0 B9R1.6 CC(=O)N1CC=CCC1 941519b4d56d0edbf71c96ca78449316 [0,0,0,0,0,0|1,0,3]=4 1 B10R1.15 CCN(C)c1ccccc1 9cc6568b1f30abe04427bdea858da30e [0,1,0,0,0,0|2,0,0]=3 2 B10R1.15 CCN(C)c1cccnc1 04b21f569d4c75e23135eca19e8dfd7f [0,1,0,0,0,0|3,0,0]=4 3 B10R1.15 CCN(C)c1ccncc1 b94b8554b6698451ca404459911593cc [0,1,0,0,0,0|3,0,0]=4 4 B10R1.15 CN(C=O)c1ccccn1 48011329103c524c4b63577b588cdb27 [0,1,0,0,0,0|2,0,0]=3 5 B10R1.15 CN(C=O)c1cccnc1 c200b85f739a703bfa35217d599e46e7 [0,1,0,0,0,0|2,0,0]=3 6 B10R1.15 CN(C=O)c1cccnn1 bb6c9a4d3ed3a56597c0fa4d221ca30b [0,1,0,0,0,0|3,0,0]=4 7 B10R1.15 CN(C=O)c1ccncc1 9cc48dd486f2ee4c03255d677df658bd [0,1,0,0,0,0|2,0,0]=3 8 B10R1.15 CN(C=O)c1ccncn1 559e04860b4b657b48b2febe0788a499 [0,1,0,0,0,0|3,0,0]=4 9 B10R1.15 CN(C=O)c1ccnnc1 e2ebf1a31d3d52b6cc6cfffa8c5ad13e [0,1,0,0,0,0|3,0,0]=4 10 B10R1.15 CN(CF)c1ccccn1 1bdd19ff0d205b3af825ce3149dae35a [0,1,0,0,0,0|3,0,0]=4 11 B10R1.15 CN(CF)c1cccnc1 242d56eee61bf5da227aba2cc8ffb8a2 [0,1,0,0,0,0|3,0,0]=4 12 B10R1.15 CN(CF)c1ccncc1 ce40ba3bf88af1d1b771c6b7bb26d1be [0,1,0,0,0,0|3,0,0]=4 13 B10R1.15 CN(CO)c1ccccn1 a93cc933fdb4d1c91563e07701d40cda [0,1,0,0,0,0|2,0,1]=4 14 B10R1.15 CN(CO)c1cccnc1 021ae75de63d9271d48b9d5b4bd35a1c [0,1,0,0,0,0|2,0,1]=4 15 B10R1.15 CN(CO)c1ccncc1 80b84f29ca23cc8379579376d55abff3 [0,1,0,0,0,0|2,0,1]=4 16 B8R1.7 CC(=O)N1CC=CC1 e11b9582e24204de984b55633fe5316e [0,0,0,0,1,0|1,0,2]=4 17 B10R1.18 CC(=O)Nc1ccccn1 eb929aff8406d4b1d349799cd9970928 [0,0,0,0,0,1|1,0,0]=2 18 B10R1.18 CC(=O)Nc1cccnc1 3ff4f8eaa45b955bdc1d480af270b630 [0,0,0,0,0,1|1,0,0]=2 19 B10R1.18 CC(=O)Nc1cccnn1 0f494122953745d5434019dc2597dec3 [0,0,0,0,0,1|2,0,0]=3 20 B10R1.18 CC(=O)Nc1ccncc1 c780044b958d7764a2638254ebdd3ded [0,0,0,0,0,1|1,0,0]=2 21 B10R1.18 CC(=O)Nc1ccncn1 21d9a226b27ccfaa0b4194dd907a60f4 [0,0,0,0,0,1|2,0,0]=3 22 B10R1.18 CC(=O)Nc1ccnnc1 13b7327c392c1dda0e0267bb7d63e990 [0,0,0,0,0,1|2,0,0]=3 23 B10R1.18 CC(=O)Nc1cnccn1 de63828007b663ee737a5f03044b51d4 [0,0,0,0,0,1|2,0,0]=3 24 B10R1.18 CC(C)Nc1ccccc1 678b2595d663b993cd638fb4df86366a [0,0,0,0,0,1|1,0,1]=3 25 B10R1.18 CC(C)Nc1ccccn1 8f41ba2831fdc97ef841b17526dcf604 [0,0,0,0,0,1|2,0,1]=4 26 B10R1.18 CC(C)Nc1cccnc1 b32b013363863cea153240b96e97c19f [0,0,0,0,0,1|2,0,1]=4 27 B10R1.18 CC(C)Nc1ccncc1 ed919cf6533ea85c87fe5a974cf5c4b4 [0,0,0,0,0,1|2,0,1]=4 28 B10R1.18 CC(C)Oc1ccccn1 0855bdc27823287e98107cda25a8e4de [0,0,0,0,0,1|2,0,1]=4 29 B10R1.18 CC(C)Oc1cccnc1 2d5fbf8b6573bcaaa6ad1437daf348fa [0,0,0,0,0,1|2,0,1]=4 30 B10R1.18 CC(C)Oc1ccncc1 fcbd1de824cfd0b7040632344868de57 [0,0,0,0,0,1|2,0,1]=4 31 B7R0.3 C=CCOC(=C)C=O e6886899fd17c4b0e35e10fadb840144 [1,0,1,0,0,0|1,0,1]=4 32 B9R0.2 C=C/C=C/CCNC(=O)C d1d4b0874c1cb5c136899f1ca87a2779 [0,1,1,0,0,0|0,0,2]=4 33 B9R0.15 C=CCN(CC=C)C(=O)C 82d675e8c4772c5f91adedd875348603 [0,1,1,0,0,0|1,0,1]=4 34 B9R1.8 CCNc1ccccc1 33257e4a9e1d882742dfd4cfddb78cda [1,1,0,0,0,0|0,0,1]=3 35 B9R1.8 CCNc1ccccn1 2525c23bd886b96c78c0be1e9ad1905b [1,1,0,0,0,0|1,0,1]=4 36 B9R1.8 CCNc1cccnc1 e16c06cad87ecb5a3a4a58b6d8537631 [1,1,0,0,0,0|1,0,1]=4 37 B9R1.8 CCNc1ccncc1 76118d388bf159fc52a5b3b43773c6d0 [1,1,0,0,0,0|1,0,1]=4 38 B9R1.8 CCOc1ccccn1 8b10ed115fcb5b65f209d3b07c05b728 [1,1,0,0,0,0|1,0,1]=4 39 B9R1.8 CCOc1cccnc1 efa582b018c37c3ab155936515b551ea [1,1,0,0,0,0|1,0,1]=4 40 B9R1.8 CCOc1ccncc1 365c1eef106f5326bc3144a980f01ba5 [1,1,0,0,0,0|1,0,1]=4 41 B9R1.8 FCNc1ccccc1 c8185de2a7206057ede93409452a493c [1,1,0,0,0,0|1,0,0]=3 42 B9R1.8 FCNc1ccccn1 e54f22e64e1a3858aca2c223c703a3f4 [1,1,0,0,0,0|2,0,0]=4 43 B9R1.8 FCNc1cccnc1 cd4b988ac9022e9beb52f2fd6e6d3819 [1,1,0,0,0,0|2,0,0]=4 44 B9R1.8 FCNc1ccncc1 b2ec03e01efad68d3352b8bfa837899b [1,1,0,0,0,0|2,0,0]=4 45 B9R1.8 FCOc1ccccn1 104b8f973c7a9ebb04a489743f7e956b [1,1,0,0,0,0|2,0,0]=4 46 B9R1.8 FCOc1cccnc1 613341899f57b52454964b4cd6fd2e82 [1,1,0,0,0,0|2,0,0]=4 47 B9R1.8 FCOc1ccncc1 ac9d070deb144d6d363d1c265a3b25fa [1,1,0,0,0,0|2,0,0]=4 48 B9R1.8 O=CNc1ccccn1 881aba1a1d89f4a286d5001a309ad574 [1,1,0,0,0,0|1,0,0]=3 49 B9R1.8 O=CNc1cccnc1 355201612949cfa8d6342c6af1c523a5 [1,1,0,0,0,0|1,0,0]=3 50 B9R1.8 O=CNc1cccnn1 c879f8306314a65926ae67496fe730c3 [1,1,0,0,0,0|2,0,0]=4 51 B9R1.8 O=CNc1ccncc1 e7930a19a74453c18ec50a777f694607 [1,1,0,0,0,0|1,0,0]=3 52 B9R1.8 O=CNc1ccncn1 2441242a2ef010826c6f20d4fd1c9498 [1,1,0,0,0,0|2,0,0]=4 53 B9R1.8 O=CNc1ccnnc1 c975d80dcdcbf9e971ef09ad97a634c5 [1,1,0,0,0,0|2,0,0]=4 54 B9R1.8 O=CNc1cnccn1 ec20f366f13fc090e89d88d03c632299 [1,1,0,0,0,0|2,0,0]=4 55 B9R1.8 OCNc1ccccc1 6a26daba1a11b7282126aadb7f7b8f97 [1,1,0,0,0,0|1,0,0]=3 56 B9R1.8 OCNc1ccccn1 d59bc8d9974c705420d0aeed6cce1b06 [1,1,0,0,0,0|2,0,0]=4 57 B9R1.8 OCNc1cccnc1 68add967e09ec2eee2b71061a3bb94f5 [1,1,0,0,0,0|2,0,0]=4 58 B9R1.8 OCNc1ccncc1 25e64b963b18028da179c82ed337c929 [1,1,0,0,0,0|2,0,0]=4 59 B9R1.11 CN(C=O)c1ccsc1 8f15e9acca9aeb51f07a52c03adb4c19 [0,1,0,0,1,0|2,0,0]=4 60 B11R1.20 CC(=O)Nc1ccc(cc1)C 060ccd1dbafbff371ab707f9c77c6f54 [0,1,0,0,0,1|0,0,0]=2 61 B11R1.20 CC(=O)Nc1ccc(cc1)F 35105970c39c6553f59bdacc3f8071bb [0,1,0,0,0,1|0,0,0]=2 62 B11R1.20 CC(=O)Nc1ccc(cc1)I c967834114ba48c24e889d26c320f98c [0,1,0,0,0,1|0,0,0]=2 63 B11R1.20 CC(=O)Nc1ccc(cc1)O e18f517b63a8d6b7b93bbe5e1805e49b [0,1,0,0,0,1|0,0,0]=2 64 B11R1.20 CC(=O)Nc1ccc(cc1)S 7fe298b0f3eca305b78c07db23ad9c9f [0,1,0,0,0,1|0,0,0]=2 65 B11R1.20 CC(=O)Nc1ccc(cn1)C 2566880c2cbd95238b8573fbab7352b5 [0,1,0,0,0,1|1,0,0]=3 66 B11R1.20 CC(=O)Nc1ccc(cn1)F 3f83a13c2f6c9200683a59445f5568b5 [0,1,0,0,0,1|1,0,0]=3 67 B11R1.20 CC(=O)Nc1ccc(cn1)I f69d5717020ba5469ac098b5ee595c2e [0,1,0,0,0,1|1,0,0]=3 68 B11R1.20 CC(=O)Nc1ccc(cn1)O 1774c40981e4bef395b20bb0cec3048d [0,1,0,0,0,1|1,0,0]=3 69 B11R1.20 CC(=O)Nc1ccc(nc1)C 99de9776e76b302c70f1b2299cc60df4 [0,1,0,0,0,1|1,0,0]=3 70 B11R1.20 CC(=O)Nc1ccc(nc1)F d95b06008ed9858976947678a788c0d4 [0,1,0,0,0,1|1,0,0]=3 71 B11R1.20 CC(=O)Nc1ccc(nc1)I 4875ca9d40de97c8bc9a2f1b043085ee [0,1,0,0,0,1|1,0,0]=3 72 B11R1.20 CC(=O)Nc1ccc(nn1)C 2db771cb7b1752060e5ab3d9558a55a5 [0,1,0,0,0,1|2,0,0]=4 73 B11R1.20 CC(=O)Nc1ccc(nn1)F fc0d35190b7248272f72c3b72d04d6de [0,1,0,0,0,1|2,0,0]=4 74 B11R1.20 CC(=O)Nc1ccc(nn1)I 103ba66fdc9246aa4c61c11e7f6e8337 [0,1,0,0,0,1|2,0,0]=4 75 B11R1.20 CC(=O)Nc1ccc(nn1)O 446c9b33355b6db90284ef3ae74ace6f [0,1,0,0,0,1|2,0,0]=4 76 B11R1.20 CC(=O)Nc1cnc(cn1)C 9e5149615a867d36276f957f71175a41 [0,1,0,0,0,1|2,0,0]=4 77 B11R1.20 CC(=O)Nc1cnc(cn1)I 21bc22ad112fe01077ff258cec8c3b14 [0,1,0,0,0,1|2,0,0]=4 78 B11R1.20 CC(C)Nc1ccc(cc1)Br e5f70783ec71726153c102e5801f7c8a [0,1,0,0,0,1|1,0,1]=4 79 B11R1.20 CC(C)Nc1ccc(cc1)Cl b33a847c825901d9dbcf3f8815c5869c [0,1,0,0,0,1|1,0,1]=4 80 B11R1.20 CC(C)Nc1ccc(cc1)F 689ddbde83a9a9429aa2388668fed19a [0,1,0,0,0,1|1,0,1]=4 81 B11R1.20 CC(C)Nc1ccc(cc1)I fa67ab606e8380aaae6be79fda5faf68 [0,1,0,0,0,1|1,0,1]=4 82 B11R1.20 CC(C)Nc1ccc(cc1)S e681327c1f8eccf785cd674735bc98be [0,1,0,0,0,1|1,0,1]=4 83 B11R1.20 CC(C)Oc1ccc(cc1)Br c830042d81f1762ab02a381b9eac79a4 [0,1,0,0,0,1|1,0,1]=4 84 B11R1.20 CC(C)Oc1ccc(cc1)Cl 7f20d83f4f9b33a7fd797ee07caaf887 [0,1,0,0,0,1|1,0,1]=4 85 B11R1.20 CC(C)Oc1ccc(cc1)F 4b3257094d99fffc8c1b5f1ead656595 [0,1,0,0,0,1|1,0,1]=4 86 B11R1.20 CC(C)Oc1ccc(cc1)I d09c2b32d485e0c585ea84ecec015274 [0,1,0,0,0,1|1,0,1]=4 87 B11R1.20 CC(C)Oc1ccc(cc1)S bc2b7db7696d219aecddb9042131dcc3 [0,1,0,0,0,1|1,0,1]=4 88 B11R1.20 Cc1ccc(cc1)NC(C)C bd77af8bd7263855741bad7d9283a59e [0,1,0,0,0,1|1,0,1]=4 89 B11R1.20 Cc1ccc(cc1)OC(C)C afaa4b057d8f12ac5846fcc0accc69e4 [0,1,0,0,0,1|1,0,1]=4 90 B11R1.36 CC(=O)N(C)c1ccccn1 3b204f817d8bae885450195e4bca3293 [0,1,0,0,0,1|1,0,0]=3 91 B11R1.36 CC(=O)N(C)c1cccnc1 99d370e4887dccbc66fa5e316a815456 [0,1,0,0,0,1|1,0,0]=3 92 B11R1.36 CC(=O)N(C)c1cccnn1 019bdf2b41b50b3dc4c1fbd9a45824e4 [0,1,0,0,0,1|2,0,0]=4 93 B11R1.36 CC(=O)N(C)c1ccncc1 92a60507d9bf675ae196cc0294354361 [0,1,0,0,0,1|1,0,0]=3 94 B11R1.36 CC(=O)N(C)c1ccncn1 669e7b6d0dcb129279d3d84513356b37 [0,1,0,0,0,1|2,0,0]=4 95 B11R1.36 CC(=O)N(C)c1ccnnc1 7b7b0659475cefeb9f34385b51243dc3 [0,1,0,0,0,1|2,0,0]=4 96 B11R1.36 CC(=O)N(C)c1cnccn1 7d8fc7dfc94af72e401da7941f18789c [0,1,0,0,0,1|2,0,0]=4 97 B11R1.40 C#CC(=O)Nc1ccccn1 c1462a2e7dbd34f49e0ec8b0b6e4c099 [0,1,0,0,0,1|1,0,1]=4 98 B11R1.40 C#CC(=O)Nc1cccnc1 fede9ede802accf01a2dd7068bdd2f92 [0,1,0,0,0,1|1,0,1]=4 99 B11R1.40 C#CC(=O)Nc1ccncc1 7e9563fca94f65240a5e54094d485c14 [0,1,0,0,0,1|1,0,1]=4 100 B11R1.40 C=CC(=O)Nc1ccccc1 5f69a60f76bf8d4845a783c3048b2563 [0,1,0,0,0,1|0,0,1]=3 101 B11R1.40 C=CC(=O)Nc1ccccn1 34fef90711dfcaefc277492e72bbe936 [0,1,0,0,0,1|1,0,1]=4 102 B11R1.40 C=CC(=O)Nc1cccnc1 de5c772a8cda94a68da43551d49c0fce [0,1,0,0,0,1|1,0,1]=4 103 B11R1.40 C=CC(=O)Nc1ccncc1 415f0c78f33533c78fc6ab46a82fb4b2 [0,1,0,0,0,1|1,0,1]=4 104 B11R1.40 C=CC(C)Nc1ccccc1 11c4f91eafeb8b3d7c22c97a0ea92d57 [0,1,0,0,0,1|1,0,1]=4 105 B11R1.40 CC(C=O)Nc1ccccc1 0d04ec44ee6fe8b8d4f3d71cd15333ba [0,1,0,0,0,1|0,0,1]=3 106 B11R1.40 CC(C=O)Nc1ccccn1 f6323f482ea726d65853ab7cc1b45bb4 [0,1,0,0,0,1|1,0,1]=4 107 B11R1.40 CC(C=O)Nc1cccnc1 d9c7b2b4935781413d4a985313466b9b [0,1,0,0,0,1|1,0,1]=4 108 B11R1.40 CC(C=O)Nc1ccncc1 9d1dbf134f97c66b59956ef2739d0216 [0,1,0,0,0,1|1,0,1]=4 109 B11R1.40 CC(C=O)Oc1ccccn1 6964fdd9e0bc6b530d4dd7a3a2376b4c [0,1,0,0,0,1|1,0,1]=4 110 B11R1.40 CC(C=O)Oc1cccnc1 e37888c7c991d828e39da1a6807dceaa [0,1,0,0,0,1|1,0,1]=4 111 B11R1.40 CC(C=O)Oc1ccncc1 e75558d3547ed47505abf1a4004897c0 [0,1,0,0,0,1|1,0,1]=4 112 B11R1.40 CC(CO)Nc1ccccc1 28944821b2a2502f940043c73e5bee97 [0,1,0,0,0,1|0,0,2]=4 113 B11R1.40 CCC(=O)Nc1ccccn1 5f642c62afae0a49ab875733e55fde1b [0,1,0,0,0,1|1,0,0]=3 114 B11R1.40 CCC(=O)Nc1cccnc1 3f3732eaee579e7903ad30638bf6459b [0,1,0,0,0,1|1,0,0]=3 115 B11R1.40 CCC(=O)Nc1cccnn1 591c7e40d773c7240b2e6c26eda21683 [0,1,0,0,0,1|2,0,0]=4 116 B11R1.40 CCC(=O)Nc1ccncn1 b77f302a19ddecbb1a61c216faedf774 [0,1,0,0,0,1|2,0,0]=4 117 B11R1.40 CCC(=O)Nc1cnccn1 e2ac897815fa11a06d867bf7943d000f [0,1,0,0,0,1|2,0,0]=4 118 B11R1.40 CCC(C)Nc1ccccc1 0d73dedeab1dd8f5149c3124f0b802dc [0,1,0,0,0,1|1,0,1]=4 119 B11R1.40 CCN(C)Cc1ccccc1 c214a7b7c23665abe56278baaf98348b [0,1,0,0,0,1|2,0,0]=4 120 B11R1.40 CC[C@@H](C)Nc1ccccc1 405a065880ecff40d5c3aba49f23a60f [0,1,0,0,0,1|1,0,1]=4 121 B11R1.40 CC[C@H](C)Nc1ccccc1 bdf0fca4eb541010d4b75cf2b0618571 [0,1,0,0,0,1|1,0,1]=4 122 B11R1.40 CN(C=O)Cc1ccccc1 701ed8237afa851586621908f176512f [0,1,0,0,0,1|1,0,0]=3 123 B11R1.40 CN(C=O)Cc1ccccn1 e1588a36a59add4eaf224b7ea271ab51 [0,1,0,0,0,1|2,0,0]=4 124 B11R1.40 CN(C=O)Cc1cccnc1 ffa035f03a82f49c9d004e6e7105924f [0,1,0,0,0,1|2,0,0]=4 125 B11R1.40 CN(C=O)Cc1ccncc1 a539f04945f92d40e9c197fd41216c1b [0,1,0,0,0,1|2,0,0]=4 126 B11R1.40 CN(CF)Cc1ccccc1 5e57d186c6f316353ffa6c809cb61d75 [0,1,0,0,0,1|2,0,0]=4 127 B11R1.40 CN(CO)Cc1ccccc1 c1d08d2d2c7de731954ebcb428d333e2 [0,1,0,0,0,1|1,0,1]=4 128 B11R1.40 C[C@@H](CO)Nc1ccccc1 d1a979ebd31c8c47073ae387eaa9c5f8 [0,1,0,0,0,1|0,0,2]=4 129 B11R1.40 C[C@H](C=O)Nc1ccccc1 10a4433daba67da13987d6e7cd5b7f0f [0,1,0,0,0,1|0,0,1]=3 130 B11R1.40 C[C@H](C=O)Nc1ccccn1 46e94b05d4e4c715a9e5400c929646b9 [0,1,0,0,0,1|1,0,1]=4 131 B11R1.40 C[C@H](C=O)Nc1cccnc1 fedeaeec69f602e704c38cd1adea1d8e [0,1,0,0,0,1|1,0,1]=4 132 B11R1.40 C[C@H](C=O)Nc1ccncc1 2f11c12f5ae2a4a34554194fcc005f15 [0,1,0,0,0,1|1,0,1]=4 133 B11R1.40 C[C@H](C=O)Oc1ccccn1 0be2b7848388ea049450b4a9fa6678e7 [0,1,0,0,0,1|1,0,1]=4 134 B11R1.40 C[C@H](C=O)Oc1cccnc1 55db0365e7488258d11fe983dbcaf255 [0,1,0,0,0,1|1,0,1]=4 135 B11R1.40 C[C@H](C=O)Oc1ccncc1 0569f754c55d1898e8e0bee53c4f5433 [0,1,0,0,0,1|1,0,1]=4 136 B11R1.40 C[C@H](CO)Nc1ccccc1 b7592eed2c2b10dda06f47547223c567 [0,1,0,0,0,1|0,0,2]=4 137 B11R1.40 O=C(CF)Nc1ccccn1 2ce6af3846508f1cbf20b58b7e69e973 [0,1,0,0,0,1|1,0,0]=3 138 B11R1.40 O=C(CF)Nc1cccnc1 5e2dc67f59a0ee35b818f3c738a2672a [0,1,0,0,0,1|1,0,0]=3 139 B11R1.40 O=C(CF)Nc1cccnn1 956ee4b8acdca6d1b3b267a9d3c5501e [0,1,0,0,0,1|2,0,0]=4 140 B11R1.40 O=C(CF)Nc1ccncn1 a44111f60632a2eea12e2d1d61934c5a [0,1,0,0,0,1|2,0,0]=4 141 B11R1.40 O=C(CF)Nc1cnccn1 73cbdadef8b5f740edf1a794b99099cb [0,1,0,0,0,1|2,0,0]=4 142 B11R1.40 O=C(CO)Nc1ccccn1 ac93149c4969ed513b19c3eba5f007d7 [0,1,0,0,0,1|1,0,0]=3 143 B11R1.40 O=C(CO)Nc1cccnc1 c1618f12da4bc6c07033d2147d5e05a1 [0,1,0,0,0,1|1,0,0]=3 144 B11R1.40 O=C(CO)Nc1cccnn1 e2ead558693a8d15dba073147810db17 [0,1,0,0,0,1|2,0,0]=4 145 B11R1.40 O=C(CO)Nc1ccncn1 1ec35e9ab589eb6ea004d772ff8dd3ef [0,1,0,0,0,1|2,0,0]=4 146 B11R1.40 O=C(CO)Nc1cnccn1 48cd2c8639e0b4dc6a2e8e8ea59a849d [0,1,0,0,0,1|2,0,0]=4 147 B11R1.40 O=C(CS)Nc1ccccn1 a5e554850131abc66cd7cf28616b9ec8 [0,1,0,0,0,1|1,0,0]=3 148 B11R1.40 O=C(CS)Nc1cccnn1 41f91dff9cbbc670e95242818cb16a37 [0,1,0,0,0,1|2,0,0]=4 149 B11R1.40 O=C(CS)Nc1cnccn1 6ba52b3c3766ee9a7edfbfe35be30e2b [0,1,0,0,0,1|2,0,0]=4 150 B11R1.40 O=CC(=O)Nc1ccccc1 d69489ae088f523aa236921a313e92a5 [0,1,0,0,0,1|0,0,1]=3 151 B11R1.40 O=CC(=O)Nc1ccccn1 9dee939f22a8949e3604743fdb4606fc [0,1,0,0,0,1|1,0,1]=4 152 B11R1.40 O=CC(=O)Nc1cccnc1 4483235651c46310384ecdfb83cf0459 [0,1,0,0,0,1|1,0,1]=4 153 B11R1.40 O=CC(=O)Nc1ccncc1 4b5bab6fe314b5f2251f228c60250dcd [0,1,0,0,0,1|1,0,1]=4 154 B11R1.86 CC(=O)Nc1ccccc1C 7049a69ccf4e362820a37d19b9dcdc8e [0,1,0,0,0,1|0,0,0]=2 155 B11R1.86 CC(=O)Nc1ccccc1F 8577dda07f10b24e878efc2b8c63979b [0,1,0,0,0,1|0,0,0]=2 156 B11R1.86 CC(=O)Nc1ccccc1I def7ccb67f6a04593a954aa370725476 [0,1,0,0,0,1|0,0,0]=2 157 B11R1.86 CC(=O)Nc1ccccc1O e286e23dcc389b9a19e5097225c5ef71 [0,1,0,0,0,1|0,0,0]=2 158 B11R1.86 CC(=O)Nc1ccccc1S 1242ce70ea265424048fd46add1f1131 [0,1,0,0,0,1|0,0,0]=2 159 B11R1.86 CC(=O)Nc1cccnc1C cb746ed6a78728abfd09af911ecd9df1 [0,1,0,0,0,1|1,0,0]=3 160 B11R1.86 CC(=O)Nc1cccnc1Cl d6108d611ff0956d8f248587b24194a3 [0,1,0,0,0,1|1,0,0]=3 161 B11R1.86 CC(=O)Nc1cccnc1F 14d1358323375dfcd1ff37fd32da5eb9 [0,1,0,0,0,1|1,0,0]=3 162 B11R1.86 CC(=O)Nc1cccnc1I 467bfbcd2f98dc2da33396f6c3169a29 [0,1,0,0,0,1|1,0,0]=3 163 B11R1.86 CC(=O)Nc1cccnc1O 7fcf288ae770f8f4e3cf6493eee6512f [0,1,0,0,0,1|1,0,0]=3 164 B11R1.86 CC(=O)Nc1ccncc1C c5c42e159450bf609b124aefb3b1a0c2 [0,1,0,0,0,1|1,0,0]=3 165 B11R1.86 CC(=O)Nc1ccncc1F c0f8b81507f6f0da50422e6a37679a28 [0,1,0,0,0,1|1,0,0]=3 166 B11R1.86 CC(=O)Nc1ccncc1I dc888df548d325d9701c437394dfdc81 [0,1,0,0,0,1|1,0,0]=3 167 B11R1.86 CC(=O)Nc1ccnnc1C cadb49c5a9c58bf00b9e5a551cd24f13 [0,1,0,0,0,1|2,0,0]=4 168 B11R1.86 CC(=O)Nc1cnccc1C 008c73bad38e7c0ad3042f8c5e2eeef6 [0,1,0,0,0,1|1,0,0]=3 169 B11R1.86 CC(=O)Nc1cnccc1F fb86cc23bed5784da517c22693fa424f [0,1,0,0,0,1|1,0,0]=3 170 B11R1.86 CC(=O)Nc1cnccc1I f9bbe3b48c30df8d0dae6d2447ab7b64 [0,1,0,0,0,1|1,0,0]=3 171 B11R1.86 CC(=O)Nc1cnccc1O 026ebb27f2a3ead3d67bfa6a1c65cef8 [0,1,0,0,0,1|1,0,0]=3 172 B11R1.86 CC(=O)Nc1ncccc1C 3c6d5cf596b0e21248657879e826b561 [0,1,0,0,0,1|1,0,0]=3 173 B11R1.86 CC(=O)Nc1ncccc1Cl 046176b1d66345ef27a31d8dec48e176 [0,1,0,0,0,1|1,0,0]=3 174 B11R1.86 CC(=O)Nc1ncccc1F 538d1f7d9dce9c391c2889dad2906996 [0,1,0,0,0,1|1,0,0]=3 175 B11R1.86 CC(=O)Nc1ncccc1I e16450fdd7c598f0519f5a1ac3923512 [0,1,0,0,0,1|1,0,0]=3 176 B11R1.86 CC(=O)Nc1ncccc1O b5c4643233d4c0cd6f7c1f9da29da199 [0,1,0,0,0,1|1,0,0]=3 177 B11R1.86 CC(=O)Nc1nccnc1C 91307da892d26270c50ec6b371044d57 [0,1,0,0,0,1|2,0,0]=4 178 B11R1.86 CC(=O)Nc1nccnc1Cl 73358f12f40bca8d83f664898a1a7cda [0,1,0,0,0,1|2,0,0]=4 179 B11R1.86 CC(=O)Nc1nccnc1I 329e07036277c7ed530d8478ac3ced74 [0,1,0,0,0,1|2,0,0]=4 180 B11R1.86 CC(=O)Nc1nccnc1O fd538b7c2f434a2f6f99824cfe0a9b4c [0,1,0,0,0,1|2,0,0]=4 181 B11R1.86 CC(=O)Nc1ncncc1I 036cd1c5d49a5eb9ed70f7c9535d8f83 [0,1,0,0,0,1|2,0,0]=4 182 B11R1.86 CC(=O)Nc1nnccc1C 24befafdb5d28545a7ca1f97bb43d82e [0,1,0,0,0,1|2,0,0]=4 183 B11R1.86 CC(=O)Nc1nnccc1O 7d15230e02c4f4b765ccddf4779cb8c0 [0,1,0,0,0,1|2,0,0]=4 184 B11R1.86 CC(C)Nc1ccccc1I 3eed1e6c2f407ecc428748af6151fed6 [0,1,0,0,0,1|1,0,1]=4 185 B11R1.86 CC(C)Oc1ccccc1Cl c23b66f89632f42c5d307b4af3111d42 [0,1,0,0,0,1|1,0,1]=4 186 B11R1.86 CC(C)Oc1ccccc1F 883d2c1cc9d854cb85fa804d83d6f507 [0,1,0,0,0,1|1,0,1]=4 187 B11R1.86 CC(C)Oc1ccccc1I 5b38c2c613687166fa94711069ce6a86 [0,1,0,0,0,1|1,0,1]=4 188 B11R1.86 CC(C)Oc1ccccc1S 75d24c98473e29b4fc09eb15793f8071 [0,1,0,0,0,1|1,0,1]=4 189 B11R1.86 Cc1ccccc1OC(C)C e336697c807367b5d2038eeb2d20cb38 [0,1,0,0,0,1|1,0,1]=4 190 B11R1.157 CC(=O)Nc1cc(ccn1)C 11bb75cefcc8e0053d4aa87066be916d [0,1,0,0,0,1|1,0,0]=3 191 B11R1.157 CC(=O)Nc1cc(ccn1)F 8e862ac7c7b42cf4a874c98f7685acd6 [0,1,0,0,0,1|1,0,0]=3 192 B11R1.157 CC(=O)Nc1cc(ccn1)O a3610b7684ca29dc38fcb0bb43d220bb [0,1,0,0,0,1|1,0,0]=3 193 B11R1.157 CC(=O)Nc1cccc(c1)C 9a7c9b465401dd095659742e6c3e194a [0,1,0,0,0,1|0,0,0]=2 194 B11R1.157 CC(=O)Nc1cccc(c1)Cl a4a6d31d02767cbd28a554abdc9d7f9c [0,1,0,0,0,1|0,0,0]=2 195 B11R1.157 CC(=O)Nc1cccc(c1)F c6f0d045fd7da349c2147d19a6b5c925 [0,1,0,0,0,1|0,0,0]=2 196 B11R1.157 CC(=O)Nc1cccc(c1)I 6985e662c065e5f04703904aecec87c5 [0,1,0,0,0,1|0,0,0]=2 197 B11R1.157 CC(=O)Nc1cccc(c1)O 83fd7000bcb1a1edfb73e9c940896bf1 [0,1,0,0,0,1|0,0,0]=2 198 B11R1.157 CC(=O)Nc1cccc(c1)S c491dfa7e666418d0885014c41e759e8 [0,1,0,0,0,1|0,0,0]=2 199 B11R1.157 CC(=O)Nc1cccc(n1)C 01436216495e07ab1a016d090bd0354d [0,1,0,0,0,1|1,0,0]=3 200 B11R1.157 CC(=O)Nc1cccc(n1)F 5c90ea818058cfdc7008511466203d36 [0,1,0,0,0,1|1,0,0]=3 201 B11R1.157 CC(=O)Nc1cccc(n1)I 5d4e8b430df68bb8d5b9e79c705284bb [0,1,0,0,0,1|1,0,0]=3 202 B11R1.157 CC(=O)Nc1cccc(n1)O 5ecee8ed76a0d083278d7db13fb46dc5 [0,1,0,0,0,1|1,0,0]=3 203 B11R1.157 CC(=O)Nc1ccnc(c1)C 1f0a21b873e7ca6abbe56d850131c0d5 [0,1,0,0,0,1|1,0,0]=3 204 B11R1.157 CC(=O)Nc1ccnc(c1)Cl 60dd71dfffbd4e7a86b9c1318a508470 [0,1,0,0,0,1|1,0,0]=3 205 B11R1.157 CC(=O)Nc1ccnc(c1)F c112cdf062cc40dd6e09308e4863a8bf [0,1,0,0,0,1|1,0,0]=3 206 B11R1.157 CC(=O)Nc1ccnc(c1)O adfd8450de9344956743fa1a05f9a0cc [0,1,0,0,0,1|1,0,0]=3 207 B11R1.157 CC(=O)Nc1ccnc(n1)C a99fb752268446820ef6d543ffd6e63c [0,1,0,0,0,1|2,0,0]=4 208 B11R1.157 CC(=O)Nc1ccnc(n1)F 408e459526577b37af420886fa5483de [0,1,0,0,0,1|2,0,0]=4 209 B11R1.157 CC(=O)Nc1ccnc(n1)S b1fb83694219796ce1766b50befd0b64 [0,1,0,0,0,1|2,0,0]=4 210 B11R1.157 CC(=O)Nc1cncc(c1)C 4291afcbdd0cbcaf1adc4172123ca697 [0,1,0,0,0,1|1,0,0]=3 211 B11R1.157 CC(=O)Nc1cncc(c1)F 9860c048d1d1e6420ea4a0a66f480b3c [0,1,0,0,0,1|1,0,0]=3 212 B11R1.157 CC(=O)Nc1cncc(c1)I 1accd6dc622c13ee068932fae9e60766 [0,1,0,0,0,1|1,0,0]=3 213 B11R1.157 CC(=O)Nc1cncc(c1)O df72e33984e978f8a94153b22b3fc5c6 [0,1,0,0,0,1|1,0,0]=3 214 B11R1.157 CC(=O)Nc1cncc(n1)C 814c6641018618ae240ef1a1633a60e7 [0,1,0,0,0,1|2,0,0]=4 215 B11R1.157 CC(=O)Nc1cncc(n1)F ef72f805b1e497b0355d489c7333b0d9 [0,1,0,0,0,1|2,0,0]=4 216 B11R1.157 CC(=O)Nc1cnnc(c1)F f1bbad3625f9dafe11622658ea27357d [0,1,0,0,0,1|2,0,0]=4 217 B11R1.157 CC(C)Nc1cccc(c1)Br c1a310149209bebd05d401b8d9453768 [0,1,0,0,0,1|1,0,1]=4 218 B11R1.157 CC(C)Nc1cccc(c1)Cl 88b649511dda4c3138b09b24b4cdf85e [0,1,0,0,0,1|1,0,1]=4 219 B11R1.157 CC(C)Nc1cccc(c1)F 2469bb14dda7a11ffa1e171e9579afdb [0,1,0,0,0,1|1,0,1]=4 220 B11R1.157 CC(C)Nc1cccc(c1)I 28c8d38bd4c860795c7f6ab5b08202d3 [0,1,0,0,0,1|1,0,1]=4 221 B11R1.157 CC(C)Nc1cccc(c1)S 4d5403275c38f6ee6364ab78831bae52 [0,1,0,0,0,1|1,0,1]=4 222 B11R1.157 CC(C)Oc1cccc(c1)Br 03d6e4f39dc83644234524de153060f8 [0,1,0,0,0,1|1,0,1]=4 223 B11R1.157 CC(C)Oc1cccc(c1)Cl b05958621a80ad10943fb41bda6c4ff4 [0,1,0,0,0,1|1,0,1]=4 224 B11R1.157 CC(C)Oc1cccc(c1)F cc5136a263bfb966a933f5c182f882fd [0,1,0,0,0,1|1,0,1]=4 225 B11R1.157 CC(C)Oc1cccc(c1)I eecf4227dddae0c4ffe51c7d1a2196a6 [0,1,0,0,0,1|1,0,1]=4 226 B11R1.157 CC(C)Oc1cccc(c1)S c0ecc340d31d590be5ee243f9c89bfa6 [0,1,0,0,0,1|1,0,1]=4 227 B11R1.157 Cc1cccc(c1)NC(C)C 6995924353e7f43790a327361636dd3c [0,1,0,0,0,1|1,0,1]=4 228 B11R1.157 Cc1cccc(c1)OC(C)C 768a0b78053567f181c821d541878835 [0,1,0,0,0,1|1,0,1]=4 229 B11R1.509 CC(C)(C)Nc1ccccc1 820b34717c3d9476c22fcc3db6fccee9 [0,1,0,0,0,1|1,0,1]=4 230 B11R1.22 CCN(C)c1ccc(cc1)F 37e2d475a9bd3cfcf296a94fc69fd067 [0,2,0,0,0,0|2,0,0]=4 231 B11R1.22 CCN(C)c1ccc(cc1)I 6deef7aec400603f68eb68f0833942ec [0,2,0,0,0,0|2,0,0]=4 232 B11R1.22 CCN(C)c1ccc(cc1)S 429f96f94511567839fe68b5edd62f1c [0,2,0,0,0,0|2,0,0]=4 233 B11R1.22 CN(C=O)c1ccc(cc1)Br 9862ed13c945c79fb65fa51787bd2093 [0,2,0,0,0,0|1,0,0]=3 234 B11R1.22 CN(C=O)c1ccc(cc1)Cl d432c23837319192897a660c45f339ba [0,2,0,0,0,0|1,0,0]=3 235 B11R1.22 CN(C=O)c1ccc(cc1)F f939c668a8e6f39bb7cc93a9ebd979dd [0,2,0,0,0,0|1,0,0]=3 236 B11R1.22 CN(C=O)c1ccc(cc1)I 86b31576c767147a57657625de6a4cf6 [0,2,0,0,0,0|1,0,0]=3 237 B11R1.22 CN(C=O)c1ccc(cc1)O 71050cca6cc6c2a34d54c8525596398a [0,2,0,0,0,0|1,0,0]=3 238 B11R1.22 CN(C=O)c1ccc(cc1)S f07b31b3eaa976c4ece94ae29131a1b8 [0,2,0,0,0,0|1,0,0]=3 239 B11R1.22 CN(C=O)c1ccc(cn1)Br 7f8da10581ce5ca8a37f373d42765e26 [0,2,0,0,0,0|2,0,0]=4 240 B11R1.22 CN(C=O)c1ccc(cn1)Cl eb3549718b5ca2b8a891721b0fccec81 [0,2,0,0,0,0|2,0,0]=4 241 B11R1.22 CN(C=O)c1ccc(cn1)F ccd5b3b4d2abee8b59e402f73866a88d [0,2,0,0,0,0|2,0,0]=4 242 B11R1.22 CN(C=O)c1ccc(cn1)I f3706e1edae5d726765a21baeac8b53e [0,2,0,0,0,0|2,0,0]=4 243 B11R1.22 CN(C=O)c1ccc(nc1)Br 02e6c8c88fc8f9a945078432f838505c [0,2,0,0,0,0|2,0,0]=4 244 B11R1.22 CN(C=O)c1ccc(nc1)Cl bd70684891af49b44bb911ed20ab21a5 [0,2,0,0,0,0|2,0,0]=4 245 B11R1.22 CN(C=O)c1ccc(nc1)F 6e5f29d7bc3545ed6e42f58e9071f45e [0,2,0,0,0,0|2,0,0]=4 246 B11R1.22 CN(CF)c1ccc(cc1)Br 6b91b8da88ddbfb295c2dccdb6cb4076 [0,2,0,0,0,0|2,0,0]=4 247 B11R1.22 CN(CF)c1ccc(cc1)Cl 0c4cb302bade12f5a411b01a9042b3ea [0,2,0,0,0,0|2,0,0]=4 248 B11R1.22 CN(CF)c1ccc(cc1)F 7a7162e57e22a4f5e6a55d2c6d204d3d [0,2,0,0,0,0|2,0,0]=4 249 B11R1.22 CN(CF)c1ccc(cc1)I 6d998585b1c8e8e7964bc459bdd74230 [0,2,0,0,0,0|2,0,0]=4 250 B11R1.22 CN(CF)c1ccc(cc1)S 790104648dfcde077abfb3f2fb190f26 [0,2,0,0,0,0|2,0,0]=4 251 B11R1.22 CN(CO)c1ccc(cc1)Br a0ee612d9ade0f057f40eda0edee63d6 [0,2,0,0,0,0|1,0,1]=4 252 B11R1.22 CN(CO)c1ccc(cc1)Cl 2c0dfaf13b4e02b467d222656644d816 [0,2,0,0,0,0|1,0,1]=4 253 B11R1.22 CN(CO)c1ccc(cc1)F c1ecf99a3d9f55a2562607c88c44d1b8 [0,2,0,0,0,0|1,0,1]=4 254 B11R1.22 CN(CO)c1ccc(cc1)I 148086324dd93cd760089e4e94a122ba [0,2,0,0,0,0|1,0,1]=4 255 B11R1.22 CN(CO)c1ccc(cc1)S 7e6f64a1230a5e349b82adbdac7f2cd1 [0,2,0,0,0,0|1,0,1]=4 256 B11R1.22 Cc1ccc(cc1)N(C)C=O c253ca59971334503e7e1b5bdad7856f [0,2,0,0,0,0|1,0,0]=3 257 B11R1.22 Cc1ccc(cc1)N(C)CF d9ca75efcf22688224e11802328b1cd1 [0,2,0,0,0,0|2,0,0]=4 258 B11R1.22 Cc1ccc(cc1)N(C)CO 3f90488aa46443ae7ceb46a9828e79d3 [0,2,0,0,0,0|1,0,1]=4 259 B11R1.22 Cc1ccc(cn1)N(C)C=O 17ad1ce648b4690112700dad4971e9cf [0,2,0,0,0,0|2,0,0]=4 260 B11R1.22 Cc1ccc(nc1)N(C)C=O e97e84386efd05e00da987d65e1de257 [0,2,0,0,0,0|2,0,0]=4 261 B11R1.12 CCN(C#N)c1ccccc1 0a33bcc251eace95a09e2548bafab86c [0,2,0,0,0,0|2,0,0]=4 262 B11R1.12 CCN(C=O)c1ccccc1 da6bb0dc53f1d66135131d66e3bbe341 [0,2,0,0,0,0|1,0,0]=3 263 B11R1.12 CCN(C=O)c1ccccn1 37ec100e83e1f6ae17d6e3d5e7e2efcf [0,2,0,0,0,0|2,0,0]=4 264 B11R1.12 CCN(C=O)c1cccnc1 480f2644a238345f8cb34be867d4aca8 [0,2,0,0,0,0|2,0,0]=4 265 B11R1.12 CCN(C=O)c1ccncc1 509a741e45cf3609202d1982e0d164de [0,2,0,0,0,0|2,0,0]=4 266 B11R1.12 CCN(CF)c1ccccc1 64bfdf9f1ec7c91dbb7909bf38760f4f [0,2,0,0,0,0|2,0,0]=4 267 B11R1.12 N#CN(CO)c1ccccc1 a68ba6ef8e1f16dac15967f291cfe801 [0,2,0,0,0,0|2,0,0]=4 268 B11R1.16 C#CCN(C)c1ccccc1 3ca89e194431e8e98a41325339f135b2 [0,2,0,0,0,0|2,0,0]=4 269 B11R1.16 C=CCN(C)c1ccccc1 cb57bdb31a063701918aa00f058638bf [0,2,0,0,0,0|2,0,0]=4 270 B11R1.16 CC(NC=O)c1ccccc1 912f825ae8ec09ad8cb929f90e443d73 [0,2,0,0,0,0|0,0,1]=3 271 B11R1.16 CC(NC=O)c1ccccn1 2d9ff4713c5fb2a2245e54b6347c7c9e [0,2,0,0,0,0|1,0,1]=4 272 B11R1.16 CC(NC=O)c1cccnc1 8993d9f42ad801a00b7dbd874864f118 [0,2,0,0,0,0|1,0,1]=4 273 B11R1.16 CC(NC=O)c1ccncc1 5faf024cdfd5434d1564838bc71dc42c [0,2,0,0,0,0|1,0,1]=4 274 B11R1.16 CC(OCF)c1ccccc1 a5a4510633c1500ac034b294490d7f65 [0,2,0,0,0,0|0,0,2]=4 275 B11R1.16 CCCN(C)c1ccccc1 5333b12ce18e2a38096b8e486fed114a [0,2,0,0,0,0|2,0,0]=4 276 B11R1.16 CCNC(C)c1ccccc1 af03e39d181c5fd668bda5d6f7d06e14 [0,2,0,0,0,0|1,0,1]=4 277 B11R1.16 CCN[C@@H](C)c1ccccc1 994b5b0b50363ecab1efd5b7f9e6d7cd [0,2,0,0,0,0|1,0,1]=4 278 B11R1.16 CCN[C@H](C)c1ccccc1 af432512ad94856da6ef9d44592c3502 [0,2,0,0,0,0|1,0,1]=4 279 B11R1.16 CCOC(C)c1ccccc1 37108e833ff536d25c550cb5b37c873d [0,2,0,0,0,0|0,0,2]=4 280 B11R1.16 CCO[C@@H](C)c1ccccc1 e4f11a13dd3f609e6f25ac3a3b969fe2 [0,2,0,0,0,0|0,0,2]=4 281 B11R1.16 CCO[C@H](C)c1ccccc1 54694971b3853f962e687b61e7c698c1 [0,2,0,0,0,0|0,0,2]=4 282 B11R1.16 CN(CC#N)c1ccccc1 e4996d8d05652ac5f69757d7a543c8c3 [0,2,0,0,0,0|2,0,0]=4 283 B11R1.16 CN(CC=O)c1ccccc1 669b7315010cb1229c9893a5bac75e38 [0,2,0,0,0,0|1,0,0]=3 284 B11R1.16 CN(CC=O)c1ccccn1 8eeacaea1098a53010acec6d489e7e31 [0,2,0,0,0,0|2,0,0]=4 285 B11R1.16 CN(CC=O)c1cccnc1 4e735c7da6851d8cd391939506ab7153 [0,2,0,0,0,0|2,0,0]=4 286 B11R1.16 CN(CC=O)c1ccncc1 4f1a5e470d242783af0cc78d9b673eed [0,2,0,0,0,0|2,0,0]=4 287 B11R1.16 CN(CCF)c1ccccc1 10541e2e32dac0db7a85ea44620c0e3e [0,2,0,0,0,0|2,0,0]=4 288 B11R1.16 CN(CCO)c1ccccc1 4b734b8d391d02ddf47f0308fb1d22c8 [0,2,0,0,0,0|1,0,1]=4 289 B11R1.16 COCN(C)c1ccccc1 6231e4bc9ebe3bdb02fd15faeb34634f [0,2,0,0,0,0|1,0,1]=4 290 B11R1.16 CSCN(C)c1ccccc1 6fe637e44a17092ac12098dbdcb5352f [0,2,0,0,0,0|1,1,0]=4 291 B11R1.16 C[C@@H](NC=O)c1ccccc1 ed3cbc790dab943801487e30e3a37c11 [0,2,0,0,0,0|0,0,1]=3 292 B11R1.16 C[C@@H](NC=O)c1ccccn1 cab0a06ffe0df70443a13b7bf3f0f929 [0,2,0,0,0,0|1,0,1]=4 293 B11R1.16 C[C@@H](NC=O)c1cccnc1 ac95236c8efa48d11de85080c1ed1da7 [0,2,0,0,0,0|1,0,1]=4 294 B11R1.16 C[C@@H](NC=O)c1ccncc1 8f84254a89086749004a481ae3d5fd96 [0,2,0,0,0,0|1,0,1]=4 295 B11R1.16 C[C@@H](OCF)c1ccccc1 f6dc1405e5744871891f84657f997fd4 [0,2,0,0,0,0|0,0,2]=4 296 B11R1.16 C[C@H](NC=O)c1ccccc1 0ca5dec48ba28ecff3cefea41bc874f0 [0,2,0,0,0,0|0,0,1]=3 297 B11R1.16 C[C@H](NC=O)c1ccccn1 353a0771be422f9d7abafb8a3ade0569 [0,2,0,0,0,0|1,0,1]=4 298 B11R1.16 C[C@H](NC=O)c1cccnc1 03b40f19b3a9bf3d85026c98e0fcf432 [0,2,0,0,0,0|1,0,1]=4 299 B11R1.16 C[C@H](NC=O)c1ccncc1 a397d98d692b7c5c0acb296625e84080 [0,2,0,0,0,0|1,0,1]=4 300 B11R1.16 C[C@H](OCF)c1ccccc1 0bdd092ad3daed19f52c193b52481cfc [0,2,0,0,0,0|0,0,2]=4 301 B11R1.16 N#CNC(=O)c1ccccc1 f968919af35f591f70d462dc16d787fc [0,2,0,0,0,0|0,0,1]=3 302 B11R1.16 N#CNC(=O)c1ccccn1 44d2e00cb0876a447fe7ca0e5dfa0092 [0,2,0,0,0,0|1,0,1]=4 303 B11R1.16 N#CNC(=O)c1cccnc1 c2b82d345410e46672bb9c640f03af28 [0,2,0,0,0,0|1,0,1]=4 304 B11R1.16 N#CNC(=O)c1ccncc1 dde9d92b87aad3cf8dd07b22dfcbdb4b [0,2,0,0,0,0|1,0,1]=4 305 B11R1.23 CCN(C)c1cccc(c1)Br b9912e02c1f17bb41ebd144c9e9202ee [0,2,0,0,0,0|2,0,0]=4 306 B11R1.23 CCN(C)c1cccc(c1)F 430101ed975145c517dcbcb463820b73 [0,2,0,0,0,0|2,0,0]=4 307 B11R1.23 CN(C=O)c1cc(ccn1)Br 5d3454b18877e79ab3d306b7bdc52c75 [0,2,0,0,0,0|2,0,0]=4 308 B11R1.23 CN(C=O)c1cc(ccn1)Cl 9f74106f894b34649db45534debd8ed1 [0,2,0,0,0,0|2,0,0]=4 309 B11R1.23 CN(C=O)c1cc(ccn1)I 34fbeab8aca98dabc7c6b19604a4eba9 [0,2,0,0,0,0|2,0,0]=4 310 B11R1.23 CN(C=O)c1cccc(c1)Br 04e2b42b796ef8d05d5e843c6bfac7b3 [0,2,0,0,0,0|1,0,0]=3 311 B11R1.23 CN(C=O)c1cccc(c1)Cl 6a133c007011cf0443d8614b42cd9db1 [0,2,0,0,0,0|1,0,0]=3 312 B11R1.23 CN(C=O)c1cccc(c1)F d6a1f4912d17ef5b2ef6dd6e9a7cc16c [0,2,0,0,0,0|1,0,0]=3 313 B11R1.23 CN(C=O)c1cccc(c1)I 0412fe6299fa843b927c099de9b2eca3 [0,2,0,0,0,0|1,0,0]=3 314 B11R1.23 CN(C=O)c1cccc(c1)O 61c55a3ac80552d55fb98f08b327401d [0,2,0,0,0,0|1,0,0]=3 315 B11R1.23 CN(C=O)c1cccc(n1)Br 8612b91e415e9cc649fb04c5ea29ab42 [0,2,0,0,0,0|2,0,0]=4 316 B11R1.23 CN(C=O)c1cccc(n1)Cl ca2b664edc0079e08a87049fdad8282a [0,2,0,0,0,0|2,0,0]=4 317 B11R1.23 CN(C=O)c1cccc(n1)F 4cee610795a72fd3ca41904bfd37bd40 [0,2,0,0,0,0|2,0,0]=4 318 B11R1.23 CN(C=O)c1ccnc(c1)Br 91a80df2840651b48e3e6a49028296ef [0,2,0,0,0,0|2,0,0]=4 319 B11R1.23 CN(C=O)c1ccnc(c1)Cl 66533818364b3b9a357710653b7fa487 [0,2,0,0,0,0|2,0,0]=4 320 B11R1.23 CN(C=O)c1ccnc(c1)F 6b488499e9af4e4c49e6e6e6b68ab3e3 [0,2,0,0,0,0|2,0,0]=4 321 B11R1.23 CN(CF)c1cccc(c1)Br 7a123ee73cafbdd957621bfb9faccc3f [0,2,0,0,0,0|2,0,0]=4 322 B11R1.23 CN(CF)c1cccc(c1)Cl 3c5b88557b8c81a0b3c7ed9ad71bde08 [0,2,0,0,0,0|2,0,0]=4 323 B11R1.23 CN(CF)c1cccc(c1)F 222030735d42d27fe394bc21ac4ac2c3 [0,2,0,0,0,0|2,0,0]=4 324 B11R1.23 CN(CF)c1cccc(c1)I a4932831bd90a86126da38899926fb81 [0,2,0,0,0,0|2,0,0]=4 325 B11R1.23 CN(CO)c1cccc(c1)Br 338387980ae1b5bd1aeb8f0f3d8c21d1 [0,2,0,0,0,0|1,0,1]=4 326 B11R1.23 CN(CO)c1cccc(c1)Cl cddd29b5bf9afdf9ebf4b5b2535c5ce6 [0,2,0,0,0,0|1,0,1]=4 327 B11R1.23 CN(CO)c1cccc(c1)F 0413508efd514c5105c44e46cec3cac8 [0,2,0,0,0,0|1,0,1]=4 328 B11R1.23 CN(CO)c1cccc(c1)I 1efe9cbcfb545c4004f668bff7e82fc4 [0,2,0,0,0,0|1,0,1]=4 329 B11R1.23 Cc1cccc(c1)N(C)C=O 8d3d604d6ddb9f04039aac9ce5e10e5e [0,2,0,0,0,0|1,0,0]=3 330 B11R1.23 Cc1cccc(n1)N(C)C=O 6cb388448dc4b9e667ac2839ef3d869c [0,2,0,0,0,0|2,0,0]=4 331 B11R1.23 Cc1ccnc(c1)N(C)C=O 9a844feefad7cbd79d0790089efe483f [0,2,0,0,0,0|2,0,0]=4 332 B11R1.23 Cc1cncc(c1)N(C)C=O 7fd556f41e83e9cebad64414d3df3e54 [0,2,0,0,0,0|2,0,0]=4 333 B11R1.222 CCN(C)c1ccccc1C 9f04b12bb5b89a6592eb728905a01c8b [0,2,0,0,0,0|2,0,0]=4 334 B11R1.222 CCN(C)c1ccccc1F f232548c9b2f85032dbceb393dfbf769 [0,2,0,0,0,0|2,0,0]=4 335 B11R1.222 CN(C=O)c1ccccc1Br 3426899914cb277130ea1a231941052f [0,2,0,0,0,0|1,0,0]=3 336 B11R1.222 CN(C=O)c1ccccc1Cl 135f44500c6825a6172cd53bd209f325 [0,2,0,0,0,0|1,0,0]=3 337 B11R1.222 CN(C=O)c1ccccc1F b02bb0760d6e84d207ae27e31e461504 [0,2,0,0,0,0|1,0,0]=3 338 B11R1.222 CN(C=O)c1ccccc1O 4c3e44ceba918ddfd6ff42ad51415b5c [0,2,0,0,0,0|1,0,0]=3 339 B11R1.222 CN(C=O)c1cccnc1Cl b027a9b01c7da1291b970a20c75c2e99 [0,2,0,0,0,0|2,0,0]=4 340 B11R1.222 CN(C=O)c1cccnc1F 8e9cfc1b0e6a6be08d31776d822be16f [0,2,0,0,0,0|2,0,0]=4 341 B11R1.222 CN(C=O)c1ccncc1Br 8cc913ec23aad9d896b4d08982d9caac [0,2,0,0,0,0|2,0,0]=4 342 B11R1.222 CN(C=O)c1ccncc1Cl 9b82e4e8acbda3d0a3daf2c69d5db345 [0,2,0,0,0,0|2,0,0]=4 343 B11R1.222 CN(C=O)c1ccncc1I 840d7cb0d6d3990e32570cdbf1681a0c [0,2,0,0,0,0|2,0,0]=4 344 B11R1.222 CN(C=O)c1cnccc1F 9a049333e1849191907641c6cea15d3a [0,2,0,0,0,0|2,0,0]=4 345 B11R1.222 CN(C=O)c1ncccc1Br db76b93ef1e268b910ac631c67ca1632 [0,2,0,0,0,0|2,0,0]=4 346 B11R1.222 CN(C=O)c1ncccc1Cl 449a83a0cec7f02bd2abd91cedd0a796 [0,2,0,0,0,0|2,0,0]=4 347 B11R1.222 CN(C=O)c1ncccc1F b641ddbedbd63da000d5c508aca4e04b [0,2,0,0,0,0|2,0,0]=4 348 B11R1.222 CN(C=O)c1ncccc1I 71913ea62e33de145ae57bd78731fdb8 [0,2,0,0,0,0|2,0,0]=4 349 B11R1.222 CN(CF)c1ccccc1F 664f2d950c125d3a1fa31610e43e1d60 [0,2,0,0,0,0|2,0,0]=4 350 B11R1.222 CN(CO)c1ccccc1Cl 93c8a0a05d68ffe0b62289d5206a4d45 [0,2,0,0,0,0|1,0,1]=4 351 B11R1.222 CN(CO)c1ccccc1F 37525b3659f76f6cb84994c550b2f6ca [0,2,0,0,0,0|1,0,1]=4 352 B11R1.222 Cc1ccccc1N(C)C=O 0cbd91f766c6614fd036ecf6c5c52ea2 [0,2,0,0,0,0|1,0,0]=3 353 B11R1.222 Cc1ccccc1N(C)CF 151ec0fcc79157784dd7bc5d5aa488f4 [0,2,0,0,0,0|2,0,0]=4 354 B11R1.222 Cc1ccccc1N(C)CO 360a66e6984b8285375a37f5a2a3ef94 [0,2,0,0,0,0|1,0,1]=4 355 B11R1.222 Cc1cccnc1N(C)C=O 438b938c4b12b8c4e4c902048dbadb00 [0,2,0,0,0,0|2,0,0]=4 356 B11R1.222 Cc1ccncc1N(C)C=O 5e2154d6d670430a5469b9d55e39c87e [0,2,0,0,0,0|2,0,0]=4 357 B11R1.222 Cc1ncccc1N(C)C=O dc35c78fbaab6693ce2763b76bacc250 [0,2,0,0,0,0|2,0,0]=4 358 B9R1.13 CC(=O)Nc1cccs1 f70dc40a2b7a68d7210198fbab697918 [0,0,1,1,0,0|2,0,0]=4 359 B9R1.13 CC(=O)Nc1ccsc1 b43c291cb5d72b5ddddbae12e8c0d0d9 [0,0,1,1,0,0|2,0,0]=4 360 B11R2.238 c1ccc(cc1)NC2CC2 0cca6617983212a2989086e88698db73 [0,0,0,1,0,1|1,0,1]=4 361 B11R1.91 C=C(Br)CNc1ccccc1 93ec6105ca168468e9c8838717ff6b1e [0,0,0,0,0,2|1,0,1]=4 362 B11R1.91 C=C(C)CNc1ccccc1 9ff030153dc2dcaf07d1da3f9e6a073f [0,0,0,0,0,2|1,0,0]=3 363 B11R1.91 C=C(C)CNc1ccccn1 296f6d3c9e71203263ef4c60889651d0 [0,0,0,0,0,2|2,0,0]=4 364 B11R1.91 C=C(C)CNc1cccnc1 8810dec0d1b93ae6f2f50fc532118fa0 [0,0,0,0,0,2|2,0,0]=4 365 B11R1.91 C=C(C)CNc1ccncc1 7fd564b3611fb48098820a623411bd04 [0,0,0,0,0,2|2,0,0]=4 366 B11R1.91 C=C(C)COc1ccccn1 53d55f6223fd317f454a145f4adf39b2 [0,0,0,0,0,2|2,0,0]=4 367 B11R1.91 C=C(C)COc1cccnc1 3cac933caa917577843fc86e5c520fd6 [0,0,0,0,0,2|2,0,0]=4 368 B11R1.91 C=C(C)COc1ccncc1 5c56bc0d616e9eba4b34abaa7d463cec [0,0,0,0,0,2|2,0,0]=4 369 B11R1.91 C=C(Cl)CNc1ccccc1 e3c53739f614fbc554b5ed591e111126 [0,0,0,0,0,2|1,0,1]=4 370 B11R1.91 C=C(F)CNc1ccccc1 aea10c9376159512fe2427e907c2a329 [0,0,0,0,0,2|1,0,1]=4 371 B11R1.91 CC(=O)CNc1ccccc1 71a2fb3da6b0e889c13cfd81e73bd182 [0,0,0,0,0,2|0,0,0]=2 372 B11R1.91 CC(=O)CNc1ccccn1 9ef5867d6e28a360f3e560522ae4c545 [0,0,0,0,0,2|1,0,0]=3 373 B11R1.91 CC(=O)CNc1cccnc1 35a6037a85b015cc869f557087769b5d [0,0,0,0,0,2|1,0,0]=3 374 B11R1.91 CC(=O)CNc1cccnn1 bd224fe4d75fd6299636314b2659cf40 [0,0,0,0,0,2|2,0,0]=4 375 B11R1.91 CC(=O)CNc1ccncc1 e7e1df2bfec9194a79bb5918ba94764c [0,0,0,0,0,2|1,0,0]=3 376 B11R1.91 CC(=O)CNc1ccncn1 4f817587489a7d067dc5afdf25fc5852 [0,0,0,0,0,2|2,0,0]=4 377 B11R1.91 CC(=O)CNc1ccnnc1 988e3b33cea73d48c45816137b4a5d30 [0,0,0,0,0,2|2,0,0]=4 378 B11R1.91 CC(=O)CNc1cnccn1 f505fd1e568103e89908ef11d0b9c40c [0,0,0,0,0,2|2,0,0]=4 379 B11R1.91 CC(=O)CNc1ncccn1 f18694e3a51e6ffd47e70f441daa4c05 [0,0,0,0,0,2|2,0,0]=4 380 B11R1.91 CC(=O)NCc1ccccc1 29a87354e4243d3817f046f8152f971d [0,0,0,0,0,2|0,0,0]=2 381 B11R1.91 CC(=O)NCc1ccccn1 4a5e0ad0f6fb64ba7eb4726872bef1d0 [0,0,0,0,0,2|1,0,0]=3 382 B11R1.91 CC(=O)NCc1cccnc1 7b71a51c058bd0c2c3114d8b61c7e1f0 [0,0,0,0,0,2|1,0,0]=3 383 B11R1.91 CC(=O)NCc1cccnn1 8df4f95b0595f5061ab86d0c6899ec2c [0,0,0,0,0,2|2,0,0]=4 384 B11R1.91 CC(=O)NCc1ccncc1 9156811b92bf0707f7382e576ceea554 [0,0,0,0,0,2|1,0,0]=3 385 B11R1.91 CC(=O)NCc1ccncn1 bb4e634dd2d2ac1df6c40895aef3c1f0 [0,0,0,0,0,2|2,0,0]=4 386 B11R1.91 CC(=O)NCc1ccnnc1 b7fb9ef1b30e19b3391ac6373f09e991 [0,0,0,0,0,2|2,0,0]=4 387 B11R1.91 CC(=O)NCc1cnccn1 3bc7c046654e0b52f0e8fd5e1c64219d [0,0,0,0,0,2|2,0,0]=4 388 B11R1.91 CC(=O)NCc1cncnc1 1788fa75b9a7d3ec40c95f826ad49ab5 [0,0,0,0,0,2|2,0,0]=4 389 B11R1.91 CC(=O)NCc1ncccn1 7e583fa87c299d4a4eb199dfcfdc7c5d [0,0,0,0,0,2|2,0,0]=4 390 B11R1.91 CC(C)CNc1ccccc1 408d8a64ab70f9eca096d81d546b6049 [0,0,0,0,0,2|1,0,1]=4 391 B11R1.91 CC(C)NCc1ccccc1 60272e3c9303882f29d21331dcab1491 [0,0,0,0,0,2|1,0,1]=4 392 B11R1.91 CC(C)OCc1ccccc1 7aa508df1117d05227b589ad5630d192 [0,0,0,0,0,2|1,0,1]=4 393 B11R1.91 CC(O)CNc1ccccc1 bad1b8ce4c3d0d43f36328d30e7f1e89 [0,0,0,0,0,2|0,0,2]=4 394 B11R1.91 CN(C)CNc1ccccc1 6ea2b21a530eb73fceed274bf1825a42 [0,0,0,0,0,2|2,0,0]=4 395 B11R1.91 C[C@@H](O)CNc1ccccc1 3364bd989574177eabc4c47575206f02 [0,0,0,0,0,2|0,0,2]=4 396 B11R1.91 C[C@H](O)CNc1ccccc1 72a253baaf381f6699a10e01b0f0ab34 [0,0,0,0,0,2|0,0,2]=4 397 B11R1.91 NC(=O)CNc1ccccc1 cb8f4e233e85228cf5430aee72130ae8 [0,0,0,0,0,2|1,0,0]=3 398 B11R1.91 NC(=O)CNc1ccccn1 034e479579804be1d3ad81d994fdfe8a [0,0,0,0,0,2|2,0,0]=4 399 B11R1.91 NC(=O)CNc1cccnc1 dbb72e205ac173bc25639603ebb9275b [0,0,0,0,0,2|2,0,0]=4 400 B11R1.91 NC(=O)CNc1ccncc1 088a2b77d25846775d03ac6d25fcda03 [0,0,0,0,0,2|2,0,0]=4 401 B11R1.91 NC(=O)COc1ccccn1 d34b1e4c40fb1accb7eddd79d84f9d95 [0,0,0,0,0,2|2,0,0]=4 402 B11R1.91 NC(=O)COc1cccnc1 561263082ed3dec2740bd877b6a3be01 [0,0,0,0,0,2|2,0,0]=4 403 B11R1.91 NC(=O)COc1ccncc1 791f490da6d45f1fafaa0833ecefe913 [0,0,0,0,0,2|2,0,0]=4 404 B11R1.91 O=C(O)CNc1ccccc1 aa02152e084051d6acb84b2b7ca3be40 [0,0,0,0,0,2|1,0,0]=3 405 B11R1.91 O=C(O)CNc1ccccn1 83bad72d96578f6ee29657bf854abc17 [0,0,0,0,0,2|2,0,0]=4 406 B11R1.91 O=C(O)CNc1cccnc1 4378235c0fca8603764c85f64c571ed0 [0,0,0,0,0,2|2,0,0]=4 407 B11R1.91 O=C(O)CNc1ccncc1 d2ec8efae842007114d587a1ec71d62f [0,0,0,0,0,2|2,0,0]=4 408 B11R1.91 O=C(O)COc1ccccn1 d10c5c7e1100e6f68973343e5e477bed [0,0,0,0,0,2|2,0,0]=4 409 B11R1.91 O=C(O)COc1cccnc1 109e5f2cec28855b082ac5e8dd76ca14 [0,0,0,0,0,2|2,0,0]=4 410 B11R1.91 O=C(O)COc1ccncc1 b0acb3702ddf8b44733ab3e3ff47483a [0,0,0,0,0,2|2,0,0]=4 411 B11R1.91 O=[N+]([O-])CNc1ccccc1 ee2373fe0eba3d741763c77ec19667e3 [0,0,0,0,0,2|2,0,0]=4