0 B10R1.15 CCN(C)c1ccccc1 9cc6568b1f30abe04427bdea858da30e [0,1,0,0,0,0|2,0,0]=3 1 B10R1.15 CCN(C)c1cccnc1 04b21f569d4c75e23135eca19e8dfd7f [0,1,0,0,0,0|3,0,0]=4 2 B10R1.15 CCN(C)c1ccncc1 b94b8554b6698451ca404459911593cc [0,1,0,0,0,0|3,0,0]=4 3 B10R1.15 CN(C=O)c1ccccn1 48011329103c524c4b63577b588cdb27 [0,1,0,0,0,0|2,1,0]=4 4 B10R1.15 CN(C=O)c1cccnc1 c200b85f739a703bfa35217d599e46e7 [0,1,0,0,0,0|2,1,0]=4 5 B10R1.15 CN(C=O)c1ccncc1 9cc48dd486f2ee4c03255d677df658bd [0,1,0,0,0,0|2,1,0]=4 6 B10R1.15 CN(CF)c1ccccn1 1bdd19ff0d205b3af825ce3149dae35a [0,1,0,0,0,0|3,0,0]=4 7 B10R1.15 CN(CF)c1cccnc1 242d56eee61bf5da227aba2cc8ffb8a2 [0,1,0,0,0,0|3,0,0]=4 8 B10R1.15 CN(CF)c1ccncc1 ce40ba3bf88af1d1b771c6b7bb26d1be [0,1,0,0,0,0|3,0,0]=4 9 B10R1.15 CN(CO)c1ccccn1 a93cc933fdb4d1c91563e07701d40cda [0,1,0,0,0,0|2,1,0]=4 10 B10R1.15 CN(CO)c1cccnc1 021ae75de63d9271d48b9d5b4bd35a1c [0,1,0,0,0,0|2,1,0]=4 11 B10R1.15 CN(CO)c1ccncc1 80b84f29ca23cc8379579376d55abff3 [0,1,0,0,0,0|2,1,0]=4 12 B10R1.18 CC(=O)Nc1ccccn1 eb929aff8406d4b1d349799cd9970928 [0,0,0,0,0,1|1,1,1]=4 13 B10R1.18 CC(=O)Nc1cccnc1 3ff4f8eaa45b955bdc1d480af270b630 [0,0,0,0,0,1|1,1,1]=4 14 B10R1.18 CC(=O)Nc1ccncc1 c780044b958d7764a2638254ebdd3ded [0,0,0,0,0,1|1,1,1]=4 15 B10R1.18 CC(C)Nc1ccccc1 678b2595d663b993cd638fb4df86366a [0,0,0,0,0,1|1,0,0]=2 16 B10R1.18 CC(C)Nc1ccccn1 8f41ba2831fdc97ef841b17526dcf604 [0,0,0,0,0,1|2,0,0]=3 17 B10R1.18 CC(C)Nc1cccnc1 b32b013363863cea153240b96e97c19f [0,0,0,0,0,1|2,0,0]=3 18 B10R1.18 CC(C)Nc1cccnn1 7e8e9cb3fe00dc0cd26a09d7d65a05b1 [0,0,0,0,0,1|3,0,0]=4 19 B10R1.18 CC(C)Nc1ccncc1 ed919cf6533ea85c87fe5a974cf5c4b4 [0,0,0,0,0,1|2,0,0]=3 20 B10R1.18 CC(C)Nc1ccncn1 069107b8df99cf2ce1a28de8ff12b3bc [0,0,0,0,0,1|3,0,0]=4 21 B10R1.18 CC(C)Nc1ccnnc1 ca5f97416f9a66603da37ac043765b94 [0,0,0,0,0,1|3,0,0]=4 22 B10R1.18 CC(C)Nc1cnccn1 58156a1e8faa75eacf930a892d9c44a0 [0,0,0,0,0,1|3,0,0]=4 23 B10R1.18 CC(C)Nc1cncnc1 58c88f3a700af3acdb4e2b5e448ab47a [0,0,0,0,0,1|3,0,0]=4 24 B10R1.18 CC(C)Nc1ncccn1 b6e51d4ce55bed0a9644a5fb30715e8d [0,0,0,0,0,1|3,0,0]=4 25 B10R1.18 CC(C)Oc1ccccn1 0855bdc27823287e98107cda25a8e4de [0,0,0,0,0,1|2,0,0]=3 26 B10R1.18 CC(C)Oc1cccnc1 2d5fbf8b6573bcaaa6ad1437daf348fa [0,0,0,0,0,1|2,0,0]=3 27 B10R1.18 CC(C)Oc1ccncc1 fcbd1de824cfd0b7040632344868de57 [0,0,0,0,0,1|2,0,0]=3 28 B10R1.18 CC(C)Oc1ccnnc1 5f378768fb399f97727c7d2434a4ccad [0,0,0,0,0,1|3,0,0]=4 29 B10R1.18 CC(C)Oc1cnccn1 f445429d4d0106398179ba53f8ca2052 [0,0,0,0,0,1|3,0,0]=4 30 B10R1.18 CC(C)Oc1cncnc1 987ff7423f824d1dd79f18db733241ff [0,0,0,0,0,1|3,0,0]=4 31 B10R1.18 CC(C)Oc1ncccn1 9c1a5b776824ae13ad1499e2cad8b03a [0,0,0,0,0,1|3,0,0]=4 32 B9R1.8 CCNc1ccccc1 33257e4a9e1d882742dfd4cfddb78cda [1,1,0,0,0,0|0,0,0]=2 33 B9R1.8 CCNc1ccccn1 2525c23bd886b96c78c0be1e9ad1905b [1,1,0,0,0,0|1,0,0]=3 34 B9R1.8 CCNc1cccnc1 e16c06cad87ecb5a3a4a58b6d8537631 [1,1,0,0,0,0|1,0,0]=3 35 B9R1.8 CCNc1cccnn1 8ce46420a68f085572db040256d5d2b7 [1,1,0,0,0,0|2,0,0]=4 36 B9R1.8 CCNc1ccncc1 76118d388bf159fc52a5b3b43773c6d0 [1,1,0,0,0,0|1,0,0]=3 37 B9R1.8 CCNc1ccncn1 e04846be86a5c479e545d0cb402fe182 [1,1,0,0,0,0|2,0,0]=4 38 B9R1.8 CCNc1ccnnc1 84df08ea46526da8091efc8e7dc98bc3 [1,1,0,0,0,0|2,0,0]=4 39 B9R1.8 CCNc1cnccn1 692286fa82997f2fb685e4d3ad5b2443 [1,1,0,0,0,0|2,0,0]=4 40 B9R1.8 CCNc1cncnc1 d22064ed1cc1956224a6568ef26d5099 [1,1,0,0,0,0|2,0,0]=4 41 B9R1.8 CCNc1ncccn1 e5f30c193b5ab11515bad37a4470b1a9 [1,1,0,0,0,0|2,0,0]=4 42 B9R1.8 CCOc1ccccn1 8b10ed115fcb5b65f209d3b07c05b728 [1,1,0,0,0,0|1,0,0]=3 43 B9R1.8 CCOc1cccnc1 efa582b018c37c3ab155936515b551ea [1,1,0,0,0,0|1,0,0]=3 44 B9R1.8 CCOc1ccncc1 365c1eef106f5326bc3144a980f01ba5 [1,1,0,0,0,0|1,0,0]=3 45 B9R1.8 CCOc1ccnnc1 495bf99ef1353fb62f88bfe5786129d6 [1,1,0,0,0,0|2,0,0]=4 46 B9R1.8 CCOc1cnccn1 aa9d1d61b4f8dce5da42fe3ddcc6df85 [1,1,0,0,0,0|2,0,0]=4 47 B9R1.8 CCOc1cncnc1 8629022d8ea6564de249e44f3cfd1da9 [1,1,0,0,0,0|2,0,0]=4 48 B9R1.8 CCOc1ncccn1 c537ae1cbb412be3ee508a248bc8885d [1,1,0,0,0,0|2,0,0]=4 49 B9R1.8 FCNc1ccccc1 c8185de2a7206057ede93409452a493c [1,1,0,0,0,0|1,0,0]=3 50 B9R1.8 FCNc1ccccn1 e54f22e64e1a3858aca2c223c703a3f4 [1,1,0,0,0,0|2,0,0]=4 51 B9R1.8 FCNc1cccnc1 cd4b988ac9022e9beb52f2fd6e6d3819 [1,1,0,0,0,0|2,0,0]=4 52 B9R1.8 FCNc1ccncc1 b2ec03e01efad68d3352b8bfa837899b [1,1,0,0,0,0|2,0,0]=4 53 B9R1.8 FCOc1ccccn1 104b8f973c7a9ebb04a489743f7e956b [1,1,0,0,0,0|2,0,0]=4 54 B9R1.8 FCOc1cccnc1 613341899f57b52454964b4cd6fd2e82 [1,1,0,0,0,0|2,0,0]=4 55 B9R1.8 FCOc1ccncc1 ac9d070deb144d6d363d1c265a3b25fa [1,1,0,0,0,0|2,0,0]=4 56 B9R1.8 OCNc1ccccc1 6a26daba1a11b7282126aadb7f7b8f97 [1,1,0,0,0,0|0,1,0]=3 57 B9R1.8 OCNc1ccccn1 d59bc8d9974c705420d0aeed6cce1b06 [1,1,0,0,0,0|1,1,0]=4 58 B9R1.8 OCNc1cccnc1 68add967e09ec2eee2b71061a3bb94f5 [1,1,0,0,0,0|1,1,0]=4 59 B9R1.8 OCNc1ccncc1 25e64b963b18028da179c82ed337c929 [1,1,0,0,0,0|1,1,0]=4 60 B11R1.20 CC(=O)Nc1ccc(cc1)C 060ccd1dbafbff371ab707f9c77c6f54 [0,1,0,0,0,1|0,1,1]=4 61 B11R1.20 CC(=O)Nc1ccc(cc1)F 35105970c39c6553f59bdacc3f8071bb [0,1,0,0,0,1|0,1,1]=4 62 B11R1.20 CC(=O)Nc1ccc(cc1)I c967834114ba48c24e889d26c320f98c [0,1,0,0,0,1|0,1,1]=4 63 B11R1.20 CC(=O)Nc1ccc(cc1)O e18f517b63a8d6b7b93bbe5e1805e49b [0,1,0,0,0,1|0,1,1]=4 64 B11R1.20 CC(=O)Nc1ccc(cc1)S 7fe298b0f3eca305b78c07db23ad9c9f [0,1,0,0,0,1|0,1,1]=4 65 B11R1.20 CC(C)Nc1ccc(=O)[nH]c1 63657213ff6b579908dedea051a64186 [0,1,0,0,0,1|2,0,0]=4 66 B11R1.20 CC(C)Nc1ccc(cc1)Br e5f70783ec71726153c102e5801f7c8a [0,1,0,0,0,1|1,0,0]=3 67 B11R1.20 CC(C)Nc1ccc(cc1)Cl b33a847c825901d9dbcf3f8815c5869c [0,1,0,0,0,1|1,0,0]=3 68 B11R1.20 CC(C)Nc1ccc(cc1)F 689ddbde83a9a9429aa2388668fed19a [0,1,0,0,0,1|1,0,0]=3 69 B11R1.20 CC(C)Nc1ccc(cc1)I fa67ab606e8380aaae6be79fda5faf68 [0,1,0,0,0,1|1,0,0]=3 70 B11R1.20 CC(C)Nc1ccc(cc1)S e681327c1f8eccf785cd674735bc98be [0,1,0,0,0,1|1,0,0]=3 71 B11R1.20 CC(C)Nc1ccc(cn1)Br 9b1d22e0d0da20412cc097462da94620 [0,1,0,0,0,1|2,0,0]=4 72 B11R1.20 CC(C)Nc1ccc(cn1)Cl 5ae73597a5a1fa64ce292b318939abee [0,1,0,0,0,1|2,0,0]=4 73 B11R1.20 CC(C)Nc1ccc(cn1)F 6d484441b7055ef582d9e9fe1a736c28 [0,1,0,0,0,1|2,0,0]=4 74 B11R1.20 CC(C)Nc1ccc(cn1)I d7825663ab6a7ded0de82b19c2a89f36 [0,1,0,0,0,1|2,0,0]=4 75 B11R1.20 CC(C)Nc1ccc(nc1)Br a219ac4b34332eb3738a2d60093d25ca [0,1,0,0,0,1|2,0,0]=4 76 B11R1.20 CC(C)Nc1ccc(nc1)Cl cd874efcc56ef7f4e81f67a347da5256 [0,1,0,0,0,1|2,0,0]=4 77 B11R1.20 CC(C)Nc1ccc(nc1)F e5037e278c2deb1da56d4dd59d5edb3e [0,1,0,0,0,1|2,0,0]=4 78 B11R1.20 CC(C)Oc1ccc(cc1)Br c830042d81f1762ab02a381b9eac79a4 [0,1,0,0,0,1|1,0,0]=3 79 B11R1.20 CC(C)Oc1ccc(cc1)Cl 7f20d83f4f9b33a7fd797ee07caaf887 [0,1,0,0,0,1|1,0,0]=3 80 B11R1.20 CC(C)Oc1ccc(cc1)F 4b3257094d99fffc8c1b5f1ead656595 [0,1,0,0,0,1|1,0,0]=3 81 B11R1.20 CC(C)Oc1ccc(cc1)I d09c2b32d485e0c585ea84ecec015274 [0,1,0,0,0,1|1,0,0]=3 82 B11R1.20 CC(C)Oc1ccc(cc1)S bc2b7db7696d219aecddb9042131dcc3 [0,1,0,0,0,1|1,0,0]=3 83 B11R1.20 CC(C)Oc1ccc(cn1)Cl 2d764f542cd850467dceb5ea7856809e [0,1,0,0,0,1|2,0,0]=4 84 B11R1.20 CC(C)Oc1ccc(cn1)F 8b718d6ec6cce88e81ab345ae3477032 [0,1,0,0,0,1|2,0,0]=4 85 B11R1.20 CC(C)Oc1ccc(cn1)I 00aba9b6fb1d651d79b062e296bef87f [0,1,0,0,0,1|2,0,0]=4 86 B11R1.20 CC(C)Oc1ccc(nc1)Br 03387980ed704f1b91f33115fdf148c9 [0,1,0,0,0,1|2,0,0]=4 87 B11R1.20 CC(C)Oc1ccc(nc1)Cl bf70b6eb15a088db8ddeb63733ed08d7 [0,1,0,0,0,1|2,0,0]=4 88 B11R1.20 CC(C)Oc1ccc(nc1)F c1100a1e2d454cfe8c3cbbc5d6e5727d [0,1,0,0,0,1|2,0,0]=4 89 B11R1.20 CC(C)Oc1ccc(nc1)I 86c15c6da9d65de15ebd86f541f4105e [0,1,0,0,0,1|2,0,0]=4 90 B11R1.20 Cc1ccc(cc1)NC(C)C bd77af8bd7263855741bad7d9283a59e [0,1,0,0,0,1|1,0,0]=3 91 B11R1.20 Cc1ccc(cc1)OC(C)C afaa4b057d8f12ac5846fcc0accc69e4 [0,1,0,0,0,1|1,0,0]=3 92 B11R1.20 Cc1ccc(cn1)NC(C)C 743454483328eed9afd36a5108a5fde3 [0,1,0,0,0,1|2,0,0]=4 93 B11R1.20 Cc1ccc(cn1)OC(C)C 587bf2eefeb78be461683015f0e1ab8b [0,1,0,0,0,1|2,0,0]=4 94 B11R1.20 Cc1ccc(nc1)NC(C)C 2fd0646075e4e7895badb9a91550ac5c [0,1,0,0,0,1|2,0,0]=4 95 B11R1.20 Cc1ccc(nc1)OC(C)C daaa0dc9632c23fcd00a8fbb104724aa [0,1,0,0,0,1|2,0,0]=4 96 B11R1.40 C#CC(C)Nc1cccnc1 cfbe38280031a5b1bea7126930aebd77 [0,1,0,0,0,1|2,0,0]=4 97 B11R1.40 C=CC(C)Nc1ccccc1 11c4f91eafeb8b3d7c22c97a0ea92d57 [0,1,0,0,0,1|1,0,0]=3 98 B11R1.40 C=CC(C)Nc1ccccn1 02b1b752c7d8a18090185a0c6f05b98f [0,1,0,0,0,1|2,0,0]=4 99 B11R1.40 C=CC(C)Nc1cccnc1 103a7e1883d7a333825583600980cdee [0,1,0,0,0,1|2,0,0]=4 100 B11R1.40 C=CC(C)Nc1ccncc1 c4fde850a7b9aca67a9b7913a57f482d [0,1,0,0,0,1|2,0,0]=4 101 B11R1.40 C=CC(C)Oc1ccccn1 2070ac1050b132c193a90ece39692aa1 [0,1,0,0,0,1|2,0,0]=4 102 B11R1.40 C=CC(C)Oc1cccnc1 d79b86e283fff567ebdcf80f360890ce [0,1,0,0,0,1|2,0,0]=4 103 B11R1.40 C=CC(C)Oc1ccncc1 079ad53e8dd52e53df82424bb261b798 [0,1,0,0,0,1|2,0,0]=4 104 B11R1.40 CC(C#N)Nc1cccnc1 da7dd839df2b3e32656f7151ae7c86a2 [0,1,0,0,0,1|2,0,0]=4 105 B11R1.40 CC(C=O)Nc1ccccc1 0d04ec44ee6fe8b8d4f3d71cd15333ba [0,1,0,0,0,1|0,1,0]=3 106 B11R1.40 CC(C=O)Nc1ccccn1 f6323f482ea726d65853ab7cc1b45bb4 [0,1,0,0,0,1|1,1,0]=4 107 B11R1.40 CC(C=O)Nc1cccnc1 d9c7b2b4935781413d4a985313466b9b [0,1,0,0,0,1|1,1,0]=4 108 B11R1.40 CC(C=O)Nc1ccncc1 9d1dbf134f97c66b59956ef2739d0216 [0,1,0,0,0,1|1,1,0]=4 109 B11R1.40 CC(C=O)Oc1ccccn1 6964fdd9e0bc6b530d4dd7a3a2376b4c [0,1,0,0,0,1|1,1,0]=4 110 B11R1.40 CC(C=O)Oc1cccnc1 e37888c7c991d828e39da1a6807dceaa [0,1,0,0,0,1|1,1,0]=4 111 B11R1.40 CC(C=O)Oc1ccncc1 e75558d3547ed47505abf1a4004897c0 [0,1,0,0,0,1|1,1,0]=4 112 B11R1.40 CC(CO)Nc1ccccc1 28944821b2a2502f940043c73e5bee97 [0,1,0,0,0,1|0,1,0]=3 113 B11R1.40 CC(CO)Nc1ccccn1 2e21620844440b7bb083395c24fa5d12 [0,1,0,0,0,1|1,1,0]=4 114 B11R1.40 CC(CO)Nc1cccnc1 1993973453fc1c9eb0295a2e45197541 [0,1,0,0,0,1|1,1,0]=4 115 B11R1.40 CC(CO)Nc1ccncc1 014df859a1aaecd67e68db71b7c7ef69 [0,1,0,0,0,1|1,1,0]=4 116 B11R1.40 CCC(C)Nc1ccccc1 0d73dedeab1dd8f5149c3124f0b802dc [0,1,0,0,0,1|1,0,0]=3 117 B11R1.40 CCC(C)Nc1ccccn1 bb895d27f1d9ed94ab4cd5f93b01f0bd [0,1,0,0,0,1|2,0,0]=4 118 B11R1.40 CCC(C)Nc1cccnc1 a0e745f4d44915557790daf72381f523 [0,1,0,0,0,1|2,0,0]=4 119 B11R1.40 CCC(C)Nc1ccncc1 8150e11adca204128a3ae62428597250 [0,1,0,0,0,1|2,0,0]=4 120 B11R1.40 CCC(C)Oc1ccccn1 b8b4a806c6af90298cf0d1454fda0647 [0,1,0,0,0,1|2,0,0]=4 121 B11R1.40 CCC(C)Oc1cccnc1 ea8ea3a935f9f1da0dc64162c872e010 [0,1,0,0,0,1|2,0,0]=4 122 B11R1.40 CCC(C)Oc1ccncc1 0e7c13edf9ed6b6addf466a3a8481e15 [0,1,0,0,0,1|2,0,0]=4 123 B11R1.40 CCN(C)Cc1ccccc1 c214a7b7c23665abe56278baaf98348b [0,1,0,0,0,1|2,0,0]=4 124 B11R1.40 CC[C@@H](C)Nc1ccccc1 405a065880ecff40d5c3aba49f23a60f [0,1,0,0,0,1|1,0,0]=3 125 B11R1.40 CC[C@@H](C)Nc1cccnc1 d5c354fec9aa4824593a6aa370b31f97 [0,1,0,0,0,1|2,0,0]=4 126 B11R1.40 CC[C@H](C)Nc1ccccc1 bdf0fca4eb541010d4b75cf2b0618571 [0,1,0,0,0,1|1,0,0]=3 127 B11R1.40 CC[C@H](C)Nc1cccnc1 a188aeb369243191dc243d4fb98ce075 [0,1,0,0,0,1|2,0,0]=4 128 B11R1.40 CN(C=O)Cc1ccccc1 701ed8237afa851586621908f176512f [0,1,0,0,0,1|1,1,0]=4 129 B11R1.40 CN(CF)Cc1ccccc1 5e57d186c6f316353ffa6c809cb61d75 [0,1,0,0,0,1|2,0,0]=4 130 B11R1.40 CN(CO)Cc1ccccc1 c1d08d2d2c7de731954ebcb428d333e2 [0,1,0,0,0,1|1,1,0]=4 131 B11R1.40 C[C@@H](CO)Nc1ccccc1 d1a979ebd31c8c47073ae387eaa9c5f8 [0,1,0,0,0,1|0,1,0]=3 132 B11R1.40 C[C@@H](CO)Nc1ccccn1 9ac7427612f5553e5180ee81712e35fd [0,1,0,0,0,1|1,1,0]=4 133 B11R1.40 C[C@@H](CO)Nc1cccnc1 b4b83540aa924934ce25b37024c4f475 [0,1,0,0,0,1|1,1,0]=4 134 B11R1.40 C[C@@H](CO)Nc1ccncc1 495de922b28b07b689b24b08a715b1b6 [0,1,0,0,0,1|1,1,0]=4 135 B11R1.40 C[C@H](C=O)Nc1ccccc1 10a4433daba67da13987d6e7cd5b7f0f [0,1,0,0,0,1|0,1,0]=3 136 B11R1.40 C[C@H](C=O)Nc1ccccn1 46e94b05d4e4c715a9e5400c929646b9 [0,1,0,0,0,1|1,1,0]=4 137 B11R1.40 C[C@H](C=O)Nc1cccnc1 fedeaeec69f602e704c38cd1adea1d8e [0,1,0,0,0,1|1,1,0]=4 138 B11R1.40 C[C@H](C=O)Nc1ccncc1 2f11c12f5ae2a4a34554194fcc005f15 [0,1,0,0,0,1|1,1,0]=4 139 B11R1.40 C[C@H](C=O)Oc1ccccn1 0be2b7848388ea049450b4a9fa6678e7 [0,1,0,0,0,1|1,1,0]=4 140 B11R1.40 C[C@H](C=O)Oc1cccnc1 55db0365e7488258d11fe983dbcaf255 [0,1,0,0,0,1|1,1,0]=4 141 B11R1.40 C[C@H](C=O)Oc1ccncc1 0569f754c55d1898e8e0bee53c4f5433 [0,1,0,0,0,1|1,1,0]=4 142 B11R1.40 C[C@H](CO)Nc1ccccc1 b7592eed2c2b10dda06f47547223c567 [0,1,0,0,0,1|0,1,0]=3 143 B11R1.40 C[C@H](CO)Nc1ccccn1 01d2d5e2403842048f8ac810f41680f1 [0,1,0,0,0,1|1,1,0]=4 144 B11R1.40 C[C@H](CO)Nc1cccnc1 0388d126da012bf4a1e005fb7424e864 [0,1,0,0,0,1|1,1,0]=4 145 B11R1.40 C[C@H](CO)Nc1ccncc1 12aec410035ef0ee1b8933a8e56e1a8b [0,1,0,0,0,1|1,1,0]=4 146 B11R1.86 CC(=O)Nc1ccccc1C 7049a69ccf4e362820a37d19b9dcdc8e [0,1,0,0,0,1|0,1,1]=4 147 B11R1.86 CC(=O)Nc1ccccc1F 8577dda07f10b24e878efc2b8c63979b [0,1,0,0,0,1|0,1,1]=4 148 B11R1.86 CC(=O)Nc1ccccc1I def7ccb67f6a04593a954aa370725476 [0,1,0,0,0,1|0,1,1]=4 149 B11R1.86 CC(=O)Nc1ccccc1O e286e23dcc389b9a19e5097225c5ef71 [0,1,0,0,0,1|0,1,1]=4 150 B11R1.86 CC(=O)Nc1ccccc1S 1242ce70ea265424048fd46add1f1131 [0,1,0,0,0,1|0,1,1]=4 151 B11R1.86 CC(C)Nc1cccc[n+]1[O-] 002b21bba3d24ee1645670e08aeceb41 [0,1,0,0,0,1|2,0,0]=4 152 B11R1.86 CC(C)Nc1ccccc1I 3eed1e6c2f407ecc428748af6151fed6 [0,1,0,0,0,1|1,0,0]=3 153 B11R1.86 CC(C)Nc1cccnc1Br a687380e5aa8756bf4d5d1c2e5895a79 [0,1,0,0,0,1|2,0,0]=4 154 B11R1.86 CC(C)Nc1cccnc1Cl 69ea8d619084b1b2778d6c21db2c80fb [0,1,0,0,0,1|2,0,0]=4 155 B11R1.86 CC(C)Nc1cccnc1F 893908ba00122d7cec7a3e9e3be67dd0 [0,1,0,0,0,1|2,0,0]=4 156 B11R1.86 CC(C)Nc1cccnc1I 51a846c9c1560b89c89fa64730a3deb3 [0,1,0,0,0,1|2,0,0]=4 157 B11R1.86 CC(C)Nc1ccncc1Br e596052c6754555b45104840e29c9959 [0,1,0,0,0,1|2,0,0]=4 158 B11R1.86 CC(C)Nc1ccncc1Cl 692462569093beed2014348ff5439bd9 [0,1,0,0,0,1|2,0,0]=4 159 B11R1.86 CC(C)Nc1ccncc1F 802dcf9c8e6305905595b97ec24ca83d [0,1,0,0,0,1|2,0,0]=4 160 B11R1.86 CC(C)Nc1ccncc1I f42128d1b412011706fba5240c2e234a [0,1,0,0,0,1|2,0,0]=4 161 B11R1.86 CC(C)Nc1cnccc1Cl 9286675edb1a06121c1b48201bbd38ab [0,1,0,0,0,1|2,0,0]=4 162 B11R1.86 CC(C)Nc1cnccc1F d36a1ce63436ee8a7fe7bd2f44ea5dbd [0,1,0,0,0,1|2,0,0]=4 163 B11R1.86 CC(C)Nc1cnccc1I ef08c6d9916171418c74e22e8ea78aab [0,1,0,0,0,1|2,0,0]=4 164 B11R1.86 CC(C)Nc1ncccc1F 6f5840dc300786776e2e321fcdb5f56b [0,1,0,0,0,1|2,0,0]=4 165 B11R1.86 CC(C)Nc1ncccc1I 532c9ce1b71264e87c45674524d2fb56 [0,1,0,0,0,1|2,0,0]=4 166 B11R1.86 CC(C)Oc1ccc[nH]c1=S af7a587cdb1aeebef35b500fdd4289f5 [0,1,0,0,0,1|2,0,0]=4 167 B11R1.86 CC(C)Oc1cccc[n+]1[O-] 10611fdb1ef3435c39bd2cacbc1b5ed5 [0,1,0,0,0,1|2,0,0]=4 168 B11R1.86 CC(C)Oc1ccccc1Cl c23b66f89632f42c5d307b4af3111d42 [0,1,0,0,0,1|1,0,0]=3 169 B11R1.86 CC(C)Oc1ccccc1F 883d2c1cc9d854cb85fa804d83d6f507 [0,1,0,0,0,1|1,0,0]=3 170 B11R1.86 CC(C)Oc1ccccc1I 5b38c2c613687166fa94711069ce6a86 [0,1,0,0,0,1|1,0,0]=3 171 B11R1.86 CC(C)Oc1ccccc1S 75d24c98473e29b4fc09eb15793f8071 [0,1,0,0,0,1|1,0,0]=3 172 B11R1.86 CC(C)Oc1cccnc1Br 41da9105aa46a4cc5b28d1151f766f7c [0,1,0,0,0,1|2,0,0]=4 173 B11R1.86 CC(C)Oc1cccnc1Cl 5f47c201110ae76c3f20771d30f413ac [0,1,0,0,0,1|2,0,0]=4 174 B11R1.86 CC(C)Oc1cccnc1F 5024034c0e002e24ad11e1d6328a6435 [0,1,0,0,0,1|2,0,0]=4 175 B11R1.86 CC(C)Oc1cccnc1I 452ebdc4006c876f552145b479069297 [0,1,0,0,0,1|2,0,0]=4 176 B11R1.86 CC(C)Oc1cccoc1=O 40032c53cdaa862447e101ae5829df37 [0,1,0,0,0,1|2,0,0]=4 177 B11R1.86 CC(C)Oc1ccncc1Br 19a74c8f130c4f5a2ca0ac00315ac896 [0,1,0,0,0,1|2,0,0]=4 178 B11R1.86 CC(C)Oc1ccncc1Cl e9ec19e818e2bc1fafa3aee746091000 [0,1,0,0,0,1|2,0,0]=4 179 B11R1.86 CC(C)Oc1ccncc1F 2c1131f1cf9aea7ce8b673f2b786cc54 [0,1,0,0,0,1|2,0,0]=4 180 B11R1.86 CC(C)Oc1cnccc1Br d266279798ad748ca463f4d7f3f9adac [0,1,0,0,0,1|2,0,0]=4 181 B11R1.86 CC(C)Oc1cnccc1Cl 8d0804b21d39d2da2453c643a62be877 [0,1,0,0,0,1|2,0,0]=4 182 B11R1.86 CC(C)Oc1cnccc1F 2f3c830875644371b715186f6a3a53d7 [0,1,0,0,0,1|2,0,0]=4 183 B11R1.86 CC(C)Oc1cnccc1I 0e40e93e631b7a656560ba0272883482 [0,1,0,0,0,1|2,0,0]=4 184 B11R1.86 CC(C)Oc1coccc1=O 4d1b0da98e9bb63884871a804e330837 [0,1,0,0,0,1|2,0,0]=4 185 B11R1.86 CC(C)Oc1ncccc1Br 3d4ea0f45df93141b027452ac7d893d8 [0,1,0,0,0,1|2,0,0]=4 186 B11R1.86 CC(C)Oc1ncccc1Cl 9581b31c20e69ea270ecf789bba7b204 [0,1,0,0,0,1|2,0,0]=4 187 B11R1.86 CC(C)Oc1ncccc1F 366877e5493bef2aca6740e317ad0785 [0,1,0,0,0,1|2,0,0]=4 188 B11R1.86 CC(C)On1ccccc1=N 4ae1f304fba835ddd2d4147240ac35fb [0,1,0,0,0,1|2,0,0]=4 189 B11R1.86 CC(C)On1ccccc1=O 22cb614e9cef459cdf1d194311410b8b [0,1,0,0,0,1|2,0,0]=4 190 B11R1.86 CC(C)On1ccccc1=S c35b26e2d1b24665cc8b4412ddcdecc1 [0,1,0,0,0,1|2,0,0]=4 191 B11R1.86 Cc1ccccc1OC(C)C e336697c807367b5d2038eeb2d20cb38 [0,1,0,0,0,1|1,0,0]=3 192 B11R1.86 Cc1cccnc1NC(C)C ca53f8740b6496eebb84463f2bacb5a7 [0,1,0,0,0,1|2,0,0]=4 193 B11R1.86 Cc1cccnc1OC(C)C 2f4605dd9175a92f8b23a3625dc7655c [0,1,0,0,0,1|2,0,0]=4 194 B11R1.86 Cc1ccncc1OC(C)C 6e2f25c7be333db7d06187bc11a46726 [0,1,0,0,0,1|2,0,0]=4 195 B11R1.86 Cc1cnccc1NC(C)C 0b91d986e8b999a69ce7977f721b4bab [0,1,0,0,0,1|2,0,0]=4 196 B11R1.86 Cc1cnccc1OC(C)C 0182e6e6188a5bd0fd92877deb3f0f63 [0,1,0,0,0,1|2,0,0]=4 197 B11R1.86 Cc1ncccc1NC(C)C ab0ea95484d50f8fd20357062d11cc88 [0,1,0,0,0,1|2,0,0]=4 198 B11R1.86 Cc1ncccc1OC(C)C 3bc8395d80b6d7a4cbb4afe4d1590f68 [0,1,0,0,0,1|2,0,0]=4 199 B11R1.157 CC(=O)Nc1cccc(c1)C 9a7c9b465401dd095659742e6c3e194a [0,1,0,0,0,1|0,1,1]=4 200 B11R1.157 CC(=O)Nc1cccc(c1)Cl a4a6d31d02767cbd28a554abdc9d7f9c [0,1,0,0,0,1|0,1,1]=4 201 B11R1.157 CC(=O)Nc1cccc(c1)F c6f0d045fd7da349c2147d19a6b5c925 [0,1,0,0,0,1|0,1,1]=4 202 B11R1.157 CC(=O)Nc1cccc(c1)I 6985e662c065e5f04703904aecec87c5 [0,1,0,0,0,1|0,1,1]=4 203 B11R1.157 CC(=O)Nc1cccc(c1)O 83fd7000bcb1a1edfb73e9c940896bf1 [0,1,0,0,0,1|0,1,1]=4 204 B11R1.157 CC(=O)Nc1cccc(c1)S c491dfa7e666418d0885014c41e759e8 [0,1,0,0,0,1|0,1,1]=4 205 B11R1.157 CC(C)Nc1cc(ccn1)Br ede334b0086465a9e421d24727c4af48 [0,1,0,0,0,1|2,0,0]=4 206 B11R1.157 CC(C)Nc1cc(ccn1)Cl 4657c8906495d89fadc59595bd54c150 [0,1,0,0,0,1|2,0,0]=4 207 B11R1.157 CC(C)Nc1cc(ccn1)F ef287f108744f6c18c5f49d744df2b4a [0,1,0,0,0,1|2,0,0]=4 208 B11R1.157 CC(C)Nc1cc(ccn1)I e2bc63e72569a419f8e6f6c1760decc0 [0,1,0,0,0,1|2,0,0]=4 209 B11R1.157 CC(C)Nc1cc[nH]c(=S)c1 943e2f3af2236045092551a8b698d760 [0,1,0,0,0,1|2,0,0]=4 210 B11R1.157 CC(C)Nc1cccc(c1)Br c1a310149209bebd05d401b8d9453768 [0,1,0,0,0,1|1,0,0]=3 211 B11R1.157 CC(C)Nc1cccc(c1)Cl 88b649511dda4c3138b09b24b4cdf85e [0,1,0,0,0,1|1,0,0]=3 212 B11R1.157 CC(C)Nc1cccc(c1)F 2469bb14dda7a11ffa1e171e9579afdb [0,1,0,0,0,1|1,0,0]=3 213 B11R1.157 CC(C)Nc1cccc(c1)I 28c8d38bd4c860795c7f6ab5b08202d3 [0,1,0,0,0,1|1,0,0]=3 214 B11R1.157 CC(C)Nc1cccc(c1)S 4d5403275c38f6ee6364ab78831bae52 [0,1,0,0,0,1|1,0,0]=3 215 B11R1.157 CC(C)Nc1cccc(n1)Br 891f541b9adc7b0ca8f76cb7e39c8b39 [0,1,0,0,0,1|2,0,0]=4 216 B11R1.157 CC(C)Nc1cccc(n1)I 8d2a49a9d3ceb895e3574586ee1c89bf [0,1,0,0,0,1|2,0,0]=4 217 B11R1.157 CC(C)Nc1ccnc(c1)Br 4af3800bff929822af3b4739eff8eddc [0,1,0,0,0,1|2,0,0]=4 218 B11R1.157 CC(C)Nc1ccnc(c1)Cl 766191311591fa4b6d81b2509e2aebbd [0,1,0,0,0,1|2,0,0]=4 219 B11R1.157 CC(C)Nc1ccnc(c1)F f733e1ce2ac4ea46e404373b197b867b [0,1,0,0,0,1|2,0,0]=4 220 B11R1.157 CC(C)Nc1ccnc(c1)I 2df22ebd7dbeb99f813a36b914800a99 [0,1,0,0,0,1|2,0,0]=4 221 B11R1.157 CC(C)Nc1cncc(c1)Cl c26350b11d8c01ec2f1f210f522bf42f [0,1,0,0,0,1|2,0,0]=4 222 B11R1.157 CC(C)Nc1cncc(c1)F c0d792196e8876c1a0df52cc6f431e54 [0,1,0,0,0,1|2,0,0]=4 223 B11R1.157 CC(C)Nc1cncc(c1)I 5165104992f08facddd648b36b59a9a8 [0,1,0,0,0,1|2,0,0]=4 224 B11R1.157 CC(C)Oc1cc(ccn1)Br 3480ee35d8ae0d5d11b7aa683499591e [0,1,0,0,0,1|2,0,0]=4 225 B11R1.157 CC(C)Oc1cc(ccn1)Cl d3d971cd1e336a781f870de87e0a3e03 [0,1,0,0,0,1|2,0,0]=4 226 B11R1.157 CC(C)Oc1cc(ccn1)F fb9a7af5c09ecabe8fe4cffddc870db1 [0,1,0,0,0,1|2,0,0]=4 227 B11R1.157 CC(C)Oc1ccc[n+](c1)[O-] b00660a7d3334e38c94bae1aa15bfa44 [0,1,0,0,0,1|2,0,0]=4 228 B11R1.157 CC(C)Oc1cccc(=O)[nH]1 13625ddc45965e087d906cecd50738c3 [0,1,0,0,0,1|2,0,0]=4 229 B11R1.157 CC(C)Oc1cccc(c1)Br 03d6e4f39dc83644234524de153060f8 [0,1,0,0,0,1|1,0,0]=3 230 B11R1.157 CC(C)Oc1cccc(c1)Cl b05958621a80ad10943fb41bda6c4ff4 [0,1,0,0,0,1|1,0,0]=3 231 B11R1.157 CC(C)Oc1cccc(c1)F cc5136a263bfb966a933f5c182f882fd [0,1,0,0,0,1|1,0,0]=3 232 B11R1.157 CC(C)Oc1cccc(c1)I eecf4227dddae0c4ffe51c7d1a2196a6 [0,1,0,0,0,1|1,0,0]=3 233 B11R1.157 CC(C)Oc1cccc(c1)S c0ecc340d31d590be5ee243f9c89bfa6 [0,1,0,0,0,1|1,0,0]=3 234 B11R1.157 CC(C)Oc1cccc(n1)Br a18346d99926fef9a7886c50d31b0717 [0,1,0,0,0,1|2,0,0]=4 235 B11R1.157 CC(C)Oc1cccc(n1)F 4bfa0974aa476b6675e47db0c31b5390 [0,1,0,0,0,1|2,0,0]=4 236 B11R1.157 CC(C)Oc1ccnc(c1)Br 8163155dc9554a826c1579a6cd8b8a53 [0,1,0,0,0,1|2,0,0]=4 237 B11R1.157 CC(C)Oc1ccnc(c1)Cl 65c976867642144996957df346a8a86e [0,1,0,0,0,1|2,0,0]=4 238 B11R1.157 CC(C)Oc1ccnc(c1)F ba6b23e91f130a75063ccfe77ebe581a [0,1,0,0,0,1|2,0,0]=4 239 B11R1.157 CC(C)Oc1cncc(c1)Cl 388d88d9e0df30a2ba0e40f8f1524c25 [0,1,0,0,0,1|2,0,0]=4 240 B11R1.157 CC(C)Oc1cncc(c1)F a1defac1377360a458739a468937d592 [0,1,0,0,0,1|2,0,0]=4 241 B11R1.157 CC(C)Oc1cncc(c1)I 277b82df97e12d2b7f27e78d9949ff74 [0,1,0,0,0,1|2,0,0]=4 242 B11R1.157 Cc1cc(ccn1)NC(C)C 0a6ae8318e6544f792c3080ec507bf61 [0,1,0,0,0,1|2,0,0]=4 243 B11R1.157 Cc1cc(ccn1)OC(C)C 8187a967c8823cc680c7bbf8143ee8a4 [0,1,0,0,0,1|2,0,0]=4 244 B11R1.157 Cc1cccc(c1)NC(C)C 6995924353e7f43790a327361636dd3c [0,1,0,0,0,1|1,0,0]=3 245 B11R1.157 Cc1cccc(c1)OC(C)C 768a0b78053567f181c821d541878835 [0,1,0,0,0,1|1,0,0]=3 246 B11R1.157 Cc1cccc(n1)NC(C)C 0fa0e842298c41943400547750aed7ea [0,1,0,0,0,1|2,0,0]=4 247 B11R1.157 Cc1cccc(n1)OC(C)C 791927ccd2fefd725c286781ac8b13c0 [0,1,0,0,0,1|2,0,0]=4 248 B11R1.157 Cc1ccnc(c1)NC(C)C d5f3d252110a2ee12b556e117762673a [0,1,0,0,0,1|2,0,0]=4 249 B11R1.157 Cc1ccnc(c1)OC(C)C 8636d90e36f69158a147da7734120e09 [0,1,0,0,0,1|2,0,0]=4 250 B11R1.157 Cc1cncc(c1)NC(C)C 16b6df361413b730dd0edaa3dd52fb68 [0,1,0,0,0,1|2,0,0]=4 251 B11R1.509 CC(C)(C)Nc1ccccc1 820b34717c3d9476c22fcc3db6fccee9 [0,1,0,0,0,1|1,0,0]=3 252 B11R1.509 CC(C)(C)Nc1cccnc1 22afe0912ef2c695ba26155c9d7e4850 [0,1,0,0,0,1|2,0,0]=4 253 B11R1.22 CCN(C)c1ccc(cc1)F 37e2d475a9bd3cfcf296a94fc69fd067 [0,2,0,0,0,0|2,0,0]=4 254 B11R1.22 CCN(C)c1ccc(cc1)I 6deef7aec400603f68eb68f0833942ec [0,2,0,0,0,0|2,0,0]=4 255 B11R1.22 CCN(C)c1ccc(cc1)S 429f96f94511567839fe68b5edd62f1c [0,2,0,0,0,0|2,0,0]=4 256 B11R1.22 CN(C=O)c1ccc(cc1)Br 9862ed13c945c79fb65fa51787bd2093 [0,2,0,0,0,0|1,1,0]=4 257 B11R1.22 CN(C=O)c1ccc(cc1)Cl d432c23837319192897a660c45f339ba [0,2,0,0,0,0|1,1,0]=4 258 B11R1.22 CN(C=O)c1ccc(cc1)F f939c668a8e6f39bb7cc93a9ebd979dd [0,2,0,0,0,0|1,1,0]=4 259 B11R1.22 CN(C=O)c1ccc(cc1)I 86b31576c767147a57657625de6a4cf6 [0,2,0,0,0,0|1,1,0]=4 260 B11R1.22 CN(C=O)c1ccc(cc1)O 71050cca6cc6c2a34d54c8525596398a [0,2,0,0,0,0|1,1,0]=4 261 B11R1.22 CN(C=O)c1ccc(cc1)S f07b31b3eaa976c4ece94ae29131a1b8 [0,2,0,0,0,0|1,1,0]=4 262 B11R1.22 CN(CF)c1ccc(cc1)Br 6b91b8da88ddbfb295c2dccdb6cb4076 [0,2,0,0,0,0|2,0,0]=4 263 B11R1.22 CN(CF)c1ccc(cc1)Cl 0c4cb302bade12f5a411b01a9042b3ea [0,2,0,0,0,0|2,0,0]=4 264 B11R1.22 CN(CF)c1ccc(cc1)F 7a7162e57e22a4f5e6a55d2c6d204d3d [0,2,0,0,0,0|2,0,0]=4 265 B11R1.22 CN(CF)c1ccc(cc1)I 6d998585b1c8e8e7964bc459bdd74230 [0,2,0,0,0,0|2,0,0]=4 266 B11R1.22 CN(CF)c1ccc(cc1)S 790104648dfcde077abfb3f2fb190f26 [0,2,0,0,0,0|2,0,0]=4 267 B11R1.22 CN(CO)c1ccc(cc1)Br a0ee612d9ade0f057f40eda0edee63d6 [0,2,0,0,0,0|1,1,0]=4 268 B11R1.22 CN(CO)c1ccc(cc1)Cl 2c0dfaf13b4e02b467d222656644d816 [0,2,0,0,0,0|1,1,0]=4 269 B11R1.22 CN(CO)c1ccc(cc1)F c1ecf99a3d9f55a2562607c88c44d1b8 [0,2,0,0,0,0|1,1,0]=4 270 B11R1.22 CN(CO)c1ccc(cc1)I 148086324dd93cd760089e4e94a122ba [0,2,0,0,0,0|1,1,0]=4 271 B11R1.22 CN(CO)c1ccc(cc1)S 7e6f64a1230a5e349b82adbdac7f2cd1 [0,2,0,0,0,0|1,1,0]=4 272 B11R1.22 Cc1ccc(cc1)N(C)C=O c253ca59971334503e7e1b5bdad7856f [0,2,0,0,0,0|1,1,0]=4 273 B11R1.22 Cc1ccc(cc1)N(C)CF d9ca75efcf22688224e11802328b1cd1 [0,2,0,0,0,0|2,0,0]=4 274 B11R1.22 Cc1ccc(cc1)N(C)CO 3f90488aa46443ae7ceb46a9828e79d3 [0,2,0,0,0,0|1,1,0]=4 275 B11R1.12 CCN(C#N)c1ccccc1 0a33bcc251eace95a09e2548bafab86c [0,2,0,0,0,0|2,0,0]=4 276 B11R1.12 CCN(C=O)c1ccccc1 da6bb0dc53f1d66135131d66e3bbe341 [0,2,0,0,0,0|1,1,0]=4 277 B11R1.12 CCN(CF)c1ccccc1 64bfdf9f1ec7c91dbb7909bf38760f4f [0,2,0,0,0,0|2,0,0]=4 278 B11R1.12 N#CN(CO)c1ccccc1 a68ba6ef8e1f16dac15967f291cfe801 [0,2,0,0,0,0|2,0,0]=4 279 B11R1.16 C#CCN(C)c1ccccc1 3ca89e194431e8e98a41325339f135b2 [0,2,0,0,0,0|2,0,0]=4 280 B11R1.16 C=CCN(C)c1ccccc1 cb57bdb31a063701918aa00f058638bf [0,2,0,0,0,0|2,0,0]=4 281 B11R1.16 CC(NC=O)c1ccccc1 912f825ae8ec09ad8cb929f90e443d73 [0,2,0,0,0,0|0,1,0]=3 282 B11R1.16 CC(NC=O)c1ccccn1 2d9ff4713c5fb2a2245e54b6347c7c9e [0,2,0,0,0,0|1,1,0]=4 283 B11R1.16 CC(NC=O)c1cccnc1 8993d9f42ad801a00b7dbd874864f118 [0,2,0,0,0,0|1,1,0]=4 284 B11R1.16 CC(NC=O)c1ccncc1 5faf024cdfd5434d1564838bc71dc42c [0,2,0,0,0,0|1,1,0]=4 285 B11R1.16 CC(NCF)c1ccccn1 0905269fa9a0af5b89b0863135e0ba86 [0,2,0,0,0,0|2,0,0]=4 286 B11R1.16 CC(NCF)c1cccnc1 06f634f0617dadb8cf037734a8a97de2 [0,2,0,0,0,0|2,0,0]=4 287 B11R1.16 CC(NCF)c1ccncc1 52244c9bda4d3b96fb892679ba84673a [0,2,0,0,0,0|2,0,0]=4 288 B11R1.16 CC(NCO)c1ccccn1 92e2d7a3e5eb4a0cf656a3abd8120ca1 [0,2,0,0,0,0|1,1,0]=4 289 B11R1.16 CC(NCO)c1cccnc1 862c30acc11398ef9d9eed839c208db8 [0,2,0,0,0,0|1,1,0]=4 290 B11R1.16 CC(NCO)c1ccncc1 c1d5cc5db08b36fc1a8cd8b573f9e139 [0,2,0,0,0,0|1,1,0]=4 291 B11R1.16 CC(OCF)c1ccccc1 a5a4510633c1500ac034b294490d7f65 [0,2,0,0,0,0|0,1,0]=3 292 B11R1.16 CC(OCF)c1ccccn1 2375003933f3ce846737f38420e767b3 [0,2,0,0,0,0|1,1,0]=4 293 B11R1.16 CC(OCF)c1cccnc1 38385d8a804ea3beb03ef81ac1897631 [0,2,0,0,0,0|1,1,0]=4 294 B11R1.16 CC(OCF)c1ccncc1 6bf0979779201a0d2383a11ee6cede62 [0,2,0,0,0,0|1,1,0]=4 295 B11R1.16 CCCN(C)c1ccccc1 5333b12ce18e2a38096b8e486fed114a [0,2,0,0,0,0|2,0,0]=4 296 B11R1.16 CCNC(C)c1ccccc1 af03e39d181c5fd668bda5d6f7d06e14 [0,2,0,0,0,0|1,0,0]=3 297 B11R1.16 CCNC(C)c1ccccn1 1349d82fdb3aca31d54d33a892f4429f [0,2,0,0,0,0|2,0,0]=4 298 B11R1.16 CCNC(C)c1cccnc1 c47433cc5cae1ddbdb53f6ca3e6bfaaf [0,2,0,0,0,0|2,0,0]=4 299 B11R1.16 CCNC(C)c1ccncc1 4381b6d20643b9397cf1c3275f14ef7f [0,2,0,0,0,0|2,0,0]=4 300 B11R1.16 CCN[C@@H](C)c1ccccc1 994b5b0b50363ecab1efd5b7f9e6d7cd [0,2,0,0,0,0|1,0,0]=3 301 B11R1.16 CCN[C@@H](C)c1ccccn1 6becaa5dd299afbde8d9e40b8df2b64b [0,2,0,0,0,0|2,0,0]=4 302 B11R1.16 CCN[C@@H](C)c1cccnc1 330151f91eef2953e097f24cd8fe5255 [0,2,0,0,0,0|2,0,0]=4 303 B11R1.16 CCN[C@@H](C)c1ccncc1 00312d91ebda62098fbd65a2d65ba17c [0,2,0,0,0,0|2,0,0]=4 304 B11R1.16 CCN[C@H](C)c1ccccc1 af432512ad94856da6ef9d44592c3502 [0,2,0,0,0,0|1,0,0]=3 305 B11R1.16 CCN[C@H](C)c1ccccn1 de5b9d337b6c15bb985fd6d76426b016 [0,2,0,0,0,0|2,0,0]=4 306 B11R1.16 CCN[C@H](C)c1cccnc1 7cb1b35ff9549b4a705f07ae86659632 [0,2,0,0,0,0|2,0,0]=4 307 B11R1.16 CCN[C@H](C)c1ccncc1 d9dd8baf03e60276588d8bf323f0d599 [0,2,0,0,0,0|2,0,0]=4 308 B11R1.16 CCOC(C)c1ccccc1 37108e833ff536d25c550cb5b37c873d [0,2,0,0,0,0|0,1,0]=3 309 B11R1.16 CCOC(C)c1ccccn1 2349fef21e807c42cd2b612eadfb89fd [0,2,0,0,0,0|1,1,0]=4 310 B11R1.16 CCOC(C)c1cccnc1 9c9e8ee26a948f6734fe8bca4ac259d1 [0,2,0,0,0,0|1,1,0]=4 311 B11R1.16 CCOC(C)c1ccncc1 e4e418e4b9933d9ffab69561c2ee0b8d [0,2,0,0,0,0|1,1,0]=4 312 B11R1.16 CCO[C@@H](C)c1ccccc1 e4f11a13dd3f609e6f25ac3a3b969fe2 [0,2,0,0,0,0|0,1,0]=3 313 B11R1.16 CCO[C@@H](C)c1ccccn1 d31d85c16530817c2b81fb1a03fe7e57 [0,2,0,0,0,0|1,1,0]=4 314 B11R1.16 CCO[C@@H](C)c1cccnc1 4f79e80bc80f924c1d9263e4c7a80e48 [0,2,0,0,0,0|1,1,0]=4 315 B11R1.16 CCO[C@@H](C)c1ccncc1 10c7e45b7f2432aed0d2d85f0e9de43f [0,2,0,0,0,0|1,1,0]=4 316 B11R1.16 CCO[C@H](C)c1ccccc1 54694971b3853f962e687b61e7c698c1 [0,2,0,0,0,0|0,1,0]=3 317 B11R1.16 CCO[C@H](C)c1ccccn1 c768b24f1cd72ff8137851b753ae2d04 [0,2,0,0,0,0|1,1,0]=4 318 B11R1.16 CCO[C@H](C)c1cccnc1 cd637b20fb4bf525c6de41c7953f4069 [0,2,0,0,0,0|1,1,0]=4 319 B11R1.16 CCO[C@H](C)c1ccncc1 be826d73c7c9b4a2a044295b6bfe0a2c [0,2,0,0,0,0|1,1,0]=4 320 B11R1.16 CN(CC#N)c1ccccc1 e4996d8d05652ac5f69757d7a543c8c3 [0,2,0,0,0,0|2,0,0]=4 321 B11R1.16 CN(CC=O)c1ccccc1 669b7315010cb1229c9893a5bac75e38 [0,2,0,0,0,0|1,1,0]=4 322 B11R1.16 CN(CCF)c1ccccc1 10541e2e32dac0db7a85ea44620c0e3e [0,2,0,0,0,0|2,0,0]=4 323 B11R1.16 CN(CCO)c1ccccc1 4b734b8d391d02ddf47f0308fb1d22c8 [0,2,0,0,0,0|1,1,0]=4 324 B11R1.16 CN(CCS)c1ccccn1 de84abbd40dd1eead0c63b1f2ba48791 [0,2,0,0,0,0|2,0,0]=4 325 B11R1.16 CN(CCS)c1cccnc1 5bb9078bc645c6a66ca8b72acfaf15de [0,2,0,0,0,0|2,0,0]=4 326 B11R1.16 CN(CCS)c1ccncc1 6b7a6f86f0d58bddc30bb09414ed45b7 [0,2,0,0,0,0|2,0,0]=4 327 B11R1.16 COCN(C)c1ccccc1 6231e4bc9ebe3bdb02fd15faeb34634f [0,2,0,0,0,0|1,1,0]=4 328 B11R1.16 CSCN(C)c1ccccc1 6fe637e44a17092ac12098dbdcb5352f [0,2,0,0,0,0|1,0,0]=3 329 B11R1.16 CSCN(C)c1ccccn1 b50faf9300869282fdd09bc9d262195a [0,2,0,0,0,0|2,0,0]=4 330 B11R1.16 CSCN(C)c1cccnc1 85210a97edc62a2031929b5c7394c57b [0,2,0,0,0,0|2,0,0]=4 331 B11R1.16 CSCN(C)c1ccncc1 4f774618b2036be44522889267e87b2f [0,2,0,0,0,0|2,0,0]=4 332 B11R1.16 C[C@@H](NC=O)c1ccccc1 ed3cbc790dab943801487e30e3a37c11 [0,2,0,0,0,0|0,1,0]=3 333 B11R1.16 C[C@@H](NC=O)c1ccccn1 cab0a06ffe0df70443a13b7bf3f0f929 [0,2,0,0,0,0|1,1,0]=4 334 B11R1.16 C[C@@H](NC=O)c1cccnc1 ac95236c8efa48d11de85080c1ed1da7 [0,2,0,0,0,0|1,1,0]=4 335 B11R1.16 C[C@@H](NC=O)c1ccncc1 8f84254a89086749004a481ae3d5fd96 [0,2,0,0,0,0|1,1,0]=4 336 B11R1.16 C[C@@H](NCF)c1ccccn1 99b97b5aa9cfaef5c750c0b6f424a155 [0,2,0,0,0,0|2,0,0]=4 337 B11R1.16 C[C@@H](NCF)c1cccnc1 661209de32fd81ce54914e1bd942009a [0,2,0,0,0,0|2,0,0]=4 338 B11R1.16 C[C@@H](NCF)c1ccncc1 7c723b81de2f22629dc13a66a3539cc2 [0,2,0,0,0,0|2,0,0]=4 339 B11R1.16 C[C@@H](NCO)c1ccccn1 06a1df171fb3e867c231d94d30fe4c59 [0,2,0,0,0,0|1,1,0]=4 340 B11R1.16 C[C@@H](NCO)c1cccnc1 cf5dbaaa37b8cb4e2f16350a55683027 [0,2,0,0,0,0|1,1,0]=4 341 B11R1.16 C[C@@H](NCO)c1ccncc1 7d10d857a4fd7fe5ca5ccba46504091e [0,2,0,0,0,0|1,1,0]=4 342 B11R1.16 C[C@@H](OCF)c1ccccc1 f6dc1405e5744871891f84657f997fd4 [0,2,0,0,0,0|0,1,0]=3 343 B11R1.16 C[C@@H](OCF)c1ccccn1 452563b793d445f90c7b5445d0861252 [0,2,0,0,0,0|1,1,0]=4 344 B11R1.16 C[C@@H](OCF)c1cccnc1 700f73ac95c9eff915753055610d6829 [0,2,0,0,0,0|1,1,0]=4 345 B11R1.16 C[C@@H](OCF)c1ccncc1 1ab9725f241037c368e977085ea4a520 [0,2,0,0,0,0|1,1,0]=4 346 B11R1.16 C[C@H](NC=O)c1ccccc1 0ca5dec48ba28ecff3cefea41bc874f0 [0,2,0,0,0,0|0,1,0]=3 347 B11R1.16 C[C@H](NC=O)c1ccccn1 353a0771be422f9d7abafb8a3ade0569 [0,2,0,0,0,0|1,1,0]=4 348 B11R1.16 C[C@H](NC=O)c1cccnc1 03b40f19b3a9bf3d85026c98e0fcf432 [0,2,0,0,0,0|1,1,0]=4 349 B11R1.16 C[C@H](NC=O)c1ccncc1 a397d98d692b7c5c0acb296625e84080 [0,2,0,0,0,0|1,1,0]=4 350 B11R1.16 C[C@H](NCF)c1ccccn1 3f81f6af69df7aaa916f5a60f5ffdf6c [0,2,0,0,0,0|2,0,0]=4 351 B11R1.16 C[C@H](NCF)c1cccnc1 66a2dcad38cbf0d519df63526d229e46 [0,2,0,0,0,0|2,0,0]=4 352 B11R1.16 C[C@H](NCF)c1ccncc1 01b512844ac187d8e5e90b8a3d251ae9 [0,2,0,0,0,0|2,0,0]=4 353 B11R1.16 C[C@H](NCO)c1ccccn1 d98746896574333cf45787ddae8ffaa8 [0,2,0,0,0,0|1,1,0]=4 354 B11R1.16 C[C@H](NCO)c1cccnc1 476af247167559627f6aa699dfa54495 [0,2,0,0,0,0|1,1,0]=4 355 B11R1.16 C[C@H](NCO)c1ccncc1 6f6a1ba3773069295a22e913e615ab17 [0,2,0,0,0,0|1,1,0]=4 356 B11R1.16 C[C@H](OCF)c1ccccc1 0bdd092ad3daed19f52c193b52481cfc [0,2,0,0,0,0|0,1,0]=3 357 B11R1.16 C[C@H](OCF)c1ccccn1 6ecec266ea2cccd56a91b2c7f7312784 [0,2,0,0,0,0|1,1,0]=4 358 B11R1.16 C[C@H](OCF)c1cccnc1 1642ade6f48ada445386d02dbd40b795 [0,2,0,0,0,0|1,1,0]=4 359 B11R1.16 C[C@H](OCF)c1ccncc1 1ba2b2d00b1ff65d044471b9d6a9a89a [0,2,0,0,0,0|1,1,0]=4 360 B11R1.23 CCN(C)c1cccc(c1)Br b9912e02c1f17bb41ebd144c9e9202ee [0,2,0,0,0,0|2,0,0]=4 361 B11R1.23 CCN(C)c1cccc(c1)F 430101ed975145c517dcbcb463820b73 [0,2,0,0,0,0|2,0,0]=4 362 B11R1.23 CN(C=O)c1cccc(c1)Br 04e2b42b796ef8d05d5e843c6bfac7b3 [0,2,0,0,0,0|1,1,0]=4 363 B11R1.23 CN(C=O)c1cccc(c1)Cl 6a133c007011cf0443d8614b42cd9db1 [0,2,0,0,0,0|1,1,0]=4 364 B11R1.23 CN(C=O)c1cccc(c1)F d6a1f4912d17ef5b2ef6dd6e9a7cc16c [0,2,0,0,0,0|1,1,0]=4 365 B11R1.23 CN(C=O)c1cccc(c1)I 0412fe6299fa843b927c099de9b2eca3 [0,2,0,0,0,0|1,1,0]=4 366 B11R1.23 CN(C=O)c1cccc(c1)O 61c55a3ac80552d55fb98f08b327401d [0,2,0,0,0,0|1,1,0]=4 367 B11R1.23 CN(CF)c1cccc(c1)Br 7a123ee73cafbdd957621bfb9faccc3f [0,2,0,0,0,0|2,0,0]=4 368 B11R1.23 CN(CF)c1cccc(c1)Cl 3c5b88557b8c81a0b3c7ed9ad71bde08 [0,2,0,0,0,0|2,0,0]=4 369 B11R1.23 CN(CF)c1cccc(c1)F 222030735d42d27fe394bc21ac4ac2c3 [0,2,0,0,0,0|2,0,0]=4 370 B11R1.23 CN(CF)c1cccc(c1)I a4932831bd90a86126da38899926fb81 [0,2,0,0,0,0|2,0,0]=4 371 B11R1.23 CN(CO)c1cccc(c1)Br 338387980ae1b5bd1aeb8f0f3d8c21d1 [0,2,0,0,0,0|1,1,0]=4 372 B11R1.23 CN(CO)c1cccc(c1)Cl cddd29b5bf9afdf9ebf4b5b2535c5ce6 [0,2,0,0,0,0|1,1,0]=4 373 B11R1.23 CN(CO)c1cccc(c1)F 0413508efd514c5105c44e46cec3cac8 [0,2,0,0,0,0|1,1,0]=4 374 B11R1.23 CN(CO)c1cccc(c1)I 1efe9cbcfb545c4004f668bff7e82fc4 [0,2,0,0,0,0|1,1,0]=4 375 B11R1.23 Cc1cccc(c1)N(C)C=O 8d3d604d6ddb9f04039aac9ce5e10e5e [0,2,0,0,0,0|1,1,0]=4 376 B11R1.222 CCN(C)c1ccccc1C 9f04b12bb5b89a6592eb728905a01c8b [0,2,0,0,0,0|2,0,0]=4 377 B11R1.222 CCN(C)c1ccccc1F f232548c9b2f85032dbceb393dfbf769 [0,2,0,0,0,0|2,0,0]=4 378 B11R1.222 CN(C=O)c1ccccc1Br 3426899914cb277130ea1a231941052f [0,2,0,0,0,0|1,1,0]=4 379 B11R1.222 CN(C=O)c1ccccc1Cl 135f44500c6825a6172cd53bd209f325 [0,2,0,0,0,0|1,1,0]=4 380 B11R1.222 CN(C=O)c1ccccc1F b02bb0760d6e84d207ae27e31e461504 [0,2,0,0,0,0|1,1,0]=4 381 B11R1.222 CN(C=O)c1ccccc1O 4c3e44ceba918ddfd6ff42ad51415b5c [0,2,0,0,0,0|1,1,0]=4 382 B11R1.222 CN(CF)c1ccccc1F 664f2d950c125d3a1fa31610e43e1d60 [0,2,0,0,0,0|2,0,0]=4 383 B11R1.222 CN(CO)c1ccccc1Cl 93c8a0a05d68ffe0b62289d5206a4d45 [0,2,0,0,0,0|1,1,0]=4 384 B11R1.222 CN(CO)c1ccccc1F 37525b3659f76f6cb84994c550b2f6ca [0,2,0,0,0,0|1,1,0]=4 385 B11R1.222 Cc1ccccc1N(C)C=O 0cbd91f766c6614fd036ecf6c5c52ea2 [0,2,0,0,0,0|1,1,0]=4 386 B11R1.222 Cc1ccccc1N(C)CF 151ec0fcc79157784dd7bc5d5aa488f4 [0,2,0,0,0,0|2,0,0]=4 387 B11R1.222 Cc1ccccc1N(C)CO 360a66e6984b8285375a37f5a2a3ef94 [0,2,0,0,0,0|1,1,0]=4 388 B11R2.238 c1cc(ccn1)NC2CC2 5ad70d53c8f8554348b48da331d79b17 [0,0,0,1,0,1|2,0,0]=4 389 B11R2.238 c1ccc(cc1)NC2CC2 0cca6617983212a2989086e88698db73 [0,0,0,1,0,1|1,0,0]=3 390 B11R2.238 c1ccc(nc1)OC2CC2 05f70841461656fba19d4e6cae35b4c4 [0,0,0,1,0,1|2,0,0]=4 391 B11R2.238 c1cncc(c1)NC2CC2 faca6d2d50c0b4a3e50cda13d58850cf [0,0,0,1,0,1|2,0,0]=4 392 B11R2.238 c1cncc(c1)OC2CC2 e02f03b072be3d2fd90f9a4a8c487a8f [0,0,0,1,0,1|2,0,0]=4 393 B11R1.91 C=C(C)CNc1ccccc1 9ff030153dc2dcaf07d1da3f9e6a073f [0,0,0,0,0,2|1,0,1]=4 394 B11R1.91 CC(=O)CNc1ccccc1 71a2fb3da6b0e889c13cfd81e73bd182 [0,0,0,0,0,2|0,1,1]=4 395 B11R1.91 CC(=O)NCc1ccccc1 29a87354e4243d3817f046f8152f971d [0,0,0,0,0,2|0,1,1]=4 396 B11R1.91 CC(C)CNc1ccccc1 408d8a64ab70f9eca096d81d546b6049 [0,0,0,0,0,2|1,0,0]=3 397 B11R1.91 CC(C)CNc1ccccn1 7b009ca04377ecc13f70ec3cf4ebfeda [0,0,0,0,0,2|2,0,0]=4 398 B11R1.91 CC(C)CNc1cccnc1 872c17275baf8dfc3e3fcfc1c6e8b0aa [0,0,0,0,0,2|2,0,0]=4 399 B11R1.91 CC(C)CNc1ccncc1 25b00c7dc1cdd402497940b3c77292de [0,0,0,0,0,2|2,0,0]=4 400 B11R1.91 CC(C)COc1ccccn1 7b0823f232ca75667ab72b773cf2055c [0,0,0,0,0,2|2,0,0]=4 401 B11R1.91 CC(C)COc1cccnc1 639764ab0bac28311f80a0c1092bb51e [0,0,0,0,0,2|2,0,0]=4 402 B11R1.91 CC(C)COc1ccncc1 f219312091f37b23472c98e305cf03a6 [0,0,0,0,0,2|2,0,0]=4 403 B11R1.91 CC(C)NCc1ccccc1 60272e3c9303882f29d21331dcab1491 [0,0,0,0,0,2|1,0,0]=3 404 B11R1.91 CC(C)NCc1ccccn1 856545f5d02de0038284fed0716bf52b [0,0,0,0,0,2|2,0,0]=4 405 B11R1.91 CC(C)NCc1cccnc1 f83c1668bc1a0795e6062eecd9dab4fd [0,0,0,0,0,2|2,0,0]=4 406 B11R1.91 CC(C)NCc1ccncc1 6f1dfa66543bb67ac78a3a333bf46a66 [0,0,0,0,0,2|2,0,0]=4 407 B11R1.91 CC(C)OCc1ccccc1 7aa508df1117d05227b589ad5630d192 [0,0,0,0,0,2|1,0,0]=3 408 B11R1.91 CC(C)OCc1ccccn1 0763eb944dcd10bf40a6049a3281f0fa [0,0,0,0,0,2|2,0,0]=4 409 B11R1.91 CC(C)OCc1cccnc1 15bee2bbdfea4851383d51503cc56958 [0,0,0,0,0,2|2,0,0]=4 410 B11R1.91 CC(C)OCc1ccncc1 6b799cfffcfa8445d7523666b8d1a250 [0,0,0,0,0,2|2,0,0]=4 411 B11R1.91 CC(O)CNc1ccccc1 bad1b8ce4c3d0d43f36328d30e7f1e89 [0,0,0,0,0,2|0,1,0]=3 412 B11R1.91 CC(O)CNc1ccccn1 0b02a9fc805d3fdc80aa58b252d76fac [0,0,0,0,0,2|1,1,0]=4 413 B11R1.91 CC(O)CNc1cccnc1 be948b4ea22210c06fa11f5ff0c44d9b [0,0,0,0,0,2|1,1,0]=4 414 B11R1.91 CC(O)CNc1ccncc1 58a36af31ee3d9178a47f4e2f681d20e [0,0,0,0,0,2|1,1,0]=4 415 B11R1.91 CN(C)CNc1ccccc1 6ea2b21a530eb73fceed274bf1825a42 [0,0,0,0,0,2|2,0,0]=4 416 B11R1.91 C[C@@H](O)CNc1ccccc1 3364bd989574177eabc4c47575206f02 [0,0,0,0,0,2|0,1,0]=3 417 B11R1.91 C[C@@H](O)CNc1ccccn1 2f50c5c35f8b03d00f3a417683f2e1c8 [0,0,0,0,0,2|1,1,0]=4 418 B11R1.91 C[C@@H](O)CNc1cccnc1 0269da8e8da5f2bc75323d1a7b31953c [0,0,0,0,0,2|1,1,0]=4 419 B11R1.91 C[C@@H](O)CNc1ccncc1 a759ad58b644a21887782ccec01db51a [0,0,0,0,0,2|1,1,0]=4 420 B11R1.91 C[C@H](O)CNc1ccccc1 72a253baaf381f6699a10e01b0f0ab34 [0,0,0,0,0,2|0,1,0]=3 421 B11R1.91 C[C@H](O)CNc1ccccn1 b5e1e178b39afd2578578a870577034a [0,0,0,0,0,2|1,1,0]=4 422 B11R1.91 C[C@H](O)CNc1cccnc1 13f963f21a32ff7cb405ad7d76f40567 [0,0,0,0,0,2|1,1,0]=4 423 B11R1.91 C[C@H](O)CNc1ccncc1 40e1cfcf68d3fb31f8ea23f4fe31cf2f [0,0,0,0,0,2|1,1,0]=4 424 B11R1.91 FC(F)CNc1ccccc1 84c83ea792636e350c2a00840c340dda [0,0,0,0,0,2|2,0,0]=4