8f4df8295dcfd62c601 [0,2,0,0,0,0|1,0,0]=3 3245 B12R1.50 Cc1ccnc(c1)N[C@@H](C)CO 5fafaaeda45da0ad3cefa424d4e6e230 [0,2,0,0,0,0|1,0,0]=3 3246 B12R1.50 Cc1ccnc(c1)N[C@H](C)C=O 9f7dcb3ecea276af50b704c53427a4ec [0,2,0,0,0,0|1,0,1]=4 3247 B12R1.50 Cc1ccnc(c1)N[C@H](C)CO 2323fcbf1c7dc53f44ee76c516b12bc5 [0,2,0,0,0,0|1,0,0]=3 3248 B12R1.50 Cc1ccnc(c1)OC(C)C=O edb6133341352a9d98f23b87ab59236b [0,2,0,0,0,0|1,0,1]=4 3249 B12R1.50 Cc1ccnc(c1)O[C@H](C)C=O 3c72084d1ad98da810f8a34d1a99a2b0 [0,2,0,0,0,0|1,0,1]=4 3250 B12R1.50 Cc1ccnc(n1)CN(C)CF 1b9667a3dc4ee461895ea2c2f3a5f3c4 [0,2,0,0,0,0|2,0,0]=4 3251 B12R1.50 Cc1ccnc(n1)CN(C)CO 57e0b89fd3b4dd79cea5610619463e5f [0,2,0,0,0,0|2,0,0]=4 3252 B12R1.50 Cc1ccnc(n1)NC(C)CO f94188c676642d9bba124fea701623b9 [0,2,0,0,0,0|2,0,0]=4 3253 B12R1.50 Cc1ccnc(n1)N[C@@H](C)CO e5906f6ba7f0d67dbd1d6f3861d10657 [0,2,0,0,0,0|2,0,0]=4 3254 B12R1.50 Cc1ccnc(n1)N[C@H](C)CO 64156d3fd220847fbd350fc1a3bf1dca [0,2,0,0,0,0|2,0,0]=4 3255 B12R1.50 Cc1cncc(n1)NC(C)CO 5baff5a797c9456588032d08240f384b [0,2,0,0,0,0|2,0,0]=4 3256 B12R1.50 Cc1cncc(n1)N[C@@H](C)CO b66a09738483f7d2f1e9245eaa7b7563 [0,2,0,0,0,0|2,0,0]=4 3257 B12R1.50 Cc1cncc(n1)N[C@H](C)CO 6f0389ddbd90baa601aec1d0d2d2a0bc [0,2,0,0,0,0|2,0,0]=4 3258 B12R1.50 Cc1cnnc(c1)NC(C)CO d7ecc1d3d87af0bc9ce64a823a30311d [0,2,0,0,0,0|2,0,0]=4 3259 B12R1.50 Cc1cnnc(c1)N[C@@H](C)CO 83a06a6144d82f0e88b55e602d4cd87a [0,2,0,0,0,0|2,0,0]=4 3260 B12R1.50 Cc1cnnc(c1)N[C@H](C)CO 5bfcf88168f29417aa7cb622ea13fcc7 [0,2,0,0,0,0|2,0,0]=4 3261 B12R1.50 Cc1nccc(n1)NC(C)CO c02bd76ee50a4a0ae498cc88f006ce93 [0,2,0,0,0,0|2,0,0]=4 3262 B12R1.50 Cc1nccc(n1)N[C@@H](C)CO 2630a1dccec551b4c7c3b201e8c9bf65 [0,2,0,0,0,0|2,0,0]=4 3263 B12R1.50 Cc1nccc(n1)N[C@H](C)CO 09f75b309f2fc319972dbb9a49a54543 [0,2,0,0,0,0|2,0,0]=4 3264 B12R1.118 C=C[C@@H](CO)Nc1ccccn1 b329b423406d8ba6908d52526853a73b [0,2,0,0,0,0|1,0,1]=4 3265 B12R1.118 CCC(C=O)Nc1ccccn1 2aca9ef2fc34cfed6c8d70ea766b8b1c [0,2,0,0,0,0|1,0,1]=4 3266 B12R1.118 CCC(C=O)Oc1ccccn1 c237ce22bb3dec565cc31430edd943de [0,2,0,0,0,0|1,0,1]=4 3267 B12R1.118 CCC(CC)Nc1ccccc1 62a5bbda4663c06f44e205dbfccb7cfa [0,2,0,0,0,0|2,0,0]=4 3268 B12R1.118 CCC(CC)Nc1ccccn1 f49e7f296a5962a94c0c5ee1a9955043 [0,2,0,0,0,0|1,0,0]=3 3269 B12R1.118 CCC(CC)Nc1cccnn1 c05a7b33409569d5823119a26a6e1ae5 [0,2,0,0,0,0|2,0,0]=4 3270 B12R1.118 CCC(CC)Nc1ccncn1 9a3602bd19fced3e20e61d12c8e58976 [0,2,0,0,0,0|2,0,0]=4 3271 B12R1.118 CCC(CC)Nc1cnccn1 b5b9f23c79921a8a4bc5cd3687fa5cac [0,2,0,0,0,0|2,0,0]=4 3272 B12R1.118 CCC(CC)Nc1ncccn1 0e13bd5a3132c2748f0d72b848629772 [0,2,0,0,0,0|2,0,0]=4 3273 B12R1.118 CCC(CC)Oc1ccccn1 f5c416138eaed35a265a3babf42f340b [0,2,0,0,0,0|1,0,0]=3 3274 B12R1.118 CCC(CC)Oc1cnccn1 8731edf5eac93888bbdbfe27777036cc [0,2,0,0,0,0|2,0,0]=4 3275 B12R1.118 CCC(CC)Oc1ncccn1 7dd64d43494e383985eb2e95d0c6a798 [0,2,0,0,0,0|2,0,0]=4 3276 B12R1.118 CCC(CO)Nc1ccccc1 4bbd0090e2c789b85e6c79fc920a972e [0,2,0,0,0,0|2,0,0]=4 3277 B12R1.118 CCC(CO)Nc1ccccn1 2181b4d61311c9e330e2e4a095a20d89 [0,2,0,0,0,0|1,0,0]=3 3278 B12R1.118 CCC(CO)Nc1cccnn1 aa4f1b4b3490a41b5e78e6882708cb10 [0,2,0,0,0,0|2,0,0]=4 3279 B12R1.118 CCC(CO)Nc1ccncn1 c4491644b60578afbe910ba96ee5fa8f [0,2,0,0,0,0|2,0,0]=4 3280 B12R1.118 CCC(CO)Nc1cnccn1 4afe7a15c995405daaa15ad7386ebd34 [0,2,0,0,0,0|2,0,0]=4 3281 B12R1.118 CCC(CO)Nc1ncccn1 2f69733dcd97b6dbe736debd8a2681ac [0,2,0,0,0,0|2,0,0]=4 3282 B12R1.118 CCN(C=O)Cc1ccccn1 b215252a15e4b5709b8ee0b7a35e4b18 [0,2,0,0,0,0|1,0,1]=4 3283 B12R1.118 CCN(CC)Cc1ccccn1 428ad89117114047b9bb0857c0f58549 [0,2,0,0,0,0|1,0,0]=3 3284 B12R1.118 CCN(CC)Cc1ncccn1 511bbb847cd044a1729cdb0cad7b821c [0,2,0,0,0,0|2,0,0]=4 3285 B12R1.118 CCN(CF)Cc1ccccn1 39885a5b2fcc19188b9867999b2dd5ce [0,2,0,0,0,0|1,0,0]=3 3286 B12R1.118 CCN(CF)Cc1ncccn1 5b31152aba81f5d906763cbacaf79842 [0,2,0,0,0,0|2,0,0]=4 3287 B12R1.118 CCN(CO)Cc1ccccn1 8e76f32a0ced6146e44e26ac9887661d [0,2,0,0,0,0|1,0,0]=3 3288 B12R1.118 CCN(CO)Cc1ncccn1 5b99d738af8719bfb0dd7b6ba63cd64b [0,2,0,0,0,0|2,0,0]=4 3289 B12R1.118 CC[C@@H](CO)Nc1ccccc1 4e6d1044dff6b69bba19855888009bcf [0,2,0,0,0,0|2,0,0]=4 3290 B12R1.118 CC[C@H](CO)Nc1ccccc1 6e84965dfbcccf2d9d399d53a4428cff [0,2,0,0,0,0|2,0,0]=4 3291 B12R1.118 OCC(CO)Nc1ccccc1 c6d188a322ff4dea1d0ad1799b765f49 [0,2,0,0,0,0|2,0,0]=4 3292 B12R1.118 OCC(CO)Nc1ccccn1 f8671496cdd0b9ae31b2e86215c96510 [0,2,0,0,0,0|1,0,0]=3 3293 B12R1.118 OCC(CO)Nc1cccnn1 82ceda4ea3e3209106acab41ad51169c [0,2,0,0,0,0|2,0,0]=4 3294 B12R1.118 OCC(CO)Nc1ccncn1 b561c7232004a6098e88c39eb5ae88cf [0,2,0,0,0,0|2,0,0]=4 3295 B12R1.118 OCC(CO)Nc1cnccn1 a2bd9f09fd055c25373ab5d4335a2b4a [0,2,0,0,0,0|2,0,0]=4 3296 B12R1.118 OCC(CO)Nc1ncccn1 8479b4baa7add29b3e95f1c45068c7a1 [0,2,0,0,0,0|2,0,0]=4 3297 B12R1.118 OCC(CO)Oc1ccccn1 cb1ffcdcac9e8fd5fe395e88ed50b040 [0,2,0,0,0,0|1,0,0]=3 3298 B12R1.118 OCC(CO)Oc1cnccn1 fa620649ca809d7a35d2b193e63c3c8a [0,2,0,0,0,0|2,0,0]=4 3299 B12R1.118 OCC(CO)Oc1ncccn1 385713323bb3a9fa397c419673736494 [0,2,0,0,0,0|2,0,0]=4 3300 B12R1.194 CC(C)(CF)Nc1ccccc1 b6beb5eadcdeb337f0158c8ad0d8b555 [0,2,0,0,0,0|2,0,0]=4 3301 B12R1.194 CC(C)(CO)Nc1ccccc1 30670d11326256bdda695fca46d82a64 [0,2,0,0,0,0|2,0,0]=4 3302 B12R1.194 CC(C)(CO)Nc1ccncn1 9dc8a19ce972da789943672fd553a2d8 [0,2,0,0,0,0|2,0,0]=4 3303 B12R1.194 CCC(C)(C)Nc1ccccc1 17a09be9f9cdec5da28d382a8493f798 [0,2,0,0,0,0|2,0,0]=4 3304 B12R1.371 C#CC(C)Nc1ncccc1I 45ece0c43e244d4435e144ee9537325b [0,2,0,0,0,0|1,0,1]=4 3305 B12R1.371 C=CC(C)Nc1ncccc1Br 01f370f0c2833d42e0f9c6661a806f1c [0,2,0,0,0,0|1,0,1]=4 3306 B12R1.371 C=CC(C)Nc1ncccc1C d7065bf7b72751fd5aea954303be8efa [0,2,0,0,0,0|1,0,1]=4 3307 B12R1.371 C=CC(C)Nc1ncccc1Cl da951fedd975bdbcb00bcc6d8aa27bdd [0,2,0,0,0,0|1,0,1]=4 3308 B12R1.371 C=CC(C)Nc1ncccc1F 4a644b7a6c779f55a3942c705b33c2f1 [0,2,0,0,0,0|1,0,1]=4 3309 B12R1.371 C=CC(C)Nc1ncccc1I f3662cf3822bc4bcf3ece259917fbc24 [0,2,0,0,0,0|1,0,1]=4 3310 B12R1.371 C=CC(C)Nc1ncccc1O 67ab0a2c18f66c7334974021caabe099 [0,2,0,0,0,0|1,0,1]=4 3311 B12R1.371 C=CC(C)Oc1ncccc1Br c7f9d9bee1c4753d20564c2e0395885c [0,2,0,0,0,0|1,0,1]=4 3312 B12R1.371 C=CC(C)Oc1ncccc1C 4fa6da2fec094ead2dd2d45f7d922b3a [0,2,0,0,0,0|1,0,1]=4 3313 B12R1.371 C=CC(C)Oc1ncccc1Cl 82ba84d4d168bd24ce88093652f2c6c6 [0,2,0,0,0,0|1,0,1]=4 3314 B12R1.371 C=CC(C)Oc1ncccc1F 7a8e077ecd6a7aeff374668430224c49 [0,2,0,0,0,0|1,0,1]=4 3315 B12R1.371 CC(C=O)Nc1ncccc1Br d1ac1ac5654f43672523a4b4155c1756 [0,2,0,0,0,0|1,0,1]=4 3316 B12R1.371 CC(C=O)Nc1ncccc1Cl 7c18b45a3e397ea7a5704e57cb2129b2 [0,2,0,0,0,0|1,0,1]=4 3317 B12R1.371 CC(C=O)Nc1ncccc1F 8cb70d76c8739391f708b03f0c66140b [0,2,0,0,0,0|1,0,1]=4 3318 B12R1.371 CC(C=O)Nc1ncccc1I 79ec43887e273c72cd1c2d5d14b22893 [0,2,0,0,0,0|1,0,1]=4 3319 B12R1.371 CC(C=O)Oc1ncccc1Br 43e3ad0604b58faeba99ecac175b7e3c [0,2,0,0,0,0|1,0,1]=4 3320 B12R1.371 CC(C=O)Oc1ncccc1Cl 03fa3216df11060b0f4d48689cad7cc3 [0,2,0,0,0,0|1,0,1]=4 3321 B12R1.371 CC(C=O)Oc1ncccc1F 37c72899175328447f9128c54e62c15f [0,2,0,0,0,0|1,0,1]=4 3322 B12R1.371 CC(CO)Nc1cccc[n+]1[O-] 23888e15eb2ed4a36bfb52afe9030080 [0,2,0,0,0,0|1,0,1]=4 3323 B12R1.371 CC(CO)Nc1ccccc1F ab9abc3c7ad63ce6e7fb98c9c85f3edf [0,2,0,0,0,0|2,0,0]=4 3324 B12R1.371 CC(CO)Nc1ccccc1I 8db44cdfb97be4fe1b6791bb92fd08be [0,2,0,0,0,0|2,0,0]=4 3325 B12R1.371 CC(CO)Nc1ncc[nH]c1=O 55f3a3b0fcdf5ae8ca36237f1a54f75e [0,2,0,0,0,0|2,0,0]=4 3326 B12R1.371 CC(CO)Nc1ncccc1Br 0d2154c32e4dc4c3a1d0dbf22eaa816a [0,2,0,0,0,0|1,0,0]=3 3327 B12R1.371 CC(CO)Nc1ncccc1Cl c3c0d5c8b8379cb408946d600babf9d8 [0,2,0,0,0,0|1,0,0]=3 3328 B12R1.371 CC(CO)Nc1ncccc1F c21375de0e5c4e333dd2c7b3e972651f [0,2,0,0,0,0|1,0,0]=3 3329 B12R1.371 CC(CO)Nc1ncccc1I dc78d6f52d6882ea4a9a559957391067 [0,2,0,0,0,0|1,0,0]=3 3330 B12R1.371 CC(CO)Nc1nccnc1Br 41a5ca9bc2f252d9c8c0597d5368ee90 [0,2,0,0,0,0|2,0,0]=4 3331 B12R1.371 CC(CO)Nc1nccnc1Cl 4d08843b87dd8fb725a775233df819d9 [0,2,0,0,0,0|2,0,0]=4 3332 B12R1.371 CC(CO)Nc1nccnc1I 2b2a4a320db3ed8e38b2bf96c51d72b7 [0,2,0,0,0,0|2,0,0]=4 3333 B12R1.371 CC(CO)Nc1ncncc1Br 03b79b4dd46e2b12f45a262411b90f1e [0,2,0,0,0,0|2,0,0]=4 3334 B12R1.371 CC(CO)Nc1ncncc1I 307628e8852f09f78d6d874512a59d9b [0,2,0,0,0,0|2,0,0]=4 3335 B12R1.371 CCC(C)Nc1cccc[n+]1[O-] 96d26cc8fc0c47ab85568b0a768d417f [0,2,0,0,0,0|1,0,1]=4 3336 B12R1.371 CCC(C)Nc1ccccc1Cl de4bf505a5bbedeb31e8a75347207b67 [0,2,0,0,0,0|2,0,0]=4 3337 B12R1.371 CCC(C)Nc1ccccc1I cd67cc2bf7f4f6d6c61e47b710e1bb55 [0,2,0,0,0,0|2,0,0]=4 3338 B12R1.371 CCC(C)Nc1ccccc1S ecd9db41f3061f567fc7308b02ebdeed [0,2,0,0,0,0|2,0,0]=4 3339 B12R1.371 CCC(C)Nc1ncccc1Br fbb051f4e66e0b9d73cb5f6e2897342d [0,2,0,0,0,0|1,0,0]=3 3340 B12R1.371 CCC(C)Nc1ncccc1C 6bda26dd06cca79da4887c577174f95d [0,2,0,0,0,0|1,0,0]=3 3341 B12R1.371 CCC(C)Nc1ncccc1Cl f0b62e4fb467f95ad24224f169682733 [0,2,0,0,0,0|1,0,0]=3 3342 B12R1.371 CCC(C)Nc1ncccc1F b039468387a6c53ec865f9b4e39c3865 [0,2,0,0,0,0|1,0,0]=3 3343 B12R1.371 CCC(C)Nc1ncccc1I b6fdb25a4fdb352b2b974198fb23da2a [0,2,0,0,0,0|1,0,0]=3 3344 B12R1.371 CCC(C)Nc1nccnc1Br 391ace3ba46c36a5e28b36e3224162af [0,2,0,0,0,0|2,0,0]=4 3345 B12R1.371 CCC(C)Nc1nccnc1C 26d7499e1a5dfd793371d8cabb4973d3 [0,2,0,0,0,0|2,0,0]=4 3346 B12R1.371 CCC(C)Nc1nccnc1Cl 6bee06affd2b8f84eef2cb8101d441a8 [0,2,0,0,0,0|2,0,0]=4 3347 B12R1.371 CCC(C)Nc1nccnc1I fcc955fece6d39b93d820b90aac34256 [0,2,0,0,0,0|2,0,0]=4 3348 B12R1.371 CCC(C)Nc1ncncc1Br b8d2192508fcad347f377677607dd776 [0,2,0,0,0,0|2,0,0]=4 3349 B12R1.371 CCC(C)Nc1ncncc1Cl 288d77eb97396cd1aa5e1665ddd9cfc0 [0,2,0,0,0,0|2,0,0]=4 3350 B12R1.371 CCC(C)Nc1ncncc1I fbba32fb3cb25c58b1ec3632670f9283 [0,2,0,0,0,0|2,0,0]=4 3351 B12R1.371 CCC(C)Nc1nnccc1C 223b3d1087faa97e65d2d4bf7c1ef4e9 [0,2,0,0,0,0|2,0,0]=4 3352 B12R1.371 CCC(C)Oc1cccc[n+]1[O-] 194a2e1d3ccdaec10afca683ac5ba809 [0,2,0,0,0,0|1,0,1]=4 3353 B12R1.371 CCC(C)Oc1ccccc1C a9f8caaebcb535b77e0f35c5ea074362 [0,2,0,0,0,0|2,0,0]=4 3354 B12R1.371 CCC(C)Oc1ccccc1Cl 6f598d947434a44e209cdf34b797bf91 [0,2,0,0,0,0|2,0,0]=4 3355 B12R1.371 CCC(C)Oc1ccccc1F b533bd9cc207ae92fa5d1dd0e1595cbc [0,2,0,0,0,0|2,0,0]=4 3356 B12R1.371 CCC(C)Oc1ccccc1I 35e6ee1db321949fbb0c54358fea5b12 [0,2,0,0,0,0|2,0,0]=4 3357 B12R1.371 CCC(C)Oc1ccccc1S 430f323aec7886fe8f11d201c4780b84 [0,2,0,0,0,0|2,0,0]=4 3358 B12R1.371 CCC(C)Oc1ncccc1Br b6613f73c3384f08e0b3850d4b67c10a [0,2,0,0,0,0|1,0,0]=3 3359 B12R1.371 CCC(C)Oc1ncccc1C 0b77a9663b4b9ad1dcca90b8ca41ba15 [0,2,0,0,0,0|1,0,0]=3 3360 B12R1.371 CCC(C)Oc1ncccc1Cl fd2b11af8f8930f31b50edcdf7c67969 [0,2,0,0,0,0|1,0,0]=3 3361 B12R1.371 CCC(C)Oc1ncccc1F 88fd04e0122f2adda4feb1271f6b1dc0 [0,2,0,0,0,0|1,0,0]=3 3362 B12R1.371 CCC(C)Oc1nccnc1Br 18ac154d995d3762329e49138900b1bb [0,2,0,0,0,0|2,0,0]=4 3363 B12R1.371 CCC(C)Oc1nccnc1C b759fee9631070f452e4c12ac1c71564 [0,2,0,0,0,0|2,0,0]=4 3364 B12R1.371 CCC(C)Oc1ncncc1C 62064e498e100aaa7ff234c4c24ecdeb [0,2,0,0,0,0|2,0,0]=4 3365 B12R1.371 CCC(C)Oc1ncncc1Cl 749402471fca12f5af3317cf35de44a3 [0,2,0,0,0,0|2,0,0]=4 3366 B12R1.371 CCC(C)Oc1ncncc1F 55d161bdb9872cd8f6a8ae42816918c7 [0,2,0,0,0,0|2,0,0]=4 3367 B12R1.371 CCC(C)Oc1ncncc1I 13a46b28b96b8206939a3033c65a1af3 [0,2,0,0,0,0|2,0,0]=4 3368 B12R1.371 CCC(C)Oc1nnccc1C 6aa3069268c166d6d9e2b43b1d27a18f [0,2,0,0,0,0|2,0,0]=4 3369 B12R1.371 CCC(C)Oc1nnccc1Cl d60219bbd75cff5b057ddcea818805e4 [0,2,0,0,0,0|2,0,0]=4 3370 B12R1.371 CCC(C)Oc1nnccc1I 95730b57c00d28d7655eb0f73b3f8a3d [0,2,0,0,0,0|2,0,0]=4 3371 B12R1.371 CCN(C)Cc1ccccc1Cl e51c361dfc91d5636e1e5a4513a1b110 [0,2,0,0,0,0|2,0,0]=4 3372 B12R1.371 CCN(C)Cc1ccccc1F 7c051a9a85266df48aaa13dcfa2254cd [0,2,0,0,0,0|2,0,0]=4 3373 B12R1.371 CCN(C)Cc1ccccc1I 83032bc0e16de05a0971afc60500c87f [0,2,0,0,0,0|2,0,0]=4 3374 B12R1.371 CCN(C)Cc1ncccc1C 77502c9b0375d3a6d84249facbeaea62 [0,2,0,0,0,0|1,0,0]=3 3375 B12R1.371 CCN(C)Cc1ncccc1Cl a011dfba9497ae1f7b501cf84f81896a [0,2,0,0,0,0|1,0,0]=3 3376 B12R1.371 CCN(C)Cc1ncccc1F 7a35501b041d9bd6fe938bed905ff219 [0,2,0,0,0,0|1,0,0]=3 3377 B12R1.371 CCN(C)Cc1nccnc1C d9523029c9ee5f89dd45302a5ec1d35d [0,2,0,0,0,0|2,0,0]=4 3378 B12R1.371 CN(C=O)Cc1ncccc1F bb0a2b43aee786d1813a51687dd76159 [0,2,0,0,0,0|1,0,1]=4 3379 B12R1.371 CN(CF)Cc1ccccc1Cl 6ed036767b7fb14071dacefe6e13d31c [0,2,0,0,0,0|2,0,0]=4 3380 B12R1.371 CN(CF)Cc1ccccc1F a8bd67ba066085685e654ad08e1c2328 [0,2,0,0,0,0|2,0,0]=4 3381 B12R1.371 CN(CF)Cc1ccccc1I 3f50ee944367b71e9fe1367ce96f9fad [0,2,0,0,0,0|2,0,0]=4 3382 B12R1.371 CN(CF)Cc1ncccc1F 185d2d71a5c0940a384ea4fa0cbb6107 [0,2,0,0,0,0|1,0,0]=3 3383 B12R1.371 CN(CO)Cc1ccccc1Br 9ac13c39fec83267043e3355bc9d3c6e [0,2,0,0,0,0|2,0,0]=4 3384 B12R1.371 CN(CO)Cc1ccccc1Cl 2fb26837977d5eacf5cb47738766ffa1 [0,2,0,0,0,0|2,0,0]=4 3385 B12R1.371 CN(CO)Cc1ccccc1F 661f3a9dbe61fe63a175ae38e8094802 [0,2,0,0,0,0|2,0,0]=4 3386 B12R1.371 CN(CO)Cc1ccccc1I fd2e6b3f5dd3915c1a3ff85b0c15f004 [0,2,0,0,0,0|2,0,0]=4 3387 B12R1.371 CN(CO)Cc1ncccc1F 28170e061fb7283dbfff316712dc8957 [0,2,0,0,0,0|1,0,0]=3 3388 B12R1.371 C[C@@H](CO)Nc1cccc[n+]1[O-] 788c9f9e795394d9b0b85ec475f1fff3 [0,2,0,0,0,0|1,0,1]=4 3389 B12R1.371 C[C@@H](CO)Nc1ccccc1F bc7a17b0246c7bfaa6b92e68ea47eff7 [0,2,0,0,0,0|2,0,0]=4 3390 B12R1.371 C[C@@H](CO)Nc1ccccc1I 4e52463ff6b81e76a206c779e1fbf0a0 [0,2,0,0,0,0|2,0,0]=4 3391 B12R1.371 C[C@@H](CO)Nc1ncc[nH]c1=O 9d12b87daf7ea0fe478391663c54a4b3 [0,2,0,0,0,0|2,0,0]=4 3392 B12R1.371 C[C@@H](CO)Nc1ncccc1Br 017cd05d431390be839fb3cc52e09b3d [0,2,0,0,0,0|1,0,0]=3 3393 B12R1.371 C[C@@H](CO)Nc1ncccc1Cl fe08519a870112c7bd81db5a28b7c9df [0,2,0,0,0,0|1,0,0]=3 3394 B12R1.371 C[C@@H](CO)Nc1ncccc1F 19206a97545c27f362d4924a75300e0a [0,2,0,0,0,0|1,0,0]=3 3395 B12R1.371 C[C@@H](CO)Nc1ncccc1I 136819d4b70145070292091b149e8fd3 [0,2,0,0,0,0|1,0,0]=3 3396 B12R1.371 C[C@@H](CO)Nc1nccnc1Br 93453409d53e5fe2de3971f477b37dfe [0,2,0,0,0,0|2,0,0]=4 3397 B12R1.371 C[C@@H](CO)Nc1nccnc1Cl d1756166d2a4162d2f802803455261ed [0,2,0,0,0,0|2,0,0]=4 3398 B12R1.371 C[C@@H](CO)Nc1nccnc1I d51f4ad8e2d23f03d1e453208c6ec7b3 [0,2,0,0,0,0|2,0,0]=4 3399 B12R1.371 C[C@@H](CO)Nc1ncncc1Br bbaeaa1db102f6776eebcbe02cd19f8e [0,2,0,0,0,0|2,0,0]=4 3400 B12R1.371 C[C@@H](CO)Nc1ncncc1I 86e8ed78ac1381d7fc94ccf2aa3dc035 [0,2,0,0,0,0|2,0,0]=4 3401 B12R1.371 C[C@H](C=O)Nc1ncccc1Br 95d68a80a9c4f8042b5f82e4d4bac64c [0,2,0,0,0,0|1,0,1]=4 3402 B12R1.371 C[C@H](C=O)Nc1ncccc1Cl 0c37b739c7c39f7b0a11e59538e47932 [0,2,0,0,0,0|1,0,1]=4 3403 B12R1.371 C[C@H](C=O)Nc1ncccc1F f04f3bb29f73ed43c2c527d1ccd2fe7f [0,2,0,0,0,0|1,0,1]=4 3404 B12R1.371 C[C@H](C=O)Nc1ncccc1I 63728bb9ca44fa09230a080de74aa3d9 [0,2,0,0,0,0|1,0,1]=4 3405 B12R1.371 C[C@H](C=O)Oc1ncccc1Br cae5517c6b93479ebccb9d1d32e675c4 [0,2,0,0,0,0|1,0,1]=4 3406 B12R1.371 C[C@H](C=O)Oc1ncccc1Cl 3695e1f39ae8c3050f9ce1756f16f89c [0,2,0,0,0,0|1,0,1]=4 3407 B12R1.371 C[C@H](C=O)Oc1ncccc1F 7585acf94faaabc2ef477f1d35926924 [0,2,0,0,0,0|1,0,1]=4 3408 B12R1.371 C[C@H](CO)Nc1cccc[n+]1[O-] fe6641bf1731d15db79c5d61e1e755f9 [0,2,0,0,0,0|1,0,1]=4 3409 B12R1.371 C[C@H](CO)Nc1ccccc1F 636c9c06865906a75d3375bd72489d82 [0,2,0,0,0,0|2,0,0]=4 3410 B12R1.371 C[C@H](CO)Nc1ccccc1I aa96d8a3924e58569f2c3ab4fed9a92f [0,2,0,0,0,0|2,0,0]=4 3411 B12R1.371 C[C@H](CO)Nc1ncc[nH]c1=O 3393f5faef56b5078984b930577c14bf [0,2,0,0,0,0|2,0,0]=4 3412 B12R1.371 C[C@H](CO)Nc1ncccc1Br 59b244a11f38fc7402356973b49f9bdd [0,2,0,0,0,0|1,0,0]=3 3413 B12R1.371 C[C@H](CO)Nc1ncccc1Cl d87b6b51986bda935d95d1dff9ee4980 [0,2,0,0,0,0|1,0,0]=3 3414 B12R1.371 C[C@H](CO)Nc1ncccc1F 1c78156be14948ed5ff0b8dacdadcf5a [0,2,0,0,0,0|1,0,0]=3 3415 B12R1.371 C[C@H](CO)Nc1ncccc1I 47f602a2e27648b592334f3c311d61d5 [0,2,0,0,0,0|1,0,0]=3 3416 B12R1.371 C[C@H](CO)Nc1nccnc1Br 1483927f7016590fe2902907428363eb [0,2,0,0,0,0|2,0,0]=4 3417 B12R1.371 C[C@H](CO)Nc1nccnc1Cl 8451145aafb8e154fddc687b27ca80d0 [0,2,0,0,0,0|2,0,0]=4 3418 B12R1.371 C[C@H](CO)Nc1nccnc1I 808dc898e334bf3ee8426aeba466446c [0,2,0,0,0,0|2,0,0]=4 3419 B12R1.371 C[C@H](CO)Nc1ncncc1Br 975fd6695f5436a07eb1c1d4f10f386a [0,2,0,0,0,0|2,0,0]=4 3420 B12R1.371 C[C@H](CO)Nc1ncncc1I e1fb54c2ffa3825babb743483f4d87e0 [0,2,0,0,0,0|2,0,0]=4 3421 B12R1.371 Cc1ccccc1CN(C)CF c4adb1d2d43ad8f4548a4d1e53228779 [0,2,0,0,0,0|2,0,0]=4 3422 B12R1.371 Cc1ccccc1CN(C)CO 63199def7303a7d9eb3beb52a0338d30 [0,2,0,0,0,0|2,0,0]=4 3423 B12R1.371 Cc1ccccc1NC(C)CO d135b508699b5774eadc8e5bb668b2c9 [0,2,0,0,0,0|2,0,0]=4 3424 B12R1.371 Cc1ccccc1N[C@@H](C)CO ca1b58b1899397ab399e5320d36d8569 [0,2,0,0,0,0|2,0,0]=4 3425 B12R1.371 Cc1ccccc1N[C@H](C)CO e0d94c7afbeca89e50d0334be68e4a7b [0,2,0,0,0,0|2,0,0]=4 3426 B12R1.371 Cc1cccnc1CN(C)C=O 8cd0d4a3b44193f08f9d3159d684e64c [0,2,0,0,0,0|1,0,1]=4 3427 B12R1.371 Cc1cccnc1CN(C)CF 59e3a680e8420f8d2b40f550bd244d69 [0,2,0,0,0,0|1,0,0]=3 3428 B12R1.371 Cc1cccnc1CN(C)CO 7595681a84f1518d909d7d748f5b97a3 [0,2,0,0,0,0|1,0,0]=3 3429 B12R1.371 Cc1cccnc1NC(C)C=O e664544991a3a98c6b16d24c03eec5ef [0,2,0,0,0,0|1,0,1]=4 3430 B12R1.371 Cc1cccnc1NC(C)CO 7f255753bb1c89a254ef796b4f882827 [0,2,0,0,0,0|1,0,0]=3 3431 B12R1.371 Cc1cccnc1N[C@@H](C)CO babcec4b79b7f1dea63ab1ae42ac667a [0,2,0,0,0,0|1,0,0]=3 3432 B12R1.371 Cc1cccnc1N[C@H](C)C=O ed828f3f000326f406444ce0802d16ea [0,2,0,0,0,0|1,0,1]=4 3433 B12R1.371 Cc1cccnc1N[C@H](C)CO 39948e51144728145513b0ea6ba22677 [0,2,0,0,0,0|1,0,0]=3 3434 B12R1.371 Cc1cccnc1OC(C)C=O bbb72dddcde61d9913e0439ed5af3140 [0,2,0,0,0,0|1,0,1]=4 3435 B12R1.371 Cc1cccnc1O[C@H](C)C=O ebe3ce918ef59d7560fe596d07c4c076 [0,2,0,0,0,0|1,0,1]=4 3436 B12R1.371 Cc1ccnnc1NC(C)CO f6cda52c7e5d8ea1d10a340811f3e33f [0,2,0,0,0,0|2,0,0]=4 3437 B12R1.371 Cc1ccnnc1N[C@@H](C)CO 809c6ad516c338e1746641354ac2e7ce [0,2,0,0,0,0|2,0,0]=4 3438 B12R1.371 Cc1ccnnc1N[C@H](C)CO 8b6c6db80a74baf7a0802260176978ea [0,2,0,0,0,0|2,0,0]=4 3439 B12R1.371 Cc1nccnc1NC(C)CO 7b19c829617907b2e92f40b72c3802db [0,2,0,0,0,0|2,0,0]=4 3440 B12R1.371 Cc1nccnc1N[C@@H](C)CO 70e451d54217408e7bf70212f195b7d6 [0,2,0,0,0,0|2,0,0]=4 3441 B12R1.371 Cc1nccnc1N[C@H](C)CO c8098ca7458a2dd2387626d20fe718db [0,2,0,0,0,0|2,0,0]=4 3442 B12R1.75 C#Cc1ccccc1NC(C)C bfd82a9d189fa7bb52f5fdd602beb28a [0,2,0,0,0,0|2,0,0]=4 3443 B12R1.75 C#Cc1ccccc1OC(C)C 5fb2785bb6f1845ea9d7399e4082f45c [0,2,0,0,0,0|2,0,0]=4 3444 B12R1.75 C#Cc1cccnc1NC(C)C c616c2d03912b878007ce061ec599395 [0,2,0,0,0,0|1,0,0]=3 3445 B12R1.75 C#Cc1cccnc1OC(C)C fb699c489bbb7d4049902edebcd08ea8 [0,2,0,0,0,0|1,0,0]=3 3446 B12R1.75 C#Cc1nccnc1NC(C)C f08fdafdc863bebbb1dcdfcc658bde0a [0,2,0,0,0,0|2,0,0]=4 3447 B12R1.75 C=Cc1ccccc1NC(C)C 995e7d4374b987994664cf5d8c4bc074 [0,2,0,0,0,0|2,0,0]=4 3448 B12R1.75 C=Cc1ccccc1OC(C)C d531882f2c23a56b1654c2b774a48133 [0,2,0,0,0,0|2,0,0]=4 3449 B12R1.75 CC(C)Nc1ccccc1C#N 348e21eb4884c996eb78d5c145f6019e [0,2,0,0,0,0|2,0,0]=4 3450 B12R1.75 CC(C)Nc1ccccc1C=O 1ea42160d99500f2f247d1c323ae97a3 [0,2,0,0,0,0|2,0,0]=4 3451 B12R1.75 CC(C)Nc1ccccc1CO af5c5fc98c450568aadbe8196cf0a208 [0,2,0,0,0,0|2,0,0]=4 3452 B12R1.75 CC(C)Nc1ccccc1CS 6950b8c71ea0a99d4719e22f4c9179fc [0,2,0,0,0,0|2,0,0]=4 3453 B12R1.75 CC(C)Nc1ncccc1C=O 10b88dd469e8cd7cf3eec994d0cb0812 [0,2,0,0,0,0|1,0,0]=3 3454 B12R1.75 CC(C)Nc1ncccc1CCl 8a7d31f915fa5718ba8a9b81ecaf7ff9 [0,2,0,0,0,0|1,0,0]=3 3455 B12R1.75 CC(C)Nc1ncccc1CO 81bb9204956ea4bb1cfd84af64a7060a [0,2,0,0,0,0|1,0,0]=3 3456 B12R1.75 CC(C)Nc1nccnc1C#N 80e4b27956278913f7d02d2fe219e38c [0,2,0,0,0,0|2,0,0]=4 3457 B12R1.75 CC(C)Nc1nccnc1C=O 5620ebe52980a7450def83a227cdba40 [0,2,0,0,0,0|2,0,0]=4 3458 B12R1.75 CC(C)Nc1nccnc1CO 42a6d31fa57d49bbf4b11e1fa004ee77 [0,2,0,0,0,0|2,0,0]=4 3459 B12R1.75 CC(C)Nc1ncncc1C=O 92f649d0d2a6aea172414ed7551a1a6d [0,2,0,0,0,0|2,0,0]=4 3460 B12R1.75 CC(C)Nc1ncncc1CO 359544d8ec60e0954c5c9cffd813701b [0,2,0,0,0,0|2,0,0]=4 3461 B12R1.75 CC(C)Nc1nnccc1C#N 16d974fb5ff0d8c8d36ad9a058572c45 [0,2,0,0,0,0|2,0,0]=4 3462 B12R1.75 CC(C)Oc1ccccc1C#N 7149e888e8961e276dfd552220244434 [0,2,0,0,0,0|2,0,0]=4 3463 B12R1.75 CC(C)Oc1ccccc1C=O fc188e20ae7067ec467c46f7640666a7 [0,2,0,0,0,0|2,0,0]=4 3464 B12R1.75 CC(C)Oc1ncncc1C#N c425762679f50957b9d746b3fcb9b84d [0,2,0,0,0,0|2,0,0]=4 3465 B12R1.75 CCc1ccccc1OC(C)C b797575d38ba5b9ee07e898e057c7852 [0,2,0,0,0,0|2,0,0]=4 3466 B12R1.75 CCc1cccnc1NC(C)C 074962f612db0044f1abd620b23f2388 [0,2,0,0,0,0|1,0,0]=3 3467 B12R1.75 CCc1cccnc1OC(C)C 5fee549730a9ae72f772ded465cf00c6 [0,2,0,0,0,0|1,0,0]=3 3468 B12R1.75 CCc1cncnc1OC(C)C 011e6c2d3d8080719bd0a9e61f0a99a1 [0,2,0,0,0,0|2,0,0]=4 3469 B12R1.75 CCc1nccnc1NC(C)C 77e2a813d30daf392e99d63a90c143c7 [0,2,0,0,0,0|2,0,0]=4 3470 B12R1.75 COc1ccccc1OC(C)C c1dcbb1f48c176cca0a792de0db2234a [0,2,0,0,0,0|2,0,0]=4 3471 B12R1.75 COc1cccnc1NC(C)C 4561726b47b322ff219016f29d055e69 [0,2,0,0,0,0|1,0,0]=3 3472 B12R1.75 COc1nccnc1NC(C)C 655de8cc36421b1edfe8c7c37440c49c [0,2,0,0,0,0|2,0,0]=4 3473 B12R1.75 CSc1ccccc1OC(C)C 8232f49eaf6b0b7ba6b339a5985799c9 [0,2,0,0,0,0|2,0,0]=4 3474 B12R1.75 CSc1cccnc1NC(C)C fcb68f01e332a1674f19fb865eb3622f [0,2,0,0,0,0|1,0,0]=3 3475 B12R1.127 CC(C)Nc1cc(ccc1Cl)Cl 3bc364d4a2a04cb63326e16ff866022c [0,2,0,0,0,0|2,0,0]=4 3476 B12R1.127 CC(C)Nc1cc(ccc1Cl)I 917594a9dfc86f00ad0b561acc198caf [0,2,0,0,0,0|2,0,0]=4 3477 B12R1.127 CC(C)Nc1cc(ccc1F)Cl f94d5f66f5469156e62d77a0d956c1b0 [0,2,0,0,0,0|2,0,0]=4 3478 B12R1.127 CC(C)Nc1cc(ccc1F)F a68abc104ca57449f291ba06b9ce4af9 [0,2,0,0,0,0|2,0,0]=4 3479 B12R1.127 CC(C)Nc1cc(ccc1F)I 61507874eea88c7732535bca188147a3 [0,2,0,0,0,0|2,0,0]=4 3480 B12R1.127 CC(C)Nc1cc(ccc1I)Br 49d2e6a2bb03a15f7ebff778427d5518 [0,2,0,0,0,0|2,0,0]=4 3481 B12R1.127 CC(C)Nc1cc(ccc1I)Cl 44969bf80dd7bc8463c2296b8456c08c [0,2,0,0,0,0|2,0,0]=4 3482 B12R1.127 CC(C)Nc1cc(ccc1I)F bcd4f3b11b33975920ae01347a0103b7 [0,2,0,0,0,0|2,0,0]=4 3483 B12R1.127 CC(C)Nc1cc(ccc1S)Cl 7e92bdc15e1e2c513a74a2baac6cf02e [0,2,0,0,0,0|2,0,0]=4 3484 B12R1.127 CC(C)Nc1nc(=O)[nH]cc1Cl 2805010245638bf7088d6b4e9eaeb58a [0,2,0,0,0,0|2,0,0]=4 3485 B12R1.127 CC(C)Nc1nc(=O)[nH]cc1I d1e87842c57eb01697326241d4f09d51 [0,2,0,0,0,0|2,0,0]=4 3486 B12R1.127 CC(C)Nc1nc(ccc1F)Br 778759b832e25727e379fd85af9dacc0 [0,2,0,0,0,0|1,0,0]=3 3487 B12R1.127 CC(C)Nc1nc(ccc1F)F 5d385cb8a7b9023ce510b2eed93e7859 [0,2,0,0,0,0|1,0,0]=3 3488 B12R1.127 CC(C)Nc1nc(ccc1I)Br 0cff94e3267156cbfa270eb6b9456320 [0,2,0,0,0,0|1,0,0]=3 3489 B12R1.127 CC(C)Nc1nc(ccc1I)Cl a74dd1df0877fc0663ee50e8ca4527e1 [0,2,0,0,0,0|1,0,0]=3 3490 B12R1.127 CC(C)Nc1nc(cnc1Br)Br 797cc49524024c189e2e34a21be393a2 [0,2,0,0,0,0|2,0,0]=4 3491 B12R1.127 CC(C)Nc1nc(cnc1Br)Cl 369ad49d393816f264508333ee5c755b [0,2,0,0,0,0|2,0,0]=4 3492 B12R1.127 CC(C)Nc1nc(cnc1Cl)Cl b3c4c6089fbb88e0f2beb4292e925c76 [0,2,0,0,0,0|2,0,0]=4 3493 B12R1.127 CC(C)Nc1nc(cnc1I)Cl 6ed220041c531a588a1e22c03ff06c22 [0,2,0,0,0,0|2,0,0]=4 3494 B12R1.127 CC(C)Nc1nc(ncc1Cl)Cl d4bd1262b089a49bfbcc9bbef1263cca [0,2,0,0,0,0|2,0,0]=4 3495 B12R1.127 CC(C)Nc1nc(ncc1F)Cl 37d8d6e44036960d14ad9547eea185c8 [0,2,0,0,0,0|2,0,0]=4 3496 B12R1.127 CC(C)Nc1nc(ncc1I)Cl b57d233dea76d7c3fa2ffb3ebc8a05e6 [0,2,0,0,0,0|2,0,0]=4 3497 B12R1.127 CC(C)Oc1cc(ccc1Br)F 2646d59679a0119b669476cc3e1b4563 [0,2,0,0,0,0|2,0,0]=4 3498 B12R1.127 CC(C)Oc1cc(ccc1Cl)Br 9468624fb0d08de85e1c148696e0ae50 [0,2,0,0,0,0|2,0,0]=4 3499 B12R1.127 CC(C)Oc1cc(ccc1Cl)Cl 71efbd6723ba2fc279387d2be3e5f755 [0,2,0,0,0,0|2,0,0]=4 3500 B12R1.127 CC(C)Oc1cc(ccc1Cl)F 256df4c3a77745d1768ec0c02b58e2b0 [0,2,0,0,0,0|2,0,0]=4 3501 B12R1.127 CC(C)Oc1cc(ccc1Cl)I 69c7a055aa19c603e95e2cfc5d444be0 [0,2,0,0,0,0|2,0,0]=4 3502 B12R1.127 CC(C)Oc1cc(ccc1F)Br 7d9170d0420d4d4fd0276e57ab4d0e0b [0,2,0,0,0,0|2,0,0]=4 3503 B12R1.127 CC(C)Oc1cc(ccc1F)Cl 7c9852a5c41d853f90db4a80c08deb31 [0,2,0,0,0,0|2,0,0]=4 3504 B12R1.127 CC(C)Oc1cc(ccc1F)F adb7375e5c4ed6f7e22ff456d3f52c59 [0,2,0,0,0,0|2,0,0]=4 3505 B12R1.127 CC(C)Oc1cc(ccc1F)I 7e6adccc2f7e2086d629938d91699ff6 [0,2,0,0,0,0|2,0,0]=4 3506 B12R1.127 CC(C)Oc1cc(ccc1I)Br f165204843f5060803a4322d5f83e91a [0,2,0,0,0,0|2,0,0]=4 3507 B12R1.127 CC(C)Oc1cc(ccc1I)Cl 0d310dc2bdd46050a03683dcd93ec581 [0,2,0,0,0,0|2,0,0]=4 3508 B12R1.127 CC(C)Oc1cc(ccc1I)F 39a1185950e035aef719641c0a0a864b [0,2,0,0,0,0|2,0,0]=4 3509 B12R1.127 CC(C)Oc1nc(ccc1Cl)Br 28501b3653eba6bd183d76b9646ce529 [0,2,0,0,0,0|1,0,0]=3 3510 B12R1.127 CC(C)Oc1nc(ccc1Cl)Cl 0e39d82d8c11f28ef11336f9c45d003f [0,2,0,0,0,0|1,0,0]=3 3511 B12R1.127 CC(C)Oc1nc(ccc1F)Cl a5032de2aa0a5b80bd3ce71890aefb00 [0,2,0,0,0,0|1,0,0]=3 3512 B12R1.127 CC(C)Oc1nc(ccc1I)Br d54139443c7eca8fb323e7f158462d49 [0,2,0,0,0,0|1,0,0]=3 3513 B12R1.127 CC(C)Oc1nc(ccc1I)Cl 2cf797750871c1a3f990c82fe335e597 [0,2,0,0,0,0|1,0,0]=3 3514 B12R1.127 CC(C)Oc1nc(ncc1Cl)Cl b353aefbcc23c961fd19a2be07eededb [0,2,0,0,0,0|2,0,0]=4 3515 B12R1.127 Cc1c[nH]c(=O)c(n1)NC(C)C ba3cf212ccd4c0b9f62b47b50128360a [0,2,0,0,0,0|2,0,0]=4 3516 B12R1.127 Cc1ccc(c(c1)NC(C)C)I eff339ae364ac1ab92947630ad0924f6 [0,2,0,0,0,0|2,0,0]=4 3517 B12R1.127 Cc1ccc(c(c1)OC(C)C)C 0b90220c912680e151ad9c07ad864a3e [0,2,0,0,0,0|2,0,0]=4 3518 B12R1.127 Cc1ccc(c(c1)OC(C)C)Cl d4c8fcf031559b895582caebaafd2bfe [0,2,0,0,0,0|2,0,0]=4 3519 B12R1.127 Cc1ccc(c(c1)OC(C)C)F 3b6a0c269bbca2fa025f72338f3cca06 [0,2,0,0,0,0|2,0,0]=4 3520 B12R1.127 Cc1ccc(c(c1)OC(C)C)I 4375ec63921a760372b3c3df06883bb8 [0,2,0,0,0,0|2,0,0]=4 3521 B12R1.127 Cc1ccc(c(n1)NC(C)C)C 18e0790533200c6b3720c1d230641cd7 [0,2,0,0,0,0|1,0,0]=3 3522 B12R1.127 Cc1ccc(c(n1)NC(C)C)F 7b6c6d0320eb18c167fba611641a2aa7 [0,2,0,0,0,0|1,0,0]=3 3523 B12R1.127 Cc1ccc(c(n1)NC(C)C)I 3c433f4b408ff6827e057c39a9edbe3d [0,2,0,0,0,0|1,0,0]=3 3524 B12R1.127 Cc1ccc(c(n1)OC(C)C)Br eacc3433a45cc42ca9697901bf3f0c2d [0,2,0,0,0,0|1,0,0]=3 3525 B12R1.127 Cc1ccc(c(n1)OC(C)C)I 01ce88c51a599fbc4cc3b16a78c64760 [0,2,0,0,0,0|1,0,0]=3 3526 B12R1.127 Cc1ccc(cc1NC(C)C)Cl f47c79f6349a9d7074bb60991664adde [0,2,0,0,0,0|2,0,0]=4 3527 B12R1.127 Cc1ccc(cc1NC(C)C)F 274f12a96715dc0590278235734a9aa0 [0,2,0,0,0,0|2,0,0]=4 3528 B12R1.127 Cc1ccc(cc1NC(C)C)I 2283d1315c934709c83b221f38d34255 [0,2,0,0,0,0|2,0,0]=4 3529 B12R1.127 Cc1ccc(cc1OC(C)C)Br 99e26b0ada7d7c01430f6a8b5e05839b [0,2,0,0,0,0|2,0,0]=4 3530 B12R1.127 Cc1ccc(cc1OC(C)C)Cl 4d21ff7d37b8da505a74e45dfdcab2b7 [0,2,0,0,0,0|2,0,0]=4 3531 B12R1.127 Cc1ccc(cc1OC(C)C)F 204fa36252cb332a629bd09aba4e9602 [0,2,0,0,0,0|2,0,0]=4 3532 B12R1.127 Cc1ccc(cc1OC(C)C)I a5fba2a18a650c3cb96ebd4044a8b1b3 [0,2,0,0,0,0|2,0,0]=4 3533 B12R1.127 Cc1ccc(nc1NC(C)C)Br 1a47286bda7cd86d43c4c58052e4b308 [0,2,0,0,0,0|1,0,0]=3 3534 B12R1.127 Cc1cnc(c(n1)NC(C)C)C 691cf4f2959493df7ad3b9fcbcbc7883 [0,2,0,0,0,0|2,0,0]=4 3535 B12R1.127 Cc1cnc(c(n1)NC(C)C)Cl 4433a46d2606cc10b94c26913bd8e72a [0,2,0,0,0,0|2,0,0]=4 3536 B12R1.127 Cc1cnc(c(n1)NC(C)C)I aea3509883d2cd11cdc2e04bb4050f02 [0,2,0,0,0,0|2,0,0]=4 3537 B12R1.127 Cc1cnc(nc1OC(C)C)Cl ff083d0f5ffa9505e7de4d7ab79dfed2 [0,2,0,0,0,0|2,0,0]=4 3538 B12R1.127 Cc1ncc(c(n1)NC(C)C)F 97ee8d9451802da47854ea7c80503a02 [0,2,0,0,0,0|2,0,0]=4 3539 B12R1.127 Cc1ncc(c(n1)OC(C)C)Br 91d7d93afacb109c8e57f1beaa22924e [0,2,0,0,0,0|2,0,0]=4 3540 B12R1.127 Cc1ncc(c(n1)OC(C)C)C 6b76a136e6cf955a7b0a0413341b4681 [0,2,0,0,0,0|2,0,0]=4 3541 B12R1.127 Cc1ncc(c(n1)OC(C)C)F 5cd2a1a0a5a8f693413a046d9ff9029c [0,2,0,0,0,0|2,0,0]=4 3542 B12R1.127 Cc1ncc(c(n1)OC(C)C)I 07b0429de6f3e9db7a1354d0ded8388a [0,2,0,0,0,0|2,0,0]=4 3543 B12R1.127 Cc1ncc(nc1NC(C)C)Cl 82d5fd1fe72c50d781beb37aa9e3d78b [0,2,0,0,0,0|2,0,0]=4 3544 B12R1.224 CC(C)Nc1cccc(c1Br)Cl 53f631048adef89ff41cef89e4c1759e [0,2,0,0,0,0|2,0,0]=4 3545 B12R1.224 CC(C)Nc1cccc(c1Cl)F dec62e55b510382a7a147658ccb9fc98 [0,2,0,0,0,0|2,0,0]=4 3546 B12R1.224 CC(C)Nc1nc[nH]c(=O)c1Br 5d43429d9c530a8ce5e2fff0e49ca26c [0,2,0,0,0,0|2,0,0]=4 3547 B12R1.224 CC(C)Nc1nccc(c1Br)Br 882ace0d87919bf0b572ea15c5bd4547 [0,2,0,0,0,0|1,0,0]=3 3548 B12R1.224 CC(C)Nc1nccc(c1Br)Cl 4a034ce2cfdc7076705c839574216e07 [0,2,0,0,0,0|1,0,0]=3 3549 B12R1.224 CC(C)Nc1nccc(c1Br)F 6ea90d8845e3c0eac80301b0694c35ac [0,2,0,0,0,0|1,0,0]=3 3550 B12R1.224 CC(C)Nc1nccc(c1Cl)Br 9781f613ba06bfa6d0de88f99db8fe75 [0,2,0,0,0,0|1,0,0]=3 3551 B12R1.224 CC(C)Nc1nccc(c1Cl)Cl 21aa873357b336c011d84d74a9d87e41 [0,2,0,0,0,0|1,0,0]=3 3552 B12R1.224 CC(C)Nc1nccc(c1Cl)I ada0e59bf4eeabbd256efbdc997cfb9e [0,2,0,0,0,0|1,0,0]=3 3553 B12R1.224 CC(C)Nc1nccc(c1F)Cl 8daf0f02b36a0f5bf7e226e21dea90cc [0,2,0,0,0,0|1,0,0]=3 3554 B12R1.224 CC(C)Nc1nccc(c1F)F 94ae87a9ba874e7a2ab0b2086a24dec6 [0,2,0,0,0,0|1,0,0]=3 3555 B12R1.224 CC(C)Nc1nccc(c1F)I b8185daeabea11f485e83b8ac1c6a086 [0,2,0,0,0,0|1,0,0]=3 3556 B12R1.224 CC(C)Nc1nccc(c1I)Br ef7d9408b82afe8f483f212d903432dc [0,2,0,0,0,0|1,0,0]=3 3557 B12R1.224 CC(C)Nc1nccc(c1I)Cl f564fcafe32c4ad8933b29963e78137e [0,2,0,0,0,0|1,0,0]=3 3558 B12R1.224 CC(C)Nc1ncnc(c1Br)Cl 1496faa9b21aebd23150c0bdbcb97f04 [0,2,0,0,0,0|2,0,0]=4 3559 B12R1.224 CC(C)Nc1ncnc(c1Cl)Cl 08be39ace7bee28b326a7f0395656a7d [0,2,0,0,0,0|2,0,0]=4 3560 B12R1.224 CC(C)Nc1ncnc(c1I)Cl 9db6843243e7107e2654bbb787e2d5a7 [0,2,0,0,0,0|2,0,0]=4 3561 B12R1.224 CC(C)Oc1cccc(c1Br)Br be7c69550c62dfc035cde811bad22360 [0,2,0,0,0,0|2,0,0]=4 3562 B12R1.224 CC(C)Oc1cccc(c1Br)Cl 1b49eea272b356f246dc8b9b05cb2a27 [0,2,0,0,0,0|2,0,0]=4 3563 B12R1.224 CC(C)Oc1cccc(c1Br)F 5adceb2b52fdf9675ce25706ffc21607 [0,2,0,0,0,0|2,0,0]=4 3564 B12R1.224 CC(C)Oc1cccc(c1Br)I aa8adc2641b9dc45b52d916ddf60dd9d [0,2,0,0,0,0|2,0,0]=4 3565 B12R1.224 CC(C)Oc1cccc(c1Cl)Br e45582288a884403b9faee35fcca9645 [0,2,0,0,0,0|2,0,0]=4 3566 B12R1.224 CC(C)Oc1cccc(c1Cl)Cl c20891242a1ef82f96eba7e624f573b3 [0,2,0,0,0,0|2,0,0]=4 3567 B12R1.224 CC(C)Oc1cccc(c1Cl)F cc9b87f18592b15f040d2b202e85598d [0,2,0,0,0,0|2,0,0]=4 3568 B12R1.224 CC(C)Oc1cccc(c1Cl)I 03f301a845c9ebf4dd792d342ee3f96f [0,2,0,0,0,0|2,0,0]=4 3569 B12R1.224 CC(C)Oc1cccc(c1F)Cl fec6e116b2cf6776dd79637095a47955 [0,2,0,0,0,0|2,0,0]=4 3570 B12R1.224 CC(C)Oc1cccc(c1F)F 9a5d7937ae29d4f07cb68f8c89987366 [0,2,0,0,0,0|2,0,0]=4 3571 B12R1.224 CC(C)Oc1cccc(c1F)I b5bb5bd994fdd596707ba2ad01904a93 [0,2,0,0,0,0|2,0,0]=4 3572 B12R1.224 CC(C)Oc1cccc(c1I)Br ab4ee7eb4278f2cc0de6076cf9ab2390 [0,2,0,0,0,0|2,0,0]=4 3573 B12R1.224 CC(C)Oc1cccc(c1I)Cl 69fdb3f6b8a4ecdf7d4d7ca9b0e18a96 [0,2,0,0,0,0|2,0,0]=4 3574 B12R1.224 CC(C)Oc1cccc(c1I)F a7b38987f78de0278bf1ff80fb64fc30 [0,2,0,0,0,0|2,0,0]=4 3575 B12R1.224 CC(C)Oc1nc[nH]c(=O)c1I e522eed404c1262bfbe825f36977e4d3 [0,2,0,0,0,0|2,0,0]=4 3576 B12R1.224 CC(C)Oc1nccc(c1Cl)Br beb0263b6a77ba8de68f31d9a3f295f3 [0,2,0,0,0,0|1,0,0]=3 3577 B12R1.224 CC(C)Oc1nccc(c1F)I 3c4edc151290d4bedf8268d4a13ea8c5 [0,2,0,0,0,0|1,0,0]=3 3578 B12R1.224 CC(C)Oc1nccc(c1I)Cl 491c6689e537fd86289e2c4d55289ed8 [0,2,0,0,0,0|1,0,0]=3 3579 B12R1.224 CC(C)Oc1ncnc(c1Cl)Cl 4954d42e92f60cb43bc0f17e4fb56626 [0,2,0,0,0,0|2,0,0]=4 3580 B12R1.224 Cc1c(cccc1OC(C)C)Br 1a7527c236845cad3dc776fd2623f89a [0,2,0,0,0,0|2,0,0]=4 3581 B12R1.224 Cc1c(cccc1OC(C)C)Cl 32051cf527c255f5c9526b4e9d8c9270 [0,2,0,0,0,0|2,0,0]=4 3582 B12R1.224 Cc1c(cccc1OC(C)C)F 3362faf6a06d7f191009b6ad4914990e [0,2,0,0,0,0|2,0,0]=4 3583 B12R1.224 Cc1c(cccc1OC(C)C)I 1f48205280453ad6d511c7023b8738df [0,2,0,0,0,0|2,0,0]=4 3584 B12R1.224 Cc1c(ccnc1NC(C)C)Br 24c7e4c2e1578379ced5ec51c7c55336 [0,2,0,0,0,0|1,0,0]=3 3585 B12R1.224 Cc1c(ccnc1NC(C)C)Cl 6179f64af6ef620bf729d347c8077ab9 [0,2,0,0,0,0|1,0,0]=3 3586 B12R1.224 Cc1c(ccnc1NC(C)C)F fc9b0edd9ce6acb585e7d58863f75078 [0,2,0,0,0,0|1,0,0]=3 3587 B12R1.224 Cc1c(ccnc1NC(C)C)I e7c043c806fded94a1b7feff909a68d2 [0,2,0,0,0,0|1,0,0]=3 3588 B12R1.224 Cc1c(ccnc1OC(C)C)Br e3c86273feeff8c9a1620ea2a58341bd [0,2,0,0,0,0|1,0,0]=3 3589 B12R1.224 Cc1c(ccnc1OC(C)C)Cl 9c06a7c433de3fa3f9e80a5623435ea2 [0,2,0,0,0,0|1,0,0]=3 3590 B12R1.224 Cc1c(ccnc1OC(C)C)I 90b1ae44030b719ade4626775c6c09b7 [0,2,0,0,0,0|1,0,0]=3 3591 B12R1.224 Cc1c(ncnc1NC(C)C)Cl d931baf75c6d562bac99a5c1b75fe569 [0,2,0,0,0,0|2,0,0]=4 3592 B12R1.224 Cc1c(ncnc1NC(C)C)F 7c4de1cefb7bde75ff98b2f0de559eb7 [0,2,0,0,0,0|2,0,0]=4 3593 B12R1.224 Cc1c(ncnc1OC(C)C)Cl fa4bee33bfe33746627dd21a514b8711 [0,2,0,0,0,0|2,0,0]=4 3594 B12R1.224 Cc1cccc(c1Br)OC(C)C 9f8c304ec70da7d671abfcd89d55d6a9 [0,2,0,0,0,0|2,0,0]=4 3595 B12R1.224 Cc1cccc(c1C)OC(C)C 795bed37a5696b93bab568ac1d277fdc [0,2,0,0,0,0|2,0,0]=4 3596 B12R1.224 Cc1cccc(c1Cl)OC(C)C 45c00ab00a852614bf8395afe9da39f8 [0,2,0,0,0,0|2,0,0]=4 3597 B12R1.224 Cc1cccc(c1F)OC(C)C 4b33c375e882d56de9aea4261ef37260 [0,2,0,0,0,0|2,0,0]=4 3598 B12R1.224 Cc1cccc(c1I)OC(C)C 4048eb28bc554829441f1c3422c8f6e7 [0,2,0,0,0,0|2,0,0]=4 3599 B12R1.224 Cc1ccnc(c1Br)NC(C)C b2fc7b20e123b090a1bc39dc5d3d4dc3 [0,2,0,0,0,0|1,0,0]=3 3600 B12R1.224 Cc1ccnc(c1Br)OC(C)C abefb442e4218b310c456266f39a203b [0,2,0,0,0,0|1,0,0]=3 3601 B12R1.224 Cc1ccnc(c1C)NC(C)C a412c66151bac47ad7c1ed1b75704c02 [0,2,0,0,0,0|1,0,0]=3 3602 B12R1.224 Cc1ccnc(c1C)OC(C)C 1afc69afa84191babac2e951ad0e1113 [0,2,0,0,0,0|1,0,0]=3 3603 B12R1.224 Cc1ccnc(c1Cl)NC(C)C a3aa28d866a63e3ab6457fe2fe3a779e [0,2,0,0,0,0|1,0,0]=3 3604 B12R1.224 Cc1ccnc(c1F)NC(C)C 4b3ceae22500f12520c2f4c65f68cb53 [0,2,0,0,0,0|1,0,0]=3 3605 B12R1.224 Cc1ccnc(c1I)NC(C)C b1991165814bfe220260c214787db697 [0,2,0,0,0,0|1,0,0]=3 3606 B12R1.224 Cc1ncnc(c1Br)NC(C)C 03a255fb7369e9d99b59a924d7b8546b [0,2,0,0,0,0|2,0,0]=4 3607 B12R1.224 Cc1ncnc(c1Br)OC(C)C 374140da1b38875964be7989289a5c23 [0,2,0,0,0,0|2,0,0]=4 3608 B12R1.224 Cc1ncnc(c1C)NC(C)C 8f46ec061c0305f4987cc24457685f41 [0,2,0,0,0,0|2,0,0]=4 3609 B12R1.224 Cc1ncnc(c1C)OC(C)C 44b61214b997006cecf533d7001ab670 [0,2,0,0,0,0|2,0,0]=4 3610 B12R1.224 Cc1ncnc(c1Cl)NC(C)C f75b9c541700915838591abcece3e617 [0,2,0,0,0,0|2,0,0]=4 3611 B12R1.224 Cc1ncnc(c1Cl)OC(C)C d9729158b493e28fa410dd6997d535e2 [0,2,0,0,0,0|2,0,0]=4 3612 B12R1.224 Cc1ncnc(c1F)OC(C)C 1b0c82fe06bc5714e9ce6af42a7106a3 [0,2,0,0,0,0|2,0,0]=4 3613 B12R1.224 Cc1ncnc(c1I)NC(C)C 0b3c7e9093004b4e3d52eed950ba5ca2 [0,2,0,0,0,0|2,0,0]=4 3614 B12R1.224 Cc1ncnc(c1I)OC(C)C 1c59def7a4ec26d723ee67192c167f14 [0,2,0,0,0,0|2,0,0]=4 3615 B12R1.1009 CC(C)Nc1c(cccc1F)F 470022a8587eb7236328233cbb60f95c [0,2,0,0,0,0|2,0,0]=4 3616 B12R1.1009 CC(C)Nc1c(cccc1I)F 14ce88a58c45e33dae9aad2cd4d3ab93 [0,2,0,0,0,0|2,0,0]=4 3617 B12R1.1009 CC(C)Nc1c(cccc1S)F 0b373eca56263ffff23bbe01e0d9662d [0,2,0,0,0,0|2,0,0]=4 3618 B12R1.1009 CC(C)Oc1c(cccc1Br)F 7867c222c052c8cc2982ef2fc699664b [0,2,0,0,0,0|2,0,0]=4 3619 B12R1.1009 CC(C)Oc1c(cccc1Cl)Cl f542c331107b7d01c4399c8fa2effefe [0,2,0,0,0,0|2,0,0]=4 3620 B12R1.1009 CC(C)Oc1c(cccc1Cl)F cccc8e6852f8614f38509456cdc51827 [0,2,0,0,0,0|2,0,0]=4 3621 B12R1.1009 CC(C)Oc1c(cccc1F)F b27287b1172887fdb45edd4b5d562ef3 [0,2,0,0,0,0|2,0,0]=4 3622 B12R1.1009 CC(C)Oc1c(cccc1I)Cl 5731189536b0eaf81f4b695548041fe3 [0,2,0,0,0,0|2,0,0]=4 3623 B12R1.1009 CC(C)Oc1c(cccc1I)F 3e89607ed3974d5ada50b29bda1bdafe [0,2,0,0,0,0|2,0,0]=4 3624 B12R1.1009 CC(C)Oc1c(cccc1I)I 01e136ff24362bbac6d437d5134aec3b [0,2,0,0,0,0|2,0,0]=4 3625 B12R1.1009 Cc1cccc(c1NC(C)C)C 6cd32127934fee8a8b404daa0d07afc4 [0,2,0,0,0,0|2,0,0]=4 3626 B12R1.1009 Cc1cccc(c1NC(C)C)F 934b8fb88d3f665ab8914d77a5e930ef [0,2,0,0,0,0|2,0,0]=4 3627 B12R1.1009 Cc1cccc(c1NC(C)C)I 1ed72108b19807cd27bbac81856b42f0 [0,2,0,0,0,0|2,0,0]=4 3628 B12R1.1009 Cc1cccc(c1OC(C)C)C bb37a196b10053a7b647b1439dc6d342 [0,2,0,0,0,0|2,0,0]=4 3629 B12R1.1009 Cc1cccc(c1OC(C)C)Cl c68212e5fdd8fc31327757aa294d790b [0,2,0,0,0,0|2,0,0]=4 3630 B12R1.1009 Cc1cccc(c1OC(C)C)F 387ce16a8241ff8ee157dafd0815cc33 [0,2,0,0,0,0|2,0,0]=4 3631 B12R1.1009 Cc1cccc(c1OC(C)C)I ac1875791951941e1a376222c111517d [0,2,0,0,0,0|2,0,0]=4 3632 B12R1.101 CC(C)Nc1cc([nH]c(=O)n1)Cl 62e1b532a290e90092ff7dcd0b3632f2 [0,2,0,0,0,0|2,0,0]=4 3633 B12R1.101 CC(C)Nc1cc(cc(c1)Br)Br 3ec75cd22625baf94e716b0d86cec300 [0,2,0,0,0,0|2,0,0]=4 3634 B12R1.101 CC(C)Nc1cc(cc(c1)Br)Cl 4000e0ba3010bc7a9b59a076c918e4fd [0,2,0,0,0,0|2,0,0]=4 3635 B12R1.101 CC(C)Nc1cc(cc(c1)Br)F 7bb88c1d7736a3f9f70f144069492576 [0,2,0,0,0,0|2,0,0]=4 3636 B12R1.101 CC(C)Nc1cc(cc(c1)Cl)Cl f30a94ed8a0fce642490e684e5283c3a [0,2,0,0,0,0|2,0,0]=4 3637 B12R1.101 CC(C)Nc1cc(cc(c1)Cl)F bd95dee3047071a168f54fa29120d71b [0,2,0,0,0,0|2,0,0]=4 3638 B12R1.101 CC(C)Nc1cc(cc(c1)F)F 55335530e40935f80378a868789e33c9 [0,2,0,0,0,0|2,0,0]=4 3639 B12R1.101 CC(C)Nc1cc(cc(c1)I)Br dafe41b594a5491fc5f14521e072ece2 [0,2,0,0,0,0|2,0,0]=4 3640 B12R1.101 CC(C)Nc1cc(cc(c1)I)Cl 21b26717636f04298c3157f92147fe12 [0,2,0,0,0,0|2,0,0]=4 3641 B12R1.101 CC(C)Nc1cc(cc(c1)I)F c3ab045b7c0d8d709f86243b63b24e41 [0,2,0,0,0,0|2,0,0]=4 3642 B12R1.101 CC(C)Nc1cc(cc(c1)I)I 067de7ee82d5d74159693c0599cce6c0 [0,2,0,0,0,0|2,0,0]=4 3643 B12R1.101 CC(C)Nc1cc(cc(n1)Br)Br 01bf3eb366cebc26ce79f785546bfdd3 [0,2,0,0,0,0|1,0,0]=3 3644 B12R1.101 CC(C)Nc1cc(cc(n1)Br)Cl 50f79a56fcb50ad5e39352c15f724ffb [0,2,0,0,0,0|1,0,0]=3 3645 B12R1.101 CC(C)Nc1cc(cc(n1)F)Br 7e26f6dee5535577beb006cfce7e581b [0,2,0,0,0,0|1,0,0]=3 3646 B12R1.101 CC(C)Nc1cc(nc(n1)Cl)Br 738ac5e5387210868b849b6792d3cbe2 [0,2,0,0,0,0|2,0,0]=4 3647 B12R1.101 CC(C)Nc1cc(nc(n1)Cl)Cl 752758524c747ebc40fb7310d84ef26f [0,2,0,0,0,0|2,0,0]=4 3648 B12R1.101 CC(C)Nc1cc(nc(n1)F)F 9d001b7d47f2b824cc70b523db3921e9 [0,2,0,0,0,0|2,0,0]=4 3649 B12R1.101 CC(C)Nc1nc(cc(n1)Cl)Cl 4cd15a8a8254253fddffde3161d1ef91 [0,2,0,0,0,0|2,0,0]=4 3650 B12R1.101 CC(C)Nc1nc(cc(n1)F)F e14b311faa12d860dcefaae0205990fe [0,2,0,0,0,0|2,0,0]=4 3651 B12R1.101 CC(C)Nc1nc(cc(n1)I)I 8d6861f12c0c0da220222de8ddd12b07 [0,2,0,0,0,0|2,0,0]=4 3652 B12R1.101 CC(C)Oc1cc(cc(c1)Br)Br 908a36ad040e083a32a0870e00ca5462 [0,2,0,0,0,0|2,0,0]=4 3653 B12R1.101 CC(C)Oc1cc(cc(c1)Br)Cl 90832d38f45494d9c534a27e70a33dab [0,2,0,0,0,0|2,0,0]=4 3654 B12R1.101 CC(C)Oc1cc(cc(c1)Br)F cc304cb852aa35b5ca8dc03183accb58 [0,2,0,0,0,0|2,0,0]=4 3655 B12R1.101 CC(C)Oc1cc(cc(c1)Cl)Cl 96cb338d5eaea2f32efef96d114d240a [0,2,0,0,0,0|2,0,0]=4 3656 B12R1.101 CC(C)Oc1cc(cc(c1)Cl)F 867bcb16d843f0bc98d5db4872f89328 [0,2,0,0,0,0|2,0,0]=4 3657 B12R1.101 CC(C)Oc1cc(cc(c1)F)F fd20f0814f72fd78fb4c03f50f7974a0 [0,2,0,0,0,0|2,0,0]=4 3658 B12R1.101 CC(C)Oc1cc(cc(c1)I)Br b82d1c7a023e0aeec9350380142ba167 [0,2,0,0,0,0|2,0,0]=4 3659 B12R1.101 CC(C)Oc1cc(cc(c1)I)Cl 40b7c52ad4fa29be1801a205eb0792a2 [0,2,0,0,0,0|2,0,0]=4 3660 B12R1.101 CC(C)Oc1cc(cc(c1)I)F 4b4513273e57ee4ce806790dfb79209b [0,2,0,0,0,0|2,0,0]=4 3661 B12R1.101 CC(C)Oc1cc(cc(n1)Cl)Br 3cffd43dd83ccd7d55092d12969460a7 [0,2,0,0,0,0|1,0,0]=3 3662 B12R1.101 CC(C)Oc1cc(cc(n1)Cl)Cl a671173d98754c9083d4f4bbfc1eedc1 [0,2,0,0,0,0|1,0,0]=3 3663 B12R1.101 Cc1cc(=O)cc(o1)OC(C)C bc6977e7cc6a2fe86078358f6b0a91f7 [0,2,0,0,0,0|2,0,0]=4 3664 B12R1.101 Cc1cc(cc(c1)NC(C)C)Br 885b9e61828ef2723175de94e6bd176b [0,2,0,0,0,0|2,0,0]=4 3665 B12R1.101 Cc1cc(cc(c1)NC(C)C)C ccc8ef4ab081b9a8f889f8a1174a230b [0,2,0,0,0,0|2,0,0]=4 3666 B12R1.101 Cc1cc(cc(c1)NC(C)C)Cl c2aff29ea5afc858a1c49f03bbc68cd0 [0,2,0,0,0,0|2,0,0]=4 3667 B12R1.101 Cc1cc(cc(c1)NC(C)C)F 15f06000c23ee02df2d873cadb899dbd [0,2,0,0,0,0|2,0,0]=4 3668 B12R1.101 Cc1cc(cc(c1)NC(C)C)I 6d29ab071cd1bea007d875602ad02d46 [0,2,0,0,0,0|2,0,0]=4 3669 B12R1.101 Cc1cc(cc(c1)OC(C)C)Br ac8af97887813bcbf58c5b92454bfdbb [0,2,0,0,0,0|2,0,0]=4 3670 B12R1.101 Cc1cc(cc(c1)OC(C)C)C bd8f6b107f52d68240d91e34be996788 [0,2,0,0,0,0|2,0,0]=4 3671 B12R1.101 Cc1cc(cc(c1)OC(C)C)Cl a64b4b8994146108dd2b4a21c188be33 [0,2,0,0,0,0|2,0,0]=4 3672 B12R1.101 Cc1cc(cc(c1)OC(C)C)F 314f83a9e2788f714312e7aa465ae3ff [0,2,0,0,0,0|2,0,0]=4 3673 B12R1.101 Cc1cc(cc(c1)OC(C)C)I ce8f72e0562a9ba1f13513f5d114bf95 [0,2,0,0,0,0|2,0,0]=4 3674 B12R1.101 Cc1cc(cc(n1)NC(C)C)Cl a87714c3b1635602d064369e1b37d715 [0,2,0,0,0,0|1,0,0]=3 3675 B12R1.101 Cc1cc(cc(n1)OC(C)C)Br 088f2986e5e43763efb9785a62f5dec6 [0,2,0,0,0,0|1,0,0]=3 3676 B12R1.101 Cc1cc(cc(n1)OC(C)C)Cl 1ee722844f520e8c69b50b9bce87afa1 [0,2,0,0,0,0|1,0,0]=3 3677 B12R1.101 Cc1cc(cc(n1)OC(C)C)F 44beba0721b108783fb326ce82687ed5 [0,2,0,0,0,0|1,0,0]=3 3678 B12R1.101 Cc1cc(nc(c1)NC(C)C)Br 626a5dc4dd7c05f5e599cf94402a3bf6 [0,2,0,0,0,0|1,0,0]=3 3679 B12R1.101 Cc1cc(nc(c1)NC(C)C)C bbe6f5a251e8316031e32ab9ebbff402 [0,2,0,0,0,0|1,0,0]=3 3680 B12R1.101 Cc1cc(nc(c1)NC(C)C)F 8a2e372135560a365e05f9c1848048cf [0,2,0,0,0,0|1,0,0]=3 3681 B12R1.101 Cc1cc(nc(c1)OC(C)C)Br ef5e47ba4a7b49802b34d7b53c690b87 [0,2,0,0,0,0|1,0,0]=3 3682 B12R1.101 Cc1cc(nc(c1)OC(C)C)C a270fc920c544a9227fec1e4ac379e72 [0,2,0,0,0,0|1,0,0]=3 3683 B12R1.101 Cc1cc(nc(c1)OC(C)C)Cl 9ec1cd750b06cecad2d946fbe55f33cd [0,2,0,0,0,0|1,0,0]=3 3684 B12R1.101 Cc1cc(nc(n1)Br)NC(C)C 2a060cc1fc300ccf32a658dec1c8562a [0,2,0,0,0,0|2,0,0]=4 3685 B12R1.101 Cc1cc(nc(n1)C)NC(C)C de7005a084140a515ed7e0f2e7fc6d92 [0,2,0,0,0,0|2,0,0]=4 3686 B12R1.101 Cc1cc(nc(n1)C)OC(C)C 03da17470e9044e0122af68bbfde898b [0,2,0,0,0,0|2,0,0]=4 3687 B12R1.101 Cc1cc(nc(n1)Cl)NC(C)C bc3ac4363688306ff161c7e90dbebf7d [0,2,0,0,0,0|2,0,0]=4 3688 B12R1.101 Cc1cc(nc(n1)Cl)OC(C)C 0c6bb7b2d95388406767d271e5608ab6 [0,2,0,0,0,0|2,0,0]=4 3689 B12R1.101 Cc1cc(nc(n1)NC(C)C)Br 599aa40b4a77309b9467876e38578f35 [0,2,0,0,0,0|2,0,0]=4 3690 B12R1.101 Cc1cc(nc(n1)NC(C)C)C d5656d1d111948ce42803569d5e5bff5 [0,2,0,0,0,0|2,0,0]=4 3691 B12R1.101 Cc1cc(nc(n1)NC(C)C)Cl 09b5a18df050d429fb1b00a5e63e15dd [0,2,0,0,0,0|2,0,0]=4 3692 B12R1.101 Cc1cc(nc(n1)NC(C)C)F d78f5a6c89fcbbf30530aa1e3f49cb05 [0,2,0,0,0,0|2,0,0]=4 3693 B12R1.101 Cc1cc(nc(n1)NC(C)C)I c40d518ead8d7e5cf4ad58e4940b9ef3 [0,2,0,0,0,0|2,0,0]=4 3694 B12R1.101 Cc1cc(nc(n1)NC(C)C)S 2c99b41752431900acd86153d309933a [0,2,0,0,0,0|2,0,0]=4 3695 B12R1.101 Cc1cc(nc(n1)OC(C)C)C 9a180d516fd49f973527c9c586e367ce [0,2,0,0,0,0|2,0,0]=4 3696 B12R1.101 Cc1cc(nc(n1)S)NC(C)C ff3698740682ce618d3c97c97fad0749 [0,2,0,0,0,0|2,0,0]=4 3697 B12R1.101 Cc1cc(nc(n1)S)OC(C)C 07c269999ab2d60da38560ff82dc6b91 [0,2,0,0,0,0|2,0,0]=4 3698 B12R1.101 Cc1nc(cc(n1)NC(C)C)Br 18e4aa84d92a43252ff9d79c44aba2ee [0,2,0,0,0,0|2,0,0]=4 3699 B12R1.101 Cc1nc(cc(n1)NC(C)C)Cl 182bdecef609019c513b8efb095bc95a [0,2,0,0,0,0|2,0,0]=4 3700 B12R1.101 Cc1nc(cc(n1)NC(C)C)I cd5e87c4804ca1caaaf269703eb4dccd [0,2,0,0,0,0|2,0,0]=4 3701 B12R1.101 Cc1nc(cc(n1)OC(C)C)Br 8ee26eefe30aab3fe3e349af3889a76d [0,2,0,0,0,0|2,0,0]=4 3702 B12R1.101 Cc1nc(cc(n1)OC(C)C)Cl d842db22056e8c4e6f91f5e15d484f59 [0,2,0,0,0,0|2,0,0]=4 3703 B12R1.119 CC(C)(C)Nc1cccc(c1)F 058f11174665294bc6a7120d8cf40fe3 [0,2,0,0,0,0|2,0,0]=4 3704 B12R1.119 CC(C)(C)Nc1cccc(c1)S ae373faa66a0562332ee24065ad1032d [0,2,0,0,0,0|2,0,0]=4 3705 B12R1.119 Cc1cccc(c1)NC(C)(C)C 62708c2bd281ff9df156c2aea8165c63 [0,2,0,0,0,0|2,0,0]=4 3706 B12R1.438 C#Cc1cccc(c1)NC(C)C 072249a3986c38fddcb6be0135aa07be [0,2,0,0,0,0|2,0,0]=4 3707 B12R1.438 C#Cc1cccc(c1)OC(C)C 99bebe74a0dec152fc399c49bf41ab27 [0,2,0,0,0,0|2,0,0]=4 3708 B12R1.438 C#Cc1cccc(n1)NC(C)C d83353bc8d5b20050d8b26775bf24b16 [0,2,0,0,0,0|1,0,0]=3 3709 B12R1.438 C#Cc1ccnc(c1)NC(C)C eb016b0e57d7892a80ee835f560003da [0,2,0,0,0,0|1,0,0]=3 3710 B12R1.438 C#Cc1ccnc(n1)NC(C)C 8885512f7f27604d5000bbecae5d5d06 [0,2,0,0,0,0|2,0,0]=4 3711 B12R1.438 C=Cc1cccc(c1)NC(C)C 44f99f3f736f8fbb53d56250eca6fc2d [0,2,0,0,0,0|2,0,0]=4 3712 B12R1.438 C=Cc1cccc(c1)OC(C)C aaa7ec7c9b22cec63f98cb575696cfc5 [0,2,0,0,0,0|2,0,0]=4 3713 B12R1.438 CC(C)Nc1cc(ccn1)C#N c9082136dca2ee885542afea672452be [0,2,0,0,0,0|1,0,0]=3 3714 B12R1.438 CC(C)Nc1cc(ccn1)CCl f44a141411815cc4df0128ba13cef009 [0,2,0,0,0,0|1,0,0]=3 3715 B12R1.438 CC(C)Nc1cc(ccn1)CO 6080abfe8eeb0b0006ea572bc4cd14e9 [0,2,0,0,0,0|1,0,0]=3 3716 B12R1.438 CC(C)Nc1cccc(c1)C#N 8e4d59a055e304d02518f03073200efa [0,2,0,0,0,0|2,0,0]=4 3717 B12R1.438 CC(C)Nc1cccc(c1)CBr 85c2d8585b2edbab393b973b1417bb53 [0,2,0,0,0,0|2,0,0]=4 3718 B12R1.438 CC(C)Nc1cccc(c1)CF dbd879566412fcd8363e57bef510c5f9 [0,2,0,0,0,0|2,0,0]=4 3719 B12R1.438 CC(C)Nc1cccc(c1)CO fc75fc740a569329c12318f6051b3a5e [0,2,0,0,0,0|2,0,0]=4 3720 B12R1.438 CC(C)Nc1cccc(n1)C#N 640ccd421174fa40e553111115dbe23b [0,2,0,0,0,0|1,0,0]=3 3721 B12R1.438 CC(C)Nc1cccc(n1)C=O 851b571ae291739e4e5964c877fd30d6 [0,2,0,0,0,0|1,0,0]=3 3722 B12R1.438 CC(C)Nc1cccc(n1)CO d99bf364a489f254e4cb7b206bc132fe [0,2,0,0,0,0|1,0,0]=3 3723 B12R1.438 CC(C)Nc1ccnc(n1)C#N 53b0cc6f4db912bc2daacef898ee93a5 [0,2,0,0,0,0|2,0,0]=4 3724 B12R1.438 CC(C)Nc1ccnc(n1)CCl 746b122256aa750d293a87377a916a1b [0,2,0,0,0,0|2,0,0]=4 3725 B12R1.438 CC(C)Nc1cncc(n1)C#N 6ddfc9698e55f250e73c7d52191b0ab4 [0,2,0,0,0,0|2,0,0]=4 3726 B12R1.438 CC(C)Nc1cncc(n1)CO 2afe3e2ef22d33608a64b558a951d09c [0,2,0,0,0,0|2,0,0]=4 3727 B12R1.438 CC(C)Nc1nccc(n1)C#N aca12a4100b6d172a7e87ebebbd2a937 [0,2,0,0,0,0|2,0,0]=4 3728 B12R1.438 CC(C)Nc1nccc(n1)CO 767cb95371a337f180c022f385b3188e [0,2,0,0,0,0|2,0,0]=4 3729 B12R1.438 CC(C)Oc1cc(ccn1)C#N 6b0a5ecf5ecb2a024d4c630df7a5a597 [0,2,0,0,0,0|1,0,0]=3 3730 B12R1.438 CC(C)Oc1cc(ccn1)C=O 517412a7ffc9096a7532eb824a96ded7 [0,2,0,0,0,0|1,0,0]=3 3731 B12R1.438 CC(C)Oc1cc(ncn1)C=O fc7b4be32132780a54a9e66cccc474b3 [0,2,0,0,0,0|2,0,0]=4 3732 B12R1.438 CC(C)Oc1cccc(c1)C#N 6269a85c3b23b7ec14b55d094cbc5998 [0,2,0,0,0,0|2,0,0]=4 3733 B12R1.438 CC(C)Oc1cccc(c1)C=O 38c2027ae121387f1f4e344f65c26cff [0,2,0,0,0,0|2,0,0]=4 3734 B12R1.438 CC(C)Oc1cccc(n1)C#N 22779b38d6f81c0b827622ed4edca61d [0,2,0,0,0,0|1,0,0]=3 3735 B12R1.438 CCc1cc(ncn1)OC(C)C 584ff3349db2e12e26f87e94928e4b52 [0,2,0,0,0,0|2,0,0]=4 3736 B12R1.438 CCc1cccc(c1)NC(C)C 804632297f29fdf0a11162bd8c1b96e0 [0,2,0,0,0,0|2,0,0]=4 3737 B12R1.438 CCc1cccc(c1)OC(C)C 1563f98e02639576b92e8ec328eb6057 [0,2,0,0,0,0|2,0,0]=4 3738 B12R1.438 CCc1ccnc(c1)NC(C)C 170919f1946c3b1d76026bfaebb734ae [0,2,0,0,0,0|1,0,0]=3 3739 B12R1.438 CCc1ccnc(n1)NC(C)C 33fec6a27ba266254cd816da8e59d0dd [0,2,0,0,0,0|2,0,0]=4 3740 B12R1.438 CCc1cncc(n1)OC(C)C b06fca753dd362e2c7293a753236929f [0,2,0,0,0,0|2,0,0]=4 3741 B12R1.438 CCc1cnnc(c1)OC(C)C b959c89271421a7de620b20fdc02b283 [0,2,0,0,0,0|2,0,0]=4 3742 B12R1.438 CCc1nccc(n1)OC(C)C d1e6b45bce56604b91852c7399a2cb93 [0,2,0,0,0,0|2,0,0]=4 3743 B12R1.438 COc1cccc(c1)NC(C)C d213ee741fc293232afa2f08da10a83a [0,2,0,0,0,0|2,0,0]=4 3744 B12R1.438 COc1cccc(c1)OC(C)C 6f8c6ff1542b239a8405bb976aacd35e [0,2,0,0,0,0|2,0,0]=4 3745 B12R1.438 COc1ccnc(c1)NC(C)C 51d4907b08ce1b115dcf2af5bfdc76f6 [0,2,0,0,0,0|1,0,0]=3 3746 B12R1.438 COc1ccnc(c1)OC(C)C 9f95a145c563e4bbe1e848cd1113d7d5 [0,2,0,0,0,0|1,0,0]=3 3747 B12R1.438 COc1ccnc(n1)NC(C)C 821c5d287cde3295f6e4f3569d56e858 [0,2,0,0,0,0|2,0,0]=4 3748 B12R1.438 COc1cnnc(c1)NC(C)C c807cbae14afb4b93f61cf292e03d50e [0,2,0,0,0,0|2,0,0]=4 3749 B12R1.438 COc1nccc(n1)NC(C)C 2f1c626265a1c0c7cf00aa14069b09e7 [0,2,0,0,0,0|2,0,0]=4 3750 B12R1.438 COc1nccc(n1)OC(C)C 204aaed48cb07e1bbcf5951219bad9fb [0,2,0,0,0,0|2,0,0]=4 3751 B12R1.438 CSc1cc(ncn1)NC(C)C 751cba4fa80e72c0c38a0109cd417f87 [0,2,0,0,0,0|2,0,0]=4 3752 B12R1.438 CSc1cccc(c1)NC(C)C 192603825632b8fee2c0c2a3ef649c93 [0,2,0,0,0,0|2,0,0]=4 3753 B12R1.438 CSc1cccc(c1)OC(C)C ad3aec57a579c1784e039ccebe1884c0 [0,2,0,0,0,0|2,0,0]=4 3754 B12R1.438 CSc1ccnc(n1)NC(C)C 7e011c7f35f852f08ec20a34c48f7504 [0,2,0,0,0,0|2,0,0]=4 3755 B12R1.438 CSc1nccc(n1)NC(C)C fce9b5215b374957e892e644b1522d6e [0,2,0,0,0,0|2,0,0]=4 3756 B10R1.66 CC(C)CNc1cc[nH]n1 d30f3d9f735de26e6dfb045fd907401f [0,0,1,1,0,0|2,0,0]=4 3757 B10R1.66 CC(C)CNc1cccs1 67dcb3c9cca955e96d2162e1f77ad9d3 [0,0,1,1,0,0|2,0,0]=4 3758 B10R1.66 CC(C)CNc1ccon1 603a476ab3e5d06007016561080e4211 [0,0,1,1,0,0|2,0,0]=4 3759 B10R1.66 CC(C)CNc1cocn1 45ddbb9a7109368c0c6340d68958763c [0,0,1,1,0,0|2,0,0]=4 3760 B10R1.66 CC(C)CNc1cscn1 84a1d8bf5382cf239191c71ffc20e506 [0,0,1,1,0,0|2,0,0]=4 3761 B10R1.66 CC(C)CNc1ncc[nH]1 9831b6d9d33420b283b5239da94f05d7 [0,0,1,1,0,0|2,0,0]=4 3762 B10R1.66 CC(C)CNc1ncco1 8259e209777df60cb7a7ca8861c36e93 [0,0,1,1,0,0|2,0,0]=4 3763 B10R1.66 CC(C)CNc1nccs1 57d5b8e82d624238ba5df3d643c93ee0 [0,0,1,1,0,0|2,0,0]=4 3764 B10R1.66 CC(C)COc1c[nH]cn1 5a6a70e59cd27d2b7c499cd9ff765ea7 [0,0,1,1,0,0|2,0,0]=4 3765 B10R1.66 CC(C)COc1ccco1 9a23c54afcd88900faea26a95d44c122 [0,0,1,1,0,0|2,0,0]=4 3766 B10R1.66 CC(C)COc1cccs1 c3a2875732f90e39bc97fc0388c7ee98 [0,0,1,1,0,0|2,0,0]=4 3767 B10R1.66 CC(C)COc1nccs1 c7d517a6b08e547f6b5f0267e322a342 [0,0,1,1,0,0|2,0,0]=4 3768 B10R1.66 CC(C)COn1cccn1 f2ab86970e2e625f8da0ffe6fabf186c [0,0,1,1,0,0|2,0,0]=4 3769 B10R1.180 C=C/C=C/C(=O)NC1CC1 f8bf20722b070cfd430fec827b3fd158 [0,0,1,1,0,0|2,0,0]=4 3770 B10R1.180 C=C/C=C\C(=O)NC1CC1 2fca2e0cb7766b311dcdb7053298b176 [0,0,1,1,0,0|2,0,0]=4 3771 B10R1.180 C=CC=CC(=O)NC1CC1 7d8d5af0c9a60cf7f610f6de6a5f3eb3 [0,0,1,1,0,0|2,0,0]=4 3772 B10R2.193 c1cc(co1)NC2CC2 6731c2251f866d9ad88bd656e4844633 [0,0,0,1,1,0|2,0,0]=4 3773 B10R2.193 c1cc(cs1)NC2CC2 fd6df036eb088cb3033620ead481a627 [0,0,0,1,1,0|2,0,0]=4 3774 B10R2.193 c1cc(cs1)OC2CC2 108cdba10863c72d0f5f9a0606e43b33 [0,0,0,1,1,0|2,0,0]=4 3775 B10R2.193 c1cc(n[nH]1)NC2CC2 c68a8c08457d5cc65e21655dd756f18f [0,0,0,1,1,0|2,0,0]=4 3776 B10R2.193 c1cnn(c1)OC2CC2 8b02ba4478bdf77c8683425e5984a0f0 [0,0,0,1,1,0|2,0,0]=4 3777 B10R2.193 c1coc(c1)OC2CC2 8985027cbca38de40f7977ffc4fa9731 [0,0,0,1,1,0|2,0,0]=4 3778 B10R2.193 c1coc(n1)NC2CC2 3ac008138901a81cc9d1e786fff3438e [0,0,0,1,1,0|2,0,0]=4 3779 B10R2.193 c1csc(n1)NC2CC2 8b25791cb25d86e962191a5c0fa30087 [0,0,0,1,1,0|2,0,0]=4 3780 B10R2.193 c1nc(c[nH]1)OC2CC2 7b8d58aef1c8875bcc52347aadcfdd89 [0,0,0,1,1,0|2,0,0]=4 3781 B12R2.11 CC1CC1Nc2ccccc2 6c2b1ed9451679c2c2b0f3748602bd6d [0,0,0,1,0,1|1,0,0]=3 3782 B12R2.11 CC1CC1Nc2cccnc2 e0f55178f08b4b2b54d9d876d97d2290 [0,0,0,1,0,1|2,0,0]=4 3783 B12R2.11 F[C@@H]1C[C@@H]1Nc2ccccc2 25c07123a823d9ea2969aff7da72cef4 [0,0,0,1,0,1|2,0,0]=4 3784 B12R2.11 F[C@@H]1C[C@@H]1Nc2ccccn2 fc41faec2161d9bc088f35169f0fc9e1 [0,0,0,1,0,1|1,0,0]=3 3785 B12R2.11 F[C@@H]1C[C@@H]1Nc2ccncn2 a97eeedc63e1e7d9830b83980c492513 [0,0,0,1,0,1|2,0,0]=4 3786 B12R2.11 F[C@@H]1C[C@@H]1Nc2cnccn2 17ad0f6a412e18d1388640b2dd918d1e [0,0,0,1,0,1|2,0,0]=4 3787 B12R2.11 F[C@@H]1C[C@H]1Nc2ccccc2 b0efbced164dabbe532e6255951097b4 [0,0,0,1,0,1|2,0,0]=4 3788 B12R2.11 F[C@@H]1C[C@H]1Nc2ccccn2 fc17ffe1e9ad6aa28e2159d2a121a181 [0,0,0,1,0,1|1,0,0]=3 3789 B12R2.11 F[C@@H]1C[C@H]1Nc2ccncn2 db20e6e5f8bed0c08026296876d7ccc8 [0,0,0,1,0,1|2,0,0]=4 3790 B12R2.11 F[C@@H]1C[C@H]1Nc2cnccn2 847448d513daab96512baf4a4956cf38 [0,0,0,1,0,1|2,0,0]=4 3791 B12R2.11 F[C@H]1C[C@@H]1Nc2ccccc2 e610ffc6a467ed241d6c7f91606b201b [0,0,0,1,0,1|2,0,0]=4 3792 B12R2.11 F[C@H]1C[C@@H]1Nc2ccccn2 59b89bc513bfcbe6b29399fe485506d9 [0,0,0,1,0,1|1,0,0]=3 3793 B12R2.11 F[C@H]1C[C@@H]1Nc2ccncn2 38cf8b56ac7318bbf6a7ae18fa483726 [0,0,0,1,0,1|2,0,0]=4 3794 B12R2.11 F[C@H]1C[C@@H]1Nc2cnccn2 0f117c1c77e8c296447cda49159d8ccc [0,0,0,1,0,1|2,0,0]=4 3795 B12R2.2057 c1cc(ccn1)COC2CC2 da3247f4bbaea1ae4c65fbee8045d76d [0,0,0,1,0,1|2,0,0]=4 3796 B12R2.2057 c1cc(ccn1)NCC2CC2 849918da92a0c0498a218bfd0f4ee058 [0,0,0,1,0,1|2,0,0]=4 3797 B12R2.2057 c1cc(ccn1)OCC2CC2 c00853e2b14f5a610ec89d61eadf6a66 [0,0,0,1,0,1|2,0,0]=4 3798 B12R2.2057 c1cc(ncn1)CNC2CC2 607a93e9573f0955e8a4018ddea58dfa [0,0,0,1,0,1|1,0,0]=3 3799 B12R2.2057 c1cc(ncn1)COC2CC2 81da20e8bc039a37530fbd5d1424e639 [0,0,0,1,0,1|1,0,0]=3 3800 B12R2.2057 c1cc(ncn1)NCC2CC2 0b7284e426d35bba207ddb7cef0d63f2 [0,0,0,1,0,1|1,0,0]=3 3801 B12R2.2057 c1ccc(cc1)CNC2CC2 0722218fcfefdcb8b8f0e8dc60326858 [0,0,0,1,0,1|1,0,0]=3 3802 B12R2.2057 c1ccc(cc1)COC2CC2 4f6efb1abdd284b3ec5fbe724b10a332 [0,0,0,1,0,1|1,0,0]=3 3803 B12R2.2057 c1ccc(cc1)NCC2CC2 14003b7d6af1ed476ecb017534f042ad [0,0,0,1,0,1|1,0,0]=3 3804 B12R2.2057 c1ccc(nc1)CNC2CC2 072625a4614190be9cbf10388fa5861b [0,0,0,1,0,1|0,0,0]=2 3805 B12R2.2057 c1ccc(nc1)COC2CC2 abde439d2a0ddaaa61aa7afca3b1da4d [0,0,0,1,0,1|0,0,0]=2 3806 B12R2.2057 c1ccc(nc1)NCC2CC2 a4bb220accadbaa000279249a4daf5cf [0,0,0,1,0,1|0,0,0]=2 3807 B12R2.2057 c1ccc(nc1)OCC2CC2 05ede210d3ae4cc4a2c3f7154d855ada [0,0,0,1,0,1|0,0,0]=2 3808 B12R2.2057 c1cnc(cn1)COC2CC2 fdc47d726f6cd28e1efa561853273f47 [0,0,0,1,0,1|1,0,0]=3 3809 B12R2.2057 c1cnc(cn1)NCC2CC2 a6ff6ae7eefb0681b8e64d1d299083be [0,0,0,1,0,1|1,0,0]=3 3810 B12R2.2057 c1cnc(cn1)OCC2CC2 b2726dc332261b3161c83cefeba4125b [0,0,0,1,0,1|1,0,0]=3 3811 B12R2.2057 c1cnc(nc1)CNC2CC2 7038fd05b2ef00331cb1adfd11eb9677 [0,0,0,1,0,1|1,0,0]=3 3812 B12R2.2057 c1cnc(nc1)COC2CC2 e4bd87d14e894bedbf03d18ff8ef7f2f [0,0,0,1,0,1|1,0,0]=3 3813 B12R2.2057 c1cnc(nc1)NCC2CC2 a4ccd00b4bac58720d9d1f0c5fd2db77 [0,0,0,1,0,1|1,0,0]=3 3814 B12R2.2057 c1cnc(nc1)OCC2CC2 9908e1fbd3e582816905ad7a5e8bbf5a [0,0,0,1,0,1|1,0,0]=3 3815 B12R2.2057 c1cnc(nn1)NCC2CC2 84d7ab3aedeb6ea313ccfe6bcb7dc29e [0,0,0,1,0,1|2,0,0]=4 3816 B12R2.2057 c1cncc(c1)CNC2CC2 de74061854556603c3b7f6c7b31bcca1 [0,0,0,1,0,1|2,0,0]=4 3817 B12R2.2057 c1cncc(c1)COC2CC2 4f1f4bbe9c5cccaf786a2469b1a1b939 [0,0,0,1,0,1|2,0,0]=4 3818 B12R2.2057 c1cncc(c1)NCC2CC2 116af6c2af65d4c96c0cfbf27938bace [0,0,0,1,0,1|2,0,0]=4 3819 B12R2.2057 c1cncc(c1)OCC2CC2 6e3515b4fef3884dcd9b31bc8938b0e1 [0,0,0,1,0,1|2,0,0]=4 3820 B12R2.2057 c1cnnc(c1)CNC2CC2 514c968ed269ecf84ec95620d443c6f3 [0,0,0,1,0,1|1,0,0]=3 3821 B12R2.2057 c1cnnc(c1)COC2CC2 5647e20affbc8a5d9e818133ea4a6290 [0,0,0,1,0,1|1,0,0]=3 3822 B12R2.2057 c1cnnc(c1)NCC2CC2 fd86c67f390e8038e0981f3804df0169 [0,0,0,1,0,1|1,0,0]=3 3823 B12R2.2057 c1ncnc(n1)NCC2CC2 3859ed969f7fea727adc81cc0df876f4 [0,0,0,1,0,1|2,0,0]=4 3824 B12R2.2057 c1nncc(n1)NCC2CC2 e4d7b52d075c0e4498614f6f085ad3ff [0,0,0,1,0,1|2,0,0]=4 3825 B12R2.294 Brc1cnc(nc1)NC2CC2 ffa03fbdbc34ebba507bac6a2c710b19 [0,1,0,1,0,0|2,0,0]=4 3826 B12R2.294 Cc1ccc(nc1)OC2CC2 9f6af58c9d3137ea63ab98a9845711a3 [0,1,0,1,0,0|1,0,0]=3 3827 B12R2.294 Cc1cnc(nc1)NC2CC2 d821ce5844ce18f3ace66ae43d0ee191 [0,1,0,1,0,0|2,0,0]=4 3828 B12R2.294 Clc1cnc(nc1)NC2CC2 13c1911f9e02540dda7a335339e6aeb2 [0,1,0,1,0,0|2,0,0]=4 3829 B12R2.294 Fc1ccc(nc1)OC2CC2 99f8ed0e6b200e7fdfa3e0a45a6713c7 [0,1,0,1,0,0|1,0,0]=3 3830 B12R2.294 Fc1cnc(nc1)NC2CC2 3fcfd6b0ec169539dee0db5121612afe [0,1,0,1,0,0|2,0,0]=4 3831 B12R2.294 Ic1ccc(nc1)OC2CC2 12433d0c59c33e9faab707f0b3d37172 [0,1,0,1,0,0|1,0,0]=3 3832 B12R2.294 Ic1cnc(nc1)NC2CC2 bcb551848642c896e872fe5a0148c48f [0,1,0,1,0,0|2,0,0]=4 3833 B12R2.294 Sc1ccc(cc1)NC2CC2 0824eade139ba6c64308f26ae03b3bd0 [0,1,0,1,0,0|2,0,0]=4 3834 B12R2.27 CCN1CC1c2ccccc2 9688627107d4117581407497e721ccee [0,1,0,1,0,0|2,0,0]=4 3835 B12R2.27 CCN1C[C@@H]1c2ccccc2 c32dec6f3160b9b7bc8c2839caf72878 [0,1,0,1,0,0|2,0,0]=4 3836 B12R2.27 FCN1CC1c2ccccc2 961cd8c1338ecdce6a27ac300fedcc98 [0,1,0,1,0,0|2,0,0]=4 3837 B12R2.27 FCN1C[C@@H]1c2ccccc2 186c23a739812eaa2456c8641683ea36 [0,1,0,1,0,0|2,0,0]=4 3838 B12R2.27 OCN1CC1c2ccccc2 380946bf56a518a4f82b6f06607820f1 [0,1,0,1,0,0|2,0,0]=4 3839 B12R2.27 OCN1C[C@@H]1c2ccccc2 b0131158d23691f2ccd2899d00b705c5 [0,1,0,1,0,0|2,0,0]=4 3840 B12R2.32 CCN1Cc2ccccc2C1 20c2942768350a956e6d394a0b65e9b5 [0,1,0,1,0,0|2,0,0]=4 3841 B12R2.32 CCN1Cc2cccnc2C1 8eff7749ade43972deb21bf7f1c49138 [0,1,0,1,0,0|1,0,0]=3 3842 B12R2.32 CCN1Cc2cncnc2C1 5992e52c291f7214513af80f9a4ae380 [0,1,0,1,0,0|2,0,0]=4 3843 B12R2.32 CCN1Cc2nccnc2C1 7e1bde9eaf2aacfd11ebe950511b0ec1 [0,1,0,1,0,0|2,0,0]=4 3844 B12R2.32 FCN1Cc2ccccc2C1 6ebe33568e88966b195306172afa5c83 [0,1,0,1,0,0|2,0,0]=4 3845 B12R2.32 FCN1Cc2cccnc2C1 2d880692ffc481b82e38df7d112397d9 [0,1,0,1,0,0|1,0,0]=3 3846 B12R2.32 FCN1Cc2cncnc2C1 6f81bca9b90354a2d858b15e65690fdd [0,1,0,1,0,0|2,0,0]=4 3847 B12R2.32 FCN1Cc2nccnc2C1 d5c461b714be198b9aaff058023ae0da [0,1,0,1,0,0|2,0,0]=4 3848 B12R2.32 O=CN1Cc2cccnc2C1 1f4bf6851ed9c560f3b39735c49c0112 [0,1,0,1,0,0|1,0,1]=4 3849 B12R2.32 OCN1Cc2ccccc2C1 67d53a903b838c41ecebb3a336e33160 [0,1,0,1,0,0|2,0,0]=4 3850 B12R2.32 OCN1Cc2cccnc2C1 95b006eb218084c5021f92d2645268ce [0,1,0,1,0,0|1,0,0]=3 3851 B12R2.32 OCN1Cc2cncnc2C1 fc95805bc891489dfc958be063609278 [0,1,0,1,0,0|2,0,0]=4 3852 B12R2.32 OCN1Cc2nccnc2C1 8939ea4fb517c440e20ab117fa53e1de [0,1,0,1,0,0|2,0,0]=4 3853 B12R2.2058 c1cc(ncn1)CN2CCC2 2c3f0723d6a6c39b79fc11c5b6517191 [0,1,0,1,0,0|2,0,0]=4 3854 B12R2.2058 c1ccc(cc1)CN2CCC2 79f0a156a4476249fe3e90dbe2fa6274 [0,1,0,1,0,0|2,0,0]=4 3855 B12R2.2058 c1ccc(cc1)NC2COC2 638d2081ed3e07246cd09300ecb8f6dc [0,1,0,1,0,0|2,0,0]=4 3856 B12R2.2058 c1ccc(nc1)CN2CCC2 ad09a5bf93c910029918799e4e089e07 [0,1,0,1,0,0|1,0,0]=3 3857 B12R2.2058 c1ccc(nc1)NC2CCC2 fb43cdd397450ab6a78add51a3593170 [0,1,0,1,0,0|1,0,0]=3 3858 B12R2.2058 c1ccc(nc1)OC2CCC2 01ad94c84aae3cf4e74cc0f7661c85b5 [0,1,0,1,0,0|1,0,0]=3 3859 B12R2.2058 c1ccc(nc1)OC2COC2 e57c93d451b0b6b991d0fd1596a311ca [0,1,0,1,0,0|1,0,0]=3 3860 B12R2.2058 c1cnc(cn1)NC2CCC2 44336cb13f75395d2c0705f2ea1af01f [0,1,0,1,0,0|2,0,0]=4 3861 B12R2.2058 c1cnc(nc1)CN2CCC2 e49193a30133e7c17126c4ae8f6bba56 [0,1,0,1,0,0|2,0,0]=4 3862 B12R2.2058 c1cnc(nc1)NC2CCC2 87105cdc2fd6ed90dabb412e16866fdf [0,1,0,1,0,0|2,0,0]=4 3863 B12R2.2058 c1cnc(nc1)NC2COC2 9193c846df9ff55a5933be2d90f6c6ee [0,1,0,1,0,0|2,0,0]=4 3864 B12R2.2058 c1cnc(nc1)OC2CCC2 80c1d6d72ca9dfb2721cf7eb39eba55e [0,1,0,1,0,0|2,0,0]=4 3865 B12R2.2058 c1cnnc(c1)CN2CCC2 6ffec972d2f9ac52f4eceae0deced11c [0,1,0,1,0,0|2,0,0]=4 3866 B12R2.225 Brc1nccnc1OC2CC2 89b9e53b010138744352f76f7211fd00 [0,1,0,1,0,0|2,0,0]=4 3867 B12R2.225 Cc1ccnnc1OC2CC2 4bddfb583d6938a17292f68a70ecda33 [0,1,0,1,0,0|2,0,0]=4 3868 B12R2.225 Clc1ccccc1OC2CC2 a4bab8f7130a623ddfe359429eb2845e [0,1,0,1,0,0|2,0,0]=4 3869 B12R2.225 Clc1nccnc1NC2CC2 96c35c539eb694298491bab562821218 [0,1,0,1,0,0|2,0,0]=4 3870 B12R2.225 Ic1cccnc1NC2CC2 2ce12d1826e4be845ccc349d3cfb47f3 [0,1,0,1,0,0|1,0,0]=3 3871 B12R2.225 Ic1ccnnc1OC2CC2 072adf1a765faa8636820ab082a08bab [0,1,0,1,0,0|2,0,0]=4 3872 B12R2.225 [O-][n+]1ccccc1NC2CC2 36df9849533d89bff62e8f6e28f1d000 [0,1,0,1,0,0|1,0,1]=4 3873 B12R2.1286 Brc1cccc(c1)OC2CC2 86a1316c992baf3081c1c927bc09a287 [0,1,0,1,0,0|2,0,0]=4 3874 B12R2.1286 Brc1ccnc(c1)OC2CC2 56f53d4579eb0d345131a470f1333f5b [0,1,0,1,0,0|1,0,0]=3 3875 B12R2.1286 Brc1ccnc(n1)NC2CC2 74ee15b5db29239934a71bb4c5f45f6e [0,1,0,1,0,0|2,0,0]=4 3876 B12R2.1286 Brc1nccc(n1)NC2CC2 279babfd48cd6d9cf5d9558525b452c4 [0,1,0,1,0,0|2,0,0]=4 3877 B12R2.1286 Cc1cccc(c1)NC2CC2 5416fc1bda4e7fcd886b594e4b5d1c15 [0,1,0,1,0,0|2,0,0]=4 3878 B12R2.1286 Cc1cccc(c1)OC2CC2 c5e41ef21eaec44bf0109887340004b0 [0,1,0,1,0,0|2,0,0]=4 3879 B12R2.1286 Cc1ccnc(n1)NC2CC2 8dbd61b0190626d6d45b2ac20776c173 [0,1,0,1,0,0|2,0,0]=4 3880 B12R2.1286 Clc1cccc(c1)NC2CC2 da0b3d09a41ad9d3b62eef57d7091303 [0,1,0,1,0,0|2,0,0]=4 3881 B12R2.1286 Clc1cccc(c1)OC2CC2 3517e32596ee199dca8f3a8989d328df [0,1,0,1,0,0|2,0,0]=4 3882 B12R2.1286 Clc1ccnc(n1)NC2CC2 f23769d364cc14d31b664979425f6f95 [0,1,0,1,0,0|2,0,0]=4 3883 B12R2.1286 Fc1cccc(c1)NC2CC2 f9cd48a2521ccf98e9a7217233e95127 [0,1,0,1,0,0|2,0,0]=4 3884 B12R2.1286 Fc1cccc(c1)OC2CC2 fd5bcec64f0f04cfa2f0c44c0567737a [0,1,0,1,0,0|2,0,0]=4 3885 B12R2.1286 Fc1ccnc(c1)OC2CC2 cb8fe06e3601af9cc6bb580acfbd65f3 [0,1,0,1,0,0|1,0,0]=3 3886 B12R2.1286 Fc1ccnc(n1)NC2CC2 5a122b9d8bb4f0cca4273c3d5cdc6200 [0,1,0,1,0,0|2,0,0]=4 3887 B12R2.1286 Fc1nccc(n1)NC2CC2 a2c546fa4fe3ac78675c826e56bbdea0 [0,1,0,1,0,0|2,0,0]=4 3888 B12R2.1286 Ic1cccc(c1)OC2CC2 c806530f93f705072682a29e36637503 [0,1,0,1,0,0|2,0,0]=4 3889 B12R2.1286 Ic1ccnc(n1)NC2CC2 6526715a67c834175cdceb16c01341d2 [0,1,0,1,0,0|2,0,0]=4 3890 B12R2.1286 O=c1nc(cc[nH]1)NC2CC2 db06f06ee704aac7e2935592af68a2ee [0,1,0,1,0,0|2,0,0]=4 3891 B12R2.1286 Sc1cccc(c1)OC2CC2 5fb16c6390673deaae2d1fc21856fb80 [0,1,0,1,0,0|2,0,0]=4 3892 B12R2.1286 Sc1ccnc(n1)NC2CC2 c0ca70a05c5e8ad32f3af9830ec53c90 [0,1,0,1,0,0|2,0,0]=4 3893 B8R1.8 CCNc1cc[nH]n1 1ec90843b0b722deac22a6d0b9230c30 [1,0,0,0,1,0|2,0,0]=4 3894 B8R1.8 CCNc1cccs1 f92887221cdfe270aa88f70a5b6538c3 [1,0,0,0,1,0|2,0,0]=4 3895 B8R1.8 CCNc1ccon1 1b2b81379cbfa300ef6ff7f035534561 [1,0,0,0,1,0|2,0,0]=4 3896 B8R1.8 CCNc1ccsc1 cda8850b0edc8792e319ed7aad994bf3 [1,0,0,0,1,0|2,0,0]=4 3897 B8R1.8 CCNc1cocn1 d8e901dc9f64240d769713656ef981d4 [1,0,0,0,1,0|2,0,0]=4 3898 B8R1.8 CCNc1cscn1 deb4d5205f2d6ad6b5aceaad6dba2646 [1,0,0,0,1,0|2,0,0]=4 3899 B8R1.8 CCNc1ncc[nH]1 9c694d8670fe0b12710364903a725787 [1,0,0,0,1,0|2,0,0]=4 3900 B8R1.8 CCNc1ncco1 9fef4809a1ac3d1c666a8faacb65e06b [1,0,0,0,1,0|2,0,0]=4 3901 B8R1.8 CCNc1nccs1 80b16777a8c3f760bbf265ac2cdb6521 [1,0,0,0,1,0|2,0,0]=4 3902 B8R1.8 CCOc1c[nH]cn1 5a57d5d014ff5f703d52daf8ebbbcbe1 [1,0,0,0,1,0|2,0,0]=4 3903 B8R1.8 CCOc1ccco1 e09af78840aa7c50339c3ce236ba2f4c [1,0,0,0,1,0|2,0,0]=4 3904 B8R1.8 CCOc1cccs1 d21292a98c2ee3c1ea9b8b00e074b6ef [1,0,0,0,1,0|2,0,0]=4 3905 B8R1.8 CCOc1ccsc1 e97ca04b8e5d46ec67b2ebe625463cd4 [1,0,0,0,1,0|2,0,0]=4 3906 B8R1.8 CCOc1nccs1 c7bf9113a012f962fcb198e0f8e767fe [1,0,0,0,1,0|2,0,0]=4 3907 B8R1.8 CCOn1cccn1 770cadc5246353a2a295ab96e14141ca [1,0,0,0,1,0|2,0,0]=4 3908 B10R0.27 C=CCC(C=C)OCC(C)C fd4cdc4d6ead9e6b8dc2c5bb09c3c006 [0,0,1,0,0,1|1,0,1]=4 3909 B12R1.252 C/C(=C/CNc1ccccn1)/I 437ee973631c41e00826fe572ef2e5c7 [0,0,0,0,0,2|1,0,1]=4 3910 B12R1.252 C/C(=C/COc1ccccn1)/I 31dad9b4a4a8f375519849e0f44f4f8c [0,0,0,0,0,2|1,0,1]=4 3911 B12R1.252 C/C(=C\CNc1ccccn1)/Cl 590fd3d80d668b7e3a995a436c682a4b [0,0,0,0,0,2|1,0,1]=4 3912 B12R1.252 C/C(=C\COc1ccccn1)/Cl 29080526a74108644cb2d8ec861a4a93 [0,0,0,0,0,2|1,0,1]=4 3913 B12R1.252 C=C(C)CCNc1ccccn1 5994b7e570337056fbe6b8ee68c83a74 [0,0,0,0,0,2|0,0,2]=4 3914 B12R1.252 C=C(C)CCOc1ccccn1 b9dcf3d8853aa13bb161ef3e0a8cb2ac [0,0,0,0,0,2|0,0,2]=4 3915 B12R1.252 C=C(C)CNCc1ccccn1 788a85ae04da57a30dfed7c4f6861e88 [0,0,0,0,0,2|0,0,2]=4 3916 B12R1.252 C=C(C)COCc1ccccn1 6969eb42119ffe7768529c61d80d21e6 [0,0,0,0,0,2|0,0,2]=4 3917 B12R1.252 CC(=CCNc1ccccc1)C eb01c4541faf3d2e0c0e5ab3c7071819 [0,0,0,0,0,2|1,0,1]=4 3918 B12R1.252 CC(=CCNc1ccccn1)C 56e563f46b93659f933bfe2f6122c220 [0,0,0,0,0,2|0,0,1]=3 3919 B12R1.252 CC(=CCNc1ccccn1)Cl 5a2e1f77b2fbb7778ba6a16fff6fa4d5 [0,0,0,0,0,2|1,0,1]=4 3920 B12R1.252 CC(=CCNc1ccccn1)I 808c67d94f67dfaa182a81c605f3c89d [0,0,0,0,0,2|1,0,1]=4 3921 B12R1.252 CC(=CCNc1cccnn1)C 05cd92fe72daa192af1c1629c0ba469f [0,0,0,0,0,2|1,0,1]=4 3922 B12R1.252 CC(=CCNc1ccncn1)C 45ea9b994140dff285bd65308e0498d4 [0,0,0,0,0,2|1,0,1]=4 3923 B12R1.252 CC(=CCNc1cnccn1)C a6a45cf44a8dfb07f364345c191f2260 [0,0,0,0,0,2|1,0,1]=4 3924 B12R1.252 CC(=CCNc1ncccn1)C db082fe6ac3ca8b697f2cd80c1eddd8c [0,0,0,0,0,2|1,0,1]=4 3925 B12R1.252 CC(=CCOc1ccccn1)C 375413cc9583b62c463032d8fc2215ec [0,0,0,0,0,2|0,0,1]=3 3926 B12R1.252 CC(=CCOc1ccccn1)Cl 5defcd22d76b3c173f83b078fc1df9ea [0,0,0,0,0,2|1,0,1]=4 3927 B12R1.252 CC(=CCOc1ccccn1)I b4714aeb2d7e1a51722b709922c2cafb [0,0,0,0,0,2|1,0,1]=4 3928 B12R1.252 CC(=CCOc1cnccn1)C 823470a3be6eead9fe26a9645b6fc2da [0,0,0,0,0,2|1,0,1]=4 3929 B12R1.252 CC(=CCOc1ncccn1)C 0c3b176ea604e33adcd7c515a82670cf [0,0,0,0,0,2|1,0,1]=4 3930 B12R1.252 CC(=O)CCNc1ccccn1 997919901794ee27201838f3f268a693 [0,0,0,0,0,2|1,0,1]=4 3931 B12R1.252 CC(=O)CCOc1ccccn1 f0d6b589e7af691479be38abbd6bcdf3 [0,0,0,0,0,2|1,0,1]=4 3932 B12R1.252 CC(=O)CNCc1ccccn1 6857f6976c347e411d9abdd48f8982fb [0,0,0,0,0,2|1,0,1]=4 3933 B12R1.252 CC(=O)COCc1ccccn1 f8ed3ffb815bee7f1737eacfe042d64f [0,0,0,0,0,2|1,0,1]=4 3934 B12R1.252 CC(=O)NCCc1ccccn1 3ad8e2876430ef8ccd3cbeba8ed6119f [0,0,0,0,0,2|1,0,1]=4 3935 B12R1.252 CC(=O)OCNc1ccccn1 a41f1b71ededa97eb4355e9af8654026 [0,0,0,0,0,2|1,0,1]=4 3936 B12R1.252 CC(=O)OCOc1ccccn1 86abcd8d807149e2e6ef73302de6ba90 [0,0,0,0,0,2|1,0,1]=4 3937 B12R1.252 CC(C)CCNc1ccccc1 a9665cd268e7b4518a4ee939be46ff28 [0,0,0,0,0,2|1,0,0]=3 3938 B12R1.252 CC(C)CCNc1ccccn1 5b6942b64e33834b458baec7cf378581 [0,0,0,0,0,2|0,0,0]=2 3939 B12R1.252 CC(C)CCNc1cccnc1 69f5877c25712220cf9d8582cf74056f [0,0,0,0,0,2|2,0,0]=4 3940 B12R1.252 CC(C)CCNc1cccnn1 49603a690558b49ae61b3e35c8c0d434 [0,0,0,0,0,2|1,0,0]=3 3941 B12R1.252 CC(C)CCNc1ccncc1 51f5e7e7cccdd7bf4f868dbc1d306bf9 [0,0,0,0,0,2|2,0,0]=4 3942 B12R1.252 CC(C)CCNc1ccncn1 ecd6f70845650d07dedc7bc6c4ecaf3e [0,0,0,0,0,2|1,0,0]=3 3943 B12R1.252 CC(C)CCNc1cnccn1 97e2470ed9c067d0275d682bf33fd1a4 [0,0,0,0,0,2|1,0,0]=3 3944 B12R1.252 CC(C)CCNc1cnncn1 443264a52a34d8b730661d2defb118ce [0,0,0,0,0,2|2,0,0]=4 3945 B12R1.252 CC(C)CCNc1ncccn1 fa06639a03be4eb7f54f05de582700f7 [0,0,0,0,0,2|1,0,0]=3 3946 B12R1.252 CC(C)CCNc1nccnn1 ab73286e31172121b9f2ab5596f94690 [0,0,0,0,0,2|2,0,0]=4 3947 B12R1.252 CC(C)CCNc1ncncn1 cbac2c92e2689ced7a377f32ce0d7708 [0,0,0,0,0,2|2,0,0]=4 3948 B12R1.252 CC(C)CCOc1ccccn1 7f883afab874ab8f83be331ad8cd7edb [0,0,0,0,0,2|0,0,0]=2 3949 B12R1.252 CC(C)CCOc1cccnc1 b89b58f2b508e626016a4b78466a2d25 [0,0,0,0,0,2|2,0,0]=4 3950 B12R1.252 CC(C)CCOc1ccncc1 d280f435e28fd77803bc44ac9ebf5e18 [0,0,0,0,0,2|2,0,0]=4 3951 B12R1.252 CC(C)CCOc1cnccn1 73ba6622223f14158ed8b6786344556e [0,0,0,0,0,2|1,0,0]=3 3952 B12R1.252 CC(C)CCOc1cncnn1 dee774261a720478b4cf30e5783e4173 [0,0,0,0,0,2|2,0,0]=4 3953 B12R1.252 CC(C)CCOc1ncccn1 d292c3b5e983ca259d629766547f8fee [0,0,0,0,0,2|1,0,0]=3 3954 B12R1.252 CC(C)CNCc1ccccc1 c48ab8ad76cb980676fd518bfed01255 [0,0,0,0,0,2|1,0,0]=3 3955 B12R1.252 CC(C)CNCc1ccccn1 6d7ebb6c45d12163344e2670abad50d7 [0,0,0,0,0,2|0,0,0]=2 3956 B12R1.252 CC(C)CNCc1cccnc1 317cc81cae733d174c088ce8c918791e [0,0,0,0,0,2|2,0,0]=4 3957 B12R1.252 CC(C)CNCc1cccnn1 84be549ae7f23e584a9cd16132c3740f [0,0,0,0,0,2|1,0,0]=3 3958 B12R1.252 CC(C)CNCc1ccncc1 e68ace07204ad5f64fa8daf124fe226c [0,0,0,0,0,2|2,0,0]=4 3959 B12R1.252 CC(C)CNCc1ccncn1 7c1867cd40dfe052b1c70621dd586356 [0,0,0,0,0,2|1,0,0]=3 3960 B12R1.252 CC(C)CNCc1cnccn1 0929626c3926e9b5408d0567fa20c060 [0,0,0,0,0,2|1,0,0]=3 3961 B12R1.252 CC(C)CNCc1ncccn1 056b2d50b9d93d6eca9e998d6d806e1a [0,0,0,0,0,2|1,0,0]=3 3962 B12R1.252 CC(C)COCc1ccccc1 5769ac6c29ea9be863f0068a3148d1e9 [0,0,0,0,0,2|1,0,0]=3 3963 B12R1.252 CC(C)COCc1ccccn1 41f471be8d0443a395a59a6edd4b2170 [0,0,0,0,0,2|0,0,0]=2 3964 B12R1.252 CC(C)COCc1cccnc1 e949ee90c476dd3afee631c02891b751 [0,0,0,0,0,2|2,0,0]=4 3965 B12R1.252 CC(C)COCc1cccnn1 bcec46c8daa86302f285ba1f41a4db4d [0,0,0,0,0,2|1,0,0]=3 3966 B12R1.252 CC(C)COCc1ccncc1 243716518cbf836169ff83c6e87d1a68 [0,0,0,0,0,2|2,0,0]=4 3967 B12R1.252 CC(C)COCc1ccncn1 504e9144090fa54e034f83efb4a8bc6c [0,0,0,0,0,2|1,0,0]=3 3968 B12R1.252 CC(C)COCc1cnccn1 54d1f572f89be35af98ac5c6d0a00bd4 [0,0,0,0,0,2|1,0,0]=3 3969 B12R1.252 CC(C)COCc1ncccn1 33688b887bd33e4027684b65bbdc620c [0,0,0,0,0,2|1,0,0]=3 3970 B12R1.252 CC(C)NCCc1ccccc1 800f62166be48d31d0f1f8e8246a3d11 [0,0,0,0,0,2|1,0,0]=3 3971 B12R1.252 CC(C)NCCc1ccccn1 60db3ccccaed87369474311fbbb2ee61 [0,0,0,0,0,2|0,0,0]=2 3972 B12R1.252 CC(C)NCCc1cccnc1 f39609cf740b878733069b3389a379d4 [0,0,0,0,0,2|2,0,0]=4 3973 B12R1.252 CC(C)NCCc1ccncc1 2e03fedf55e71e95c0abd0f4865dc22e [0,0,0,0,0,2|2,0,0]=4 3974 B12R1.252 CC(C)NCCc1ccncn1 f7502abf563207bb5d53cb2d326dbabf [0,0,0,0,0,2|1,0,0]=3 3975 B12R1.252 CC(C)NCCc1cnccn1 35c3b70c1897dffd7b3a32c2343123fc [0,0,0,0,0,2|1,0,0]=3 3976 B12R1.252 CC(C)NCCc1ncccn1 794cc03a494745a4fc8f3acdee35c851 [0,0,0,0,0,2|1,0,0]=3 3977 B12R1.252 CC(C)OCCc1ccccc1 cd2036e50db53ec52d80c5b70290b19c [0,0,0,0,0,2|1,0,0]=3 3978 B12R1.252 CC(C)OCCc1ccccn1 618810b4708a73ec52035c34c4054b87 [0,0,0,0,0,2|0,0,0]=2 3979 B12R1.252 CC(C)OCCc1cccnc1 ad83d4217e0420d4f686447a978fc953 [0,0,0,0,0,2|2,0,0]=4 3980 B12R1.252 CC(C)OCCc1ccncc1 07cefd4f30952a7fff1efa12f3f8cb0e [0,0,0,0,0,2|2,0,0]=4 3981 B12R1.252 CC(C)OCCc1ccncn1 f1ce6c97a497c9e91937eebb9f30c7a6 [0,0,0,0,0,2|1,0,0]=3 3982 B12R1.252 CC(C)OCCc1cnccn1 ae26b65e22ea6fcf5c22fdff048110ff [0,0,0,0,0,2|1,0,0]=3 3983 B12R1.252 CC(C)OCCc1ncccn1 c1c5cf56502b5e60b3dba4a7a219c587 [0,0,0,0,0,2|1,0,0]=3 3984 B12R1.252 CC(C)OCNc1ccccc1 4ab9f406843d3d3dea8c678f7ec5fd29 [0,0,0,0,0,2|1,0,0]=3 3985 B12R1.252 CC(C)OCNc1ccccn1 f79533e956cd51a6f0cee4ac927e1136 [0,0,0,0,0,2|0,0,0]=2 3986 B12R1.252 CC(C)OCNc1cccnc1 6dd37a3ca9a4168d344f1af36676e50f [0,0,0,0,0,2|2,0,0]=4 3987 B12R1.252 CC(C)OCNc1cccnn1 4233edd1b8acbdda6e2ed07ac97c4f18 [0,0,0,0,0,2|1,0,0]=3 3988 B12R1.252 CC(C)OCNc1ccncc1 8f9b47fcb224f8aeae405dd2ac59e733 [0,0,0,0,0,2|2,0,0]=4 3989 B12R1.252 CC(C)OCNc1ccncn1 1fabcbbfa80bb30d20791ae9f3c3ce8d [0,0,0,0,0,2|1,0,0]=3 3990 B12R1.252 CC(C)OCNc1cnccn1 1ae9e037a0f2b87cad7a04a6488d98a1 [0,0,0,0,0,2|1,0,0]=3 3991 B12R1.252 CC(C)OCNc1cnncn1 d9b5a643672e4561313c8f1921165709 [0,0,0,0,0,2|2,0,0]=4 3992 B12R1.252 CC(C)OCNc1ncccn1 0c1046b7f6674f6f89d655b1c355fded [0,0,0,0,0,2|1,0,0]=3 3993 B12R1.252 CC(C)OCNc1nccnn1 0a5b8da3a38e5120f028a1c30c7fd3e6 [0,0,0,0,0,2|2,0,0]=4 3994 B12R1.252 CC(C)OCNc1ncncn1 e97a527ee0e7b907b5e49be7de4cd872 [0,0,0,0,0,2|2,0,0]=4 3995 B12R1.252 CC(C)OCOc1ccccn1 1f60fa9657a31d54ae86707f451d8353 [0,0,0,0,0,2|0,0,0]=2 3996 B12R1.252 CC(C)OCOc1cccnc1 0adf6c0a61ffae293502a60ec48e9b78 [0,0,0,0,0,2|2,0,0]=4 3997 B12R1.252 CC(C)OCOc1ccncc1 2419024f861ffb40c39021803c819ad7 [0,0,0,0,0,2|2,0,0]=4 3998 B12R1.252 CC(C)OCOc1cnccn1 8b455fe88e72e81fb797f6202bd7e240 [0,0,0,0,0,2|1,0,0]=3 3999 B12R1.252 CC(C)OCOc1ncccn1 54d4d12d600bf11bfd6c053363cfc867 [0,0,0,0,0,2|1,0,0]=3 4000 B12R1.252 CC(F)COCc1ccccc1 ceaaa348669e5aa8cbad2a4c64558f8e [0,0,0,0,0,2|2,0,0]=4 4001 B12R1.252 CC(F)COCc1ccccn1 476695497df80cb7c084184b5b43d035 [0,0,0,0,0,2|1,0,0]=3 4002 B12R1.252 CC(F)COCc1cccnn1 a8676d0003d9a388121c44b40728d121 [0,0,0,0,0,2|2,0,0]=4 4003 B12R1.252 CC(F)COCc1ccncn1 e66fcc367d7980f6bc6aae01f6a3dcca [0,0,0,0,0,2|2,0,0]=4 4004 B12R1.252 CC(F)COCc1ncccn1 b164a01eba2e6ffed2b68a89c16a263d [0,0,0,0,0,2|2,0,0]=4 4005 B12R1.252 CC(O)CCNc1ccccc1 5c6c9358fbd8939fc6c9f54dcb2d3a37 [0,0,0,0,0,2|2,0,0]=4 4006 B12R1.252 CC(O)CCNc1ccccn1 97031b4d64979d289ef04acc206d003e [0,0,0,0,0,2|1,0,0]=3 4007 B12R1.252 CC(O)CCNc1cccnn1 47b97190e8ab1842f9cd5e0dee7ed3e8 [0,0,0,0,0,2|2,0,0]=4 4008 B12R1.252 CC(O)CCNc1ccncn1 ebd00d7ab06f73cce67a72b6f0de4119 [0,0,0,0,0,2|2,0,0]=4 4009 B12R1.252 CC(O)CCNc1cnccn1 6eb47df63aaf1411aa20597fd2d69a7f [0,0,0,0,0,2|2,0,0]=4 4010 B12R1.252 CC(O)CCNc1ncccn1 225479af487259f3587dee9eb87e8f0e [0,0,0,0,0,2|2,0,0]=4 4011 B12R1.252 CC(O)CNCc1ccccc1 19d19f96fb686d7cbd72f5df359e9dd8 [0,0,0,0,0,2|2,0,0]=4 4012 B12R1.252 CC(O)CNCc1ccccn1 e28c29c938e18ad1238cd975f89a06a8 [0,0,0,0,0,2|1,0,0]=3 4013 B12R1.252 CC(O)CNCc1cccnn1 ca0f502bcc801933ee5c767e5093148e [0,0,0,0,0,2|2,0,0]=4 4014 B12R1.252 CC(O)CNCc1ccncn1 7a5d78fb681ded42d2d147fe1c55e164 [0,0,0,0,0,2|2,0,0]=4 4015 B12R1.252 CC(O)CNCc1cnccn1 c8835bddb9845c918606787997b443d4 [0,0,0,0,0,2|2,0,0]=4 4016 B12R1.252 CC(O)CNCc1ncccn1 94e03f4ed43c28d3bc90554d2a7d489e [0,0,0,0,0,2|2,0,0]=4 4017 B12R1.252 CC(S)COCc1ccccc1 a2dbb8c27ced04cd31e27a2a08aed095 [0,0,0,0,0,2|2,0,0]=4 4018 B12R1.252 CC(S)COCc1ccccn1 a4f3c7b4dcc63c52aaa45bb366b1ace4 [0,0,0,0,0,2|1,0,0]=3 4019 B12R1.252 CC(S)COCc1cccnn1 d2ecb2d0e631a99f442e857229dbdd98 [0,0,0,0,0,2|2,0,0]=4 4020 B12R1.252 CC(S)COCc1ccncn1 950c30d73f3928e6c48b7ade8fe9fd37 [0,0,0,0,0,2|2,0,0]=4 4021 B12R1.252 CC(S)COCc1ncccn1 f43e202e339061758ab99ff5a34648cc [0,0,0,0,0,2|2,0,0]=4 4022 B12R1.252 CN(C)CCNc1ccccc1 d3b2e620d30900fb427915c44cfde5dc [0,0,0,0,0,2|2,0,0]=4 4023 B12R1.252 CN(C)CCNc1ccccn1 3770115323c648ae32f4fd74bb45de81 [0,0,0,0,0,2|1,0,0]=3 4024 B12R1.252 CN(C)CCNc1cccnn1 f51377c01c96fdc88384854f00f73356 [0,0,0,0,0,2|2,0,0]=4 4025 B12R1.252 CN(C)CCNc1ccncn1 2cd4d55888d8939bc08798c6d2948753 [0,0,0,0,0,2|2,0,0]=4 4026 B12R1.252 CN(C)CCNc1cnccn1 99b5e064c6c4102ef678e43c645d6e69 [0,0,0,0,0,2|2,0,0]=4 4027 B12R1.252 CN(C)CCNc1ncccn1 e3fe9f2518c45b2b62ecc9487a8fd94e [0,0,0,0,0,2|2,0,0]=4 4028 B12R1.252 CN(C)CCOc1ccccn1 97e00588b90af414fe2d070a8bfe7282 [0,0,0,0,0,2|1,0,0]=3 4029 B12R1.252 CN(C)CCOc1cnccn1 be4a48ac312e1b2ba1ac35f772f0f9b6 [0,0,0,0,0,2|2,0,0]=4 4030 B12R1.252 CN(C)CCOc1ncccn1 34eb8e7b8b85574aadca6c16e5735743 [0,0,0,0,0,2|2,0,0]=4 4031 B12R1.252 CN(C)CNCc1ccccc1 0202e986c8da8d9c48034425b18c3dfe [0,0,0,0,0,2|2,0,0]=4 4032 B12R1.252 CN(C)CNCc1ccccn1 3e94ae66f4eb87252a917a8d226960eb [0,0,0,0,0,2|1,0,0]=3 4033 B12R1.252 CN(C)CNCc1cccnn1 edb85eed85dffb6aff21e0071b036dad [0,0,0,0,0,2|2,0,0]=4 4034 B12R1.252 CN(C)CNCc1ccncn1 9cbfae7e21c8e5ae4be1bdaf6d3e5fc5 [0,0,0,0,0,2|2,0,0]=4 4035 B12R1.252 CN(C)CNCc1cnccn1 303398dd218f1390f1eac5b97feabe25 [0,0,0,0,0,2|2,0,0]=4 4036 B12R1.252 CN(C)CNCc1ncccn1 fdfb181a4e6f4f1b9fe86f84f07b4b69 [0,0,0,0,0,2|2,0,0]=4 4037 B12R1.252 CN(C)COCc1ccccc1 a063060d7f5ce478c07330412cbf8447 [0,0,0,0,0,2|2,0,0]=4 4038 B12R1.252 CN(C)COCc1ccccn1 3a10a8f32d4655fe62f905c50c31c2d8 [0,0,0,0,0,2|1,0,0]=3 4039 B12R1.252 CN(C)COCc1cccnn1 ac01354b378cf6d9281d0c823aad81fa [0,0,0,0,0,2|2,0,0]=4 4040 B12R1.252 CN(C)COCc1ccncn1 9446e89009038eaf9cd705f7ab1acfe9 [0,0,0,0,0,2|2,0,0]=4 4041 B12R1.252 CN(C)COCc1cnccn1 9470c70b6acb2c5f48e9d9b28b3f08b2 [0,0,0,0,0,2|2,0,0]=4 4042 B12R1.252 CN(C)COCc1ncccn1 c0cf83d068e46c7499100bd0e82240bf [0,0,0,0,0,2|2,0,0]=4 4043 B12R1.252 CS(=O)CCNc1ccccn1 32809cdd694b5d2997184adf79ab8936 [0,0,0,0,0,2|2,0,0]=4 4044 B12R1.252 CS(=O)CCOc1ccccn1 30133f9bf19ef8b3fdfb27b7644f2fa7 [0,0,0,0,0,2|2,0,0]=4 4045 B12R1.252 C[C@@H](F)COCc1ccccc1 ba1a50f79e3a1a52d90fe2949f8a3658 [0,0,0,0,0,2|2,0,0]=4 4046 B12R1.252 C[C@@H](F)COCc1ccccn1 25305c43f86a522a8b001eca7d58c6e1 [0,0,0,0,0,2|1,0,0]=3 4047 B12R1.252 C[C@@H](F)COCc1cccnn1 06cb4b03e5d2138a02ec68b491d736db [0,0,0,0,0,2|2,0,0]=4 4048 B12R1.252 C[C@@H](F)COCc1ccncn1 719b49a72c09f7d762d98352aa2ee153 [0,0,0,0,0,2|2,0,0]=4 4049 B12R1.252 C[C@@H](F)COCc1ncccn1 0be2c0fc83116bf68d16d48e2175abbd [0,0,0,0,0,2|2,0,0]=4 4050 B12R1.252 C[C@@H](O)CCNc1ccccc1 3c324f6ae4acc93f637fccf82ee7ce0d [0,0,0,0,0,2|2,0,0]=4 4051 B12R1.252 C[C@@H](O)CCNc1cccnn1 cf73112336214ad7cbf0dc1846b2b8b5 [0,0,0,0,0,2|2,0,0]=4 4052 B12R1.252 C[C@@H](O)CCNc1ccncn1 e9c337d98b4124b083ec155c782d5afc [0,0,0,0,0,2|2,0,0]=4 4053 B12R1.252 C[C@@H](O)CCNc1cnccn1 d98d70b012f52698df30b7825b3d3f44 [0,0,0,0,0,2|2,0,0]=4 4054 B12R1.252 C[C@@H](O)CNCc1ccccc1 6c2312c00225852faacfd748f3e179a9 [0,0,0,0,0,2|2,0,0]=4 4055 B12R1.252 C[C@@H](O)CNCc1ccccn1 451f5ffb0f29e3e72e062344afb5a2f0 [0,0,0,0,0,2|1,0,0]=3 4056 B12R1.252 C[C@@H](O)CNCc1cccnn1 cd1031e294d6f0d361dd47fa33d49ff3 [0,0,0,0,0,2|2,0,0]=4 4057 B12R1.252 C[C@@H](O)CNCc1ccncn1 736b6f19c1f730535787b4bd97f49fab [0,0,0,0,0,2|2,0,0]=4 4058 B12R1.252 C[C@@H](O)CNCc1cnccn1 eef2e176f843886c7abc553819e37052 [0,0,0,0,0,2|2,0,0]=4 4059 B12R1.252 C[C@@H](O)CNCc1ncccn1 0624e3b4e312bb88305cee2546fdfafe [0,0,0,0,0,2|2,0,0]=4 4060 B12R1.252 C[C@H](F)COCc1ccccc1 bbc793e84de595855390c7dc0e162e4e [0,0,0,0,0,2|2,0,0]=4 4061 B12R1.252 C[C@H](F)COCc1ccccn1 1c3e68e8b7d209c95b5abd8e99134585 [0,0,0,0,0,2|1,0,0]=3 4062 B12R1.252 C[C@H](F)COCc1cccnn1 2be52db7760fdc7844e251123071f59c [0,0,0,0,0,2|2,0,0]=4 4063 B12R1.252 C[C@H](F)COCc1ccncn1 7bca4df3c29ccb83ca7218b56534d104 [0,0,0,0,0,2|2,0,0]=4 4064 B12R1.252 C[C@H](F)COCc1ncccn1 7af5a27af441f4087010aeedfc65f0ba [0,0,0,0,0,2|2,0,0]=4 4065 B12R1.252 C[C@H](O)CCNc1ccccc1 6e2f4bd6880dfbdf2c0288d2956dbdc6 [0,0,0,0,0,2|2,0,0]=4 4066 B12R1.252 C[C@H](O)CCNc1cccnn1 c62b16aa58dfc3c8ac3d7053343062a4 [0,0,0,0,0,2|2,0,0]=4 4067 B12R1.252 C[C@H](O)CCNc1ccncn1 4320134883fca98ee018037af11033ea [0,0,0,0,0,2|2,0,0]=4 4068 B12R1.252 C[C@H](O)CCNc1cnccn1 5d34a9c581c97e3e5cec72109f7ba47d [0,0,0,0,0,2|2,0,0]=4 4069 B12R1.252 C[C@H](O)CNCc1ccccc1 300dc860ca45284f1e63efe30c8515f8 [0,0,0,0,0,2|2,0,0]=4 4070 B12R1.252 C[C@H](O)CNCc1ccccn1 b271f5c0c0f30c343eeedababca7e2eb [0,0,0,0,0,2|1,0,0]=3 4071 B12R1.252 C[C@H](O)CNCc1cccnn1 30faf4d5d2d2cfc53436874f05fa4323 [0,0,0,0,0,2|2,0,0]=4 4072 B12R1.252 C[C@H](O)CNCc1ccncn1 f524766be8fbe3d3ed19bfa5c9a61a28 [0,0,0,0,0,2|2,0,0]=4 4073 B12R1.252 C[C@H](O)CNCc1cnccn1 3fe1c33c64283497dd89455f2ff7b9fd [0,0,0,0,0,2|2,0,0]=4 4074 B12R1.252 C[C@H](O)CNCc1ncccn1 76fcffd630239efd786e389061949a13 [0,0,0,0,0,2|2,0,0]=4 4075 B12R1.252 FC(F)CCNc1ccccn1 cc81dcc876994e19229f366729c14f42 [0,0,0,0,0,2|2,0,0]=4 4076 B12R1.252 FC(F)CNCc1ccccn1 77bd5b4958e554940a2488a652c3c227 [0,0,0,0,0,2|2,0,0]=4 4077 B12R1.252 FC(F)COCc1ccccn1 0c03e4bfe601ba3a265a9d65726e12d8 [0,0,0,0,0,2|2,0,0]=4