0 B12R2.1 CCN1CCc2c1cccn2 c6dc67a825bc35ffc313764f68fe419e [0,1,0,0,0,0|2,0,0]=3 1 B12R2.1 CCN1CCc2c1nccc2 12def77c50510f33b92190b9b59aae18 [0,1,0,0,0,0|2,0,0]=3 2 B12R2.1 CCN1CCc2c1nccn2 3a03a9b80da9220833252a85218386b2 [0,1,0,0,0,0|1,0,0]=2 3 B12R2.1 CCN1CCc2c1ncnc2 a2f164d5e48c81735c1bef35538e54fa [0,1,0,0,0,0|3,0,0]=4 4 B12R2.1 FCN1CCc2c1cccn2 4377bfe78ba7f41c2b687c6b1c905846 [0,1,0,0,0,0|2,0,0]=3 5 B12R2.1 FCN1CCc2c1nccc2 9141164ad6d29af56584f279428a9be4 [0,1,0,0,0,0|2,0,0]=3 6 B12R2.1 FCN1CCc2c1nccn2 532a8beac2385f30a7dcaf6c6a577405 [0,1,0,0,0,0|1,0,0]=2 7 B12R2.1 FCN1CCc2c1ncnc2 fe58f08969c613f6d8f955d0fc36a4a8 [0,1,0,0,0,0|3,0,0]=4 8 B12R2.1 O=CN1CCc2c1cccn2 d2dcd13cafbd9713f3325443b770875f [0,1,0,0,0,0|2,0,1]=4 9 B12R2.1 O=CN1CCc2c1nccc2 6d4df3c1b7ebbfc1a8390e263c834cd5 [0,1,0,0,0,0|2,0,1]=4 10 B12R2.1 O=CN1CCc2c1nccn2 3dde5bbab042a2c47d35ce7f8f31979e [0,1,0,0,0,0|1,0,1]=3 11 B12R2.1 OCN1CCc2c1cccc2 b6afa4fa6bad5e1cd18ef7eeaa43164b [0,1,0,0,0,0|3,0,0]=4 12 B12R2.1 OCN1CCc2c1cccn2 6bc3bb677f88da8fd8301f0c9a392f1b [0,1,0,0,0,0|2,0,0]=3 13 B12R2.1 OCN1CCc2c1nccc2 a47c7d48541048f1d1671782051639e3 [0,1,0,0,0,0|2,0,0]=3 14 B12R2.1 OCN1CCc2c1nccn2 f033df3ade04e8da35a0353fed6500eb [0,1,0,0,0,0|1,0,0]=2 15 B12R2.1 OCN1CCc2c1ncnc2 5fdf869239b44fed0639cd827007a478 [0,1,0,0,0,0|3,0,0]=4 16 B10R1.15 CCN(C)c1ccccc1 9cc6568b1f30abe04427bdea858da30e [0,0,1,0,0,0|3,0,0]=4 17 B10R1.15 CCN(C)c1cccnc1 04b21f569d4c75e23135eca19e8dfd7f [0,0,1,0,0,0|2,0,0]=3 18 B10R1.15 CCN(C)c1ccncn1 d3188d994a55f552daffb246c4de2ff9 [0,0,1,0,0,0|3,0,0]=4 19 B10R1.15 CCN(C)c1ccnnc1 1ac91ab60a635fb5329291a771fa3c6f [0,0,1,0,0,0|3,0,0]=4 20 B10R1.15 CCN(C)c1cnccn1 a8ffa0df115721fdc6dd2269b8097d32 [0,0,1,0,0,0|1,0,0]=2 21 B10R1.15 CCN(C)c1ncccn1 2190b05b172124b2ca945163c4e222f5 [0,0,1,0,0,0|3,0,0]=4 22 B10R1.15 CCN(C)c1nccnn1 1e7db70c44a1fbbd9523378dfbbdb889 [0,0,1,0,0,0|2,0,0]=3 23 B10R1.15 CN(CF)c1ccccn1 1bdd19ff0d205b3af825ce3149dae35a [0,0,1,0,0,0|3,0,0]=4 24 B10R1.15 CN(CF)c1cccnc1 242d56eee61bf5da227aba2cc8ffb8a2 [0,0,1,0,0,0|3,0,0]=4 25 B10R1.15 CN(CF)c1cnccn1 a9fa5c6bd903856b36188b1f0c8b1c0b [0,0,1,0,0,0|2,0,0]=3 26 B10R1.15 CN(CF)c1nccnn1 f4a791a4ef58a436a884994b50b441f6 [0,0,1,0,0,0|3,0,0]=4 27 B10R1.15 CN(CO)c1ccccn1 a93cc933fdb4d1c91563e07701d40cda [0,0,1,0,0,0|3,0,0]=4 28 B10R1.15 CN(CO)c1cccnc1 021ae75de63d9271d48b9d5b4bd35a1c [0,0,1,0,0,0|3,0,0]=4 29 B10R1.15 CN(CO)c1cnccn1 789c6aa6696e30e272870a4861e371ee [0,0,1,0,0,0|2,0,0]=3 30 B10R1.15 CN(CO)c1nccnn1 0728cf3a3b28771d5a527d99cb863b03 [0,0,1,0,0,0|3,0,0]=4 31 B10R1.17 BrCCNc1ccccn1 3e3884def368abe14a8394ce1a1093e4 [0,0,1,0,0,0|3,0,0]=4 32 B10R1.17 BrCCNc1cccnc1 2d13be8c88ebb7269676c6abc03a383d [0,0,1,0,0,0|3,0,0]=4 33 B10R1.17 C#CCNc1cnccn1 dc6987489b39578bddc05e0be3eb230e [0,0,1,0,0,0|1,0,2]=4 34 B10R1.17 C#CCOc1cnccn1 fb6c30ea0c5dd2abdf997e51d9e306e4 [0,0,1,0,0,0|1,0,2]=4 35 B10R1.17 C=CCNc1cnccn1 7e2fedbeb6954ebe9f1fbde2a577d90a [0,0,1,0,0,0|1,0,2]=4 36 B10R1.17 C=CCOc1cnccn1 4666c6b00a4f4348694de26ab0f9e595 [0,0,1,0,0,0|1,0,2]=4 37 B10R1.17 CCCNc1ccccc1 b539dcf8361adb43cc5ffbb8617222f9 [0,0,1,0,0,0|3,0,0]=4 38 B10R1.17 CCCNc1ccccn1 d0e3424364e1c8a55b80e6e83d3696ba [0,0,1,0,0,0|2,0,0]=3 39 B10R1.17 CCCNc1cccnc1 54f0ece250e78709faf1eb2fd4dc869b [0,0,1,0,0,0|2,0,0]=3 40 B10R1.17 CCCNc1cccnn1 563334c6dadea743653cde03719d759b [0,0,1,0,0,0|3,0,0]=4 41 B10R1.17 CCCNc1ccncn1 b9fcfeaf51b4e3f06d605d771d307526 [0,0,1,0,0,0|3,0,0]=4 42 B10R1.17 CCCNc1ccnnc1 2caee9d9c90b98666cbfecfa06fa8cff [0,0,1,0,0,0|3,0,0]=4 43 B10R1.17 CCCNc1cnccn1 21846cbecedbe2640cf1187c9cb12883 [0,0,1,0,0,0|1,0,0]=2 44 B10R1.17 CCCNc1cncnc1 2bb7fb2ced184242938c7fda4c6e1a37 [0,0,1,0,0,0|3,0,0]=4 45 B10R1.17 CCCNc1cnncn1 ae485abbfb53ff29b4abc600381cf9a2 [0,0,1,0,0,0|2,0,0]=3 46 B10R1.17 CCCNc1ncccn1 75419027ddb25105c51dd1506820ccba [0,0,1,0,0,0|3,0,0]=4 47 B10R1.17 CCCNc1nccnn1 ba977de7796519a7c9234ce6324979fd [0,0,1,0,0,0|2,0,0]=3 48 B10R1.17 CCCOc1ccccn1 6e04423b9fd777130a88eaa9fd38fe0c [0,0,1,0,0,0|2,0,0]=3 49 B10R1.17 CCCOc1cccnc1 a97f517fc793a805aaab3ac7468bbd26 [0,0,1,0,0,0|2,0,0]=3 50 B10R1.17 CCCOc1ccnnc1 3c9c3d60b434f5a1bdb1673f40955496 [0,0,1,0,0,0|3,0,0]=4 51 B10R1.17 CCCOc1cnccn1 63621ef82dd8a608febe84451551c55a [0,0,1,0,0,0|1,0,0]=2 52 B10R1.17 CCCOc1cncnc1 3e9abc9b1ba148ce4f151dd0bc3facae [0,0,1,0,0,0|3,0,0]=4 53 B10R1.17 CCCOc1cncnn1 bc5670d65c0c36d3b12443fc4957fbb6 [0,0,1,0,0,0|2,0,0]=3 54 B10R1.17 CCCOc1ncccn1 5c5a6b9b9ac104a48d6c4b0d32992f0c [0,0,1,0,0,0|3,0,0]=4 55 B10R1.17 CCNCc1ccccc1 b1285c6596ffdf0473a3780bf23df272 [0,0,1,0,0,0|3,0,0]=4 56 B10R1.17 CCNCc1ccccn1 18cfef8413e038075fdfe85720c8bb60 [0,0,1,0,0,0|2,0,0]=3 57 B10R1.17 CCNCc1cccnc1 ef83bfb13d2744bc293d6f1d68f67b86 [0,0,1,0,0,0|2,0,0]=3 58 B10R1.17 CCNCc1cccnn1 d81bd9bf1bc516576c473bbc4cf064a6 [0,0,1,0,0,0|3,0,0]=4 59 B10R1.17 CCNCc1ccncn1 ae6a093ba5aef71c0ed8d67651e0dd26 [0,0,1,0,0,0|3,0,0]=4 60 B10R1.17 CCNCc1ccnnc1 dc0861acfe2535501016a881a15b8655 [0,0,1,0,0,0|3,0,0]=4 61 B10R1.17 CCNCc1cnccn1 e42a4917d2a6a9dffed5bdafd4c5a5d6 [0,0,1,0,0,0|1,0,0]=2 62 B10R1.17 CCNCc1cncnc1 f9703e58bb488c49affd31e2d844b19f [0,0,1,0,0,0|3,0,0]=4 63 B10R1.17 CCNCc1ncccn1 7e64da8f6dedc74d9803d8b0ac5afe0e [0,0,1,0,0,0|3,0,0]=4 64 B10R1.17 CCOCc1ccccc1 551a24ad73c54bc42b4e27015fdb411f [0,0,1,0,0,0|3,0,0]=4 65 B10R1.17 CCOCc1ccccn1 0c63694580ac3136b3801886d248907b [0,0,1,0,0,0|2,0,0]=3 66 B10R1.17 CCOCc1cccnc1 5f09f824e7a9d5177841898d80553992 [0,0,1,0,0,0|2,0,0]=3 67 B10R1.17 CCOCc1cccnn1 a18ecdaafc84bd92138525fb2f4ad399 [0,0,1,0,0,0|3,0,0]=4 68 B10R1.17 CCOCc1ccncn1 d55d0b80fa8d405bad8866668c0f9fa7 [0,0,1,0,0,0|3,0,0]=4 69 B10R1.17 CCOCc1ccnnc1 eb3f0189714571d275860574016314ed [0,0,1,0,0,0|3,0,0]=4 70 B10R1.17 CCOCc1cnccn1 7fb271123056acc990d03d3767398eec [0,0,1,0,0,0|1,0,0]=2 71 B10R1.17 CCOCc1cncnc1 c69748ab8bdd1b31da65e1fc4248cd6d [0,0,1,0,0,0|3,0,0]=4 72 B10R1.17 CCOCc1ncccn1 ba95357c7224be2db8f523f6aa6f9bb0 [0,0,1,0,0,0|3,0,0]=4 73 B10R1.17 COCNc1ccccn1 a7abef3468bc69aa80ea510854a664da [0,0,1,0,0,0|3,0,0]=4 74 B10R1.17 COCNc1cccnc1 06eb298a8599044156c09f99ea626504 [0,0,1,0,0,0|3,0,0]=4 75 B10R1.17 COCNc1cnccn1 e1b86a322d65d71968ad3b0b53c14350 [0,0,1,0,0,0|2,0,0]=3 76 B10R1.17 COCNc1cnncn1 3a26bcd1f3e8d8efbe9997a4eb33c66f [0,0,1,0,0,0|3,0,0]=4 77 B10R1.17 COCNc1nccnn1 440d61370a2427eaa09d1568352aa4db [0,0,1,0,0,0|3,0,0]=4 78 B10R1.17 COCOc1ccccn1 20cd252a71a5a01c3e93af63053a4326 [0,0,1,0,0,0|3,0,0]=4 79 B10R1.17 COCOc1cccnc1 d9b37fb8d6b9f459b8606485db596791 [0,0,1,0,0,0|3,0,0]=4 80 B10R1.17 COCOc1cnccn1 91692ef16c539c2f51ce9f654d4e167a [0,0,1,0,0,0|2,0,0]=3 81 B10R1.17 COCOc1cncnn1 01c19f731c4638ba64dd0f8b9a46b308 [0,0,1,0,0,0|3,0,0]=4 82 B10R1.17 CSCNc1ccccn1 cc0ec9b3c5cc0b5eddbb2cfb429d6e35 [0,0,1,0,0,0|3,0,0]=4 83 B10R1.17 CSCNc1cccnc1 e9d3d08db46089fcfbd01833b3252a03 [0,0,1,0,0,0|3,0,0]=4 84 B10R1.17 CSCNc1cnccn1 930f16f0ffaab42f985807a52dc0c6d1 [0,0,1,0,0,0|2,0,0]=3 85 B10R1.17 CSCNc1cnncn1 9d0890c38f677514b38cfec005ae6919 [0,0,1,0,0,0|3,0,0]=4 86 B10R1.17 CSCNc1nccnn1 e89b9be9cd834590d799d8882073472c [0,0,1,0,0,0|3,0,0]=4 87 B10R1.17 CSCOc1ccccn1 af78560ad465f4d707ca132fa83d0e3a [0,0,1,0,0,0|3,0,0]=4 88 B10R1.17 CSCOc1cccnc1 ba5df6f707d429b8683f03b4c7f7b4a6 [0,0,1,0,0,0|3,0,0]=4 89 B10R1.17 CSCOc1cnccn1 52ffcd2be78a9b2f46dfb44270cb610f [0,0,1,0,0,0|2,0,0]=3 90 B10R1.17 CSCOc1cncnn1 023ff167526b97e19119f4d2300546cf [0,0,1,0,0,0|3,0,0]=4 91 B10R1.17 FCCNc1ccccn1 6ab197fb6cbd8dea7ad6d85c80356b58 [0,0,1,0,0,0|3,0,0]=4 92 B10R1.17 FCCNc1cccnc1 948881de1f8cebdb00d3305a89cccf21 [0,0,1,0,0,0|3,0,0]=4 93 B10R1.17 FCCNc1cnccn1 dd60db3af5d33017b5272adbacfa821e [0,0,1,0,0,0|2,0,0]=3 94 B10R1.17 FCCNc1cnncn1 eb6b90db0f91e54f78ef3b5c4ad4590d [0,0,1,0,0,0|3,0,0]=4 95 B10R1.17 FCCNc1nccnn1 0fe76bbfafb9e638ade1151ba1f0ae07 [0,0,1,0,0,0|3,0,0]=4 96 B10R1.17 FCCOc1ccccn1 06b65dfb48082d4779fc37c34dadb476 [0,0,1,0,0,0|3,0,0]=4 97 B10R1.17 FCCOc1cccnc1 7a88b89adbe5c70a007fa3204bf675ab [0,0,1,0,0,0|3,0,0]=4 98 B10R1.17 FCCOc1cnccn1 a0c148fc7e01278295d3fef98ce5f3d8 [0,0,1,0,0,0|2,0,0]=3 99 B10R1.17 FCNCc1ccccn1 14327276004818c05fc55a3ce987673c [0,0,1,0,0,0|3,0,0]=4 100 B10R1.17 FCNCc1cccnc1 303a68c3e72902076a5285aac654492a [0,0,1,0,0,0|3,0,0]=4 101 B10R1.17 FCNCc1cnccn1 b6859870939f07ca1816c457c1ced744 [0,0,1,0,0,0|2,0,0]=3 102 B10R1.17 FCOCc1ccccn1 52de5aacdb8cde16edb0cbea31183c40 [0,0,1,0,0,0|3,0,0]=4 103 B10R1.17 FCOCc1cccnc1 d58467b55ec7fcb175961d4ef6210edb [0,0,1,0,0,0|3,0,0]=4 104 B10R1.17 FCOCc1cnccn1 a11466f76fde0f26dadf75b6a45d47be [0,0,1,0,0,0|2,0,0]=3 105 B10R1.17 ICCNc1cccnc1 bd2873fb4e8705ac6b2391510b61aca0 [0,0,1,0,0,0|3,0,0]=4 106 B10R1.17 N#CCNc1cnccn1 a7df16fc21523e52db6e770eb1e6c776 [0,0,1,0,0,0|2,0,1]=4 107 B10R1.17 N#CCOc1cnccn1 a21a29f5a501afc140e902842d4639b8 [0,0,1,0,0,0|2,0,1]=4 108 B10R1.17 O=CCNc1cnccn1 1f2d05c8c2da92e2355104fcbbea848e [0,0,1,0,0,0|2,0,1]=4 109 B10R1.17 O=CCOc1cnccn1 ecda20f1b67333503933c739d5d7b88b [0,0,1,0,0,0|2,0,1]=4 110 B10R1.17 O=CNCc1cnccn1 2bd46c5e573c56891fa964a095c4e2d7 [0,0,1,0,0,0|2,0,1]=4 111 B10R1.17 OCCNc1ccccn1 14d1f9671b0391e7cf5b318b74673aa8 [0,0,1,0,0,0|3,0,0]=4 112 B10R1.17 OCCNc1cccnc1 528072d5adbbf320415662e70c05db36 [0,0,1,0,0,0|3,0,0]=4 113 B10R1.17 OCCNc1cnccn1 b8c8b329bec75a99372dd1b5fe38a887 [0,0,1,0,0,0|2,0,0]=3 114 B10R1.17 OCCNc1cnncn1 e69210d24020efd9e5307d7dab7980f8 [0,0,1,0,0,0|3,0,0]=4 115 B10R1.17 OCCNc1nccnn1 2fb8cb2b43266f1bf89cf977698b3d69 [0,0,1,0,0,0|3,0,0]=4 116 B10R1.17 OCNCc1ccccn1 9488b9a65408dc593594baac432012ff [0,0,1,0,0,0|3,0,0]=4 117 B10R1.17 OCNCc1cccnc1 86bd6343ace558a3752eaa3d1a554844 [0,0,1,0,0,0|3,0,0]=4 118 B10R1.17 OCNCc1cnccn1 2e97e3c7cc39869beec41193ed233122 [0,0,1,0,0,0|2,0,0]=3 119 B10R1.17 SCCNc1ccccn1 de2447df01f4514b4267a28db291424f [0,0,1,0,0,0|3,0,0]=4 120 B10R1.17 SCCNc1cccnc1 d7661b93dffeb3e5de5eb3930ee71345 [0,0,1,0,0,0|3,0,0]=4 121 B10R1.17 SCCNc1cnccn1 7a532bee0aa009efe26ced5e1fd07b4c [0,0,1,0,0,0|2,0,0]=3 122 B10R1.17 SCCNc1cnncn1 7ab506686917a98881392482b4c1513c [0,0,1,0,0,0|3,0,0]=4 123 B10R1.17 SCCNc1nccnn1 8f1c7e110d4b6ee1cc5f08282bc1f039 [0,0,1,0,0,0|3,0,0]=4 124 B10R1.17 SCCOc1ccccn1 80884e7103538d273738856f1f9d4222 [0,0,1,0,0,0|3,0,0]=4 125 B10R1.17 SCCOc1cccnc1 84b759d60311f3e5695c1f1ffc5005e0 [0,0,1,0,0,0|3,0,0]=4 126 B10R1.17 SCCOc1cnccn1 9ed631421fd79ea9b405fc40aac58272 [0,0,1,0,0,0|2,0,0]=3 127 B10R1.17 SCCOc1cncnn1 740654b2e6958307ec3bf8f8805b8756 [0,0,1,0,0,0|3,0,0]=4 128 B9R1.8 CCNc1ccccn1 2525c23bd886b96c78c0be1e9ad1905b [1,0,1,0,0,0|2,0,0]=4 129 B9R1.8 CCNc1cccnc1 e16c06cad87ecb5a3a4a58b6d8537631 [1,0,1,0,0,0|2,0,0]=4 130 B9R1.8 CCNc1cnccn1 692286fa82997f2fb685e4d3ad5b2443 [1,0,1,0,0,0|1,0,0]=3 131 B9R1.8 CCNc1cnncn1 f82c088077ae7696bce842278215e142 [1,0,1,0,0,0|2,0,0]=4 132 B9R1.8 CCNc1nccnn1 de6c00a96ec865d94fb0210d389d00df [1,0,1,0,0,0|2,0,0]=4 133 B9R1.8 CCOc1ccccn1 8b10ed115fcb5b65f209d3b07c05b728 [1,0,1,0,0,0|2,0,0]=4 134 B9R1.8 CCOc1cccnc1 efa582b018c37c3ab155936515b551ea [1,0,1,0,0,0|2,0,0]=4 135 B9R1.8 CCOc1cnccn1 aa9d1d61b4f8dce5da42fe3ddcc6df85 [1,0,1,0,0,0|1,0,0]=3 136 B9R1.8 CCOc1cncnn1 c9814c00ede749a4f13c3c62d7c87882 [1,0,1,0,0,0|2,0,0]=4 137 B9R1.8 FCNc1cnccn1 3cbe94cf9594c68ec8b94825e8905ed8 [1,0,1,0,0,0|2,0,0]=4 138 B9R1.8 FCOc1cnccn1 e656ed16372ac6d21dfc0a12172339fc [1,0,1,0,0,0|2,0,0]=4 139 B9R1.8 OCNc1cnccn1 a22ea0b3c17d02d754f571b9860bc923 [1,0,1,0,0,0|2,0,0]=4 140 B11R1.12 CCN(C=O)c1cnccn1 2106275e2d269f3c272150672947c57e [0,1,1,0,0,0|1,0,1]=4 141 B11R1.12 CCN(CC)c1cccnc1 52601769ca231e644678fff005cbe4b5 [0,1,1,0,0,0|2,0,0]=4 142 B11R1.12 CCN(CC)c1cnccn1 534f5614ab93b4a72aa583f5a89a8e6d [0,1,1,0,0,0|1,0,0]=3 143 B11R1.12 CCN(CC)c1nccnn1 a6be7bb815ec22cca922abef1bd36c7f [0,1,1,0,0,0|2,0,0]=4 144 B11R1.12 CCN(CF)c1cccnc1 0312fe3f0e237cbe2838982475b5dabc [0,1,1,0,0,0|2,0,0]=4 145 B11R1.12 CCN(CF)c1nccnn1 c6c496c4ae1f5d8ca05b8578200dd765 [0,1,1,0,0,0|2,0,0]=4 146 B11R1.12 CCN(CO)c1cccnc1 f2903e21d817aefbbc8f3b43452e9503 [0,1,1,0,0,0|2,0,0]=4 147 B11R1.12 CCN(CO)c1cnccn1 94eb593a52e2be02f0653b4bfe0a37dd [0,1,1,0,0,0|1,0,0]=3 148 B11R1.12 CCN(CO)c1nccnn1 2a333c555a3380dcf8b27d027aa3f2c1 [0,1,1,0,0,0|2,0,0]=4 149 B11R1.16 C#CCN(C)c1cnccn1 a4cffc80422290291397fb62c9c33827 [0,1,1,0,0,0|1,0,1]=4 150 B11R1.16 C=CCN(C)c1cnccn1 cc787492a46ddbcf60b305b71c24191e [0,1,1,0,0,0|1,0,1]=4 151 B11R1.16 CC(NC=O)c1cnccn1 b12aa70178da0d6f388963a11219364c [0,1,1,0,0,0|1,0,1]=4 152 B11R1.16 CC(NCF)c1ccccn1 0905269fa9a0af5b89b0863135e0ba86 [0,1,1,0,0,0|2,0,0]=4 153 B11R1.16 CC(NCF)c1cccnc1 06f634f0617dadb8cf037734a8a97de2 [0,1,1,0,0,0|2,0,0]=4 154 B11R1.16 CC(NCF)c1cnccn1 98fa7db5c4884fbbbdf1607e1137c7e9 [0,1,1,0,0,0|1,0,0]=3 155 B11R1.16 CC(NCO)c1ccccn1 92e2d7a3e5eb4a0cf656a3abd8120ca1 [0,1,1,0,0,0|2,0,0]=4 156 B11R1.16 CC(NCO)c1cccnc1 862c30acc11398ef9d9eed839c208db8 [0,1,1,0,0,0|2,0,0]=4 157 B11R1.16 CC(NCO)c1cnccn1 dd375ba3f51181f3178a09958c46ca97 [0,1,1,0,0,0|1,0,0]=3 158 B11R1.16 CC(OCF)c1ccccn1 2375003933f3ce846737f38420e767b3 [0,1,1,0,0,0|2,0,0]=4 159 B11R1.16 CC(OCF)c1cccnc1 38385d8a804ea3beb03ef81ac1897631 [0,1,1,0,0,0|2,0,0]=4 160 B11R1.16 CC(OCF)c1cnccn1 edaa78b62734f3603bd18d85f98d58c9 [0,1,1,0,0,0|1,0,0]=3 161 B11R1.16 CCCN(C)c1ccccn1 8ff1db8620efe8553f2af13d547cf9e1 [0,1,1,0,0,0|2,0,0]=4 162 B11R1.16 CCCN(C)c1cccnc1 28cb54c9c808eaf7ba52852976110e8a [0,1,1,0,0,0|2,0,0]=4 163 B11R1.16 CCCN(C)c1cnccn1 7515a4a7db1f95bb8312ff50e22bcdd1 [0,1,1,0,0,0|1,0,0]=3 164 B11R1.16 CCCN(C)c1nccnn1 552b16f9e53ac8a67f4ebec7fdd12090 [0,1,1,0,0,0|2,0,0]=4 165 B11R1.16 CCNC(C)c1ccccc1 af03e39d181c5fd668bda5d6f7d06e14 [0,1,1,0,0,0|2,0,0]=4 166 B11R1.16 CCNC(C)c1ccccn1 1349d82fdb3aca31d54d33a892f4429f [0,1,1,0,0,0|1,0,0]=3 167 B11R1.16 CCNC(C)c1cccnc1 c47433cc5cae1ddbdb53f6ca3e6bfaaf [0,1,1,0,0,0|1,0,0]=3 168 B11R1.16 CCNC(C)c1cccnn1 efc02f97da2becc35b8d266864811e35 [0,1,1,0,0,0|2,0,0]=4 169 B11R1.16 CCNC(C)c1ccncn1 22930201dd5caefefa3309491753d9e9 [0,1,1,0,0,0|2,0,0]=4 170 B11R1.16 CCNC(C)c1ccnnc1 0713f69abf6a393210781cec459513ed [0,1,1,0,0,0|2,0,0]=4 171 B11R1.16 CCNC(C)c1cnccn1 3027041055109ccfc9487eb2dd1789f2 [0,1,1,0,0,0|0,0,0]=2 172 B11R1.16 CCNC(C)c1cncnc1 ab3fa3d22d74a84898be02b87f8fd66a [0,1,1,0,0,0|2,0,0]=4 173 B11R1.16 CCNC(C)c1ncccn1 112a21bda09e683bb3edc0c3fc56d505 [0,1,1,0,0,0|2,0,0]=4 174 B11R1.16 CCN[C@@H](C)c1ccccc1 994b5b0b50363ecab1efd5b7f9e6d7cd [0,1,1,0,0,0|2,0,0]=4 175 B11R1.16 CCN[C@@H](C)c1ccccn1 6becaa5dd299afbde8d9e40b8df2b64b [0,1,1,0,0,0|1,0,0]=3 176 B11R1.16 CCN[C@@H](C)c1cccnc1 330151f91eef2953e097f24cd8fe5255 [0,1,1,0,0,0|1,0,0]=3 177 B11R1.16 CCN[C@@H](C)c1cncnc1 a5c49eac43efe2289be51d06c11c7575 [0,1,1,0,0,0|2,0,0]=4 178 B11R1.16 CCN[C@H](C)c1ccccc1 af432512ad94856da6ef9d44592c3502 [0,1,1,0,0,0|2,0,0]=4 179 B11R1.16 CCN[C@H](C)c1ccccn1 de5b9d337b6c15bb985fd6d76426b016 [0,1,1,0,0,0|1,0,0]=3 180 B11R1.16 CCN[C@H](C)c1cccnc1 7cb1b35ff9549b4a705f07ae86659632 [0,1,1,0,0,0|1,0,0]=3 181 B11R1.16 CCN[C@H](C)c1cncnc1 186d78fcf30dda4d736d86a57c2d1693 [0,1,1,0,0,0|2,0,0]=4 182 B11R1.16 CCOC(C)c1ccccc1 37108e833ff536d25c550cb5b37c873d [0,1,1,0,0,0|2,0,0]=4 183 B11R1.16 CCOC(C)c1ccccn1 2349fef21e807c42cd2b612eadfb89fd [0,1,1,0,0,0|1,0,0]=3 184 B11R1.16 CCOC(C)c1cccnc1 9c9e8ee26a948f6734fe8bca4ac259d1 [0,1,1,0,0,0|1,0,0]=3 185 B11R1.16 CCOC(C)c1cccnn1 b45ba464b06ee6bdc1c736a50ffd8553 [0,1,1,0,0,0|2,0,0]=4 186 B11R1.16 CCOC(C)c1cnccn1 c43729a6fd74b4ab221ba3a8754f47ca [0,1,1,0,0,0|0,0,0]=2 187 B11R1.16 CCOC(C)c1ncccn1 1fedda22cfecf8948662f3eef3f690f9 [0,1,1,0,0,0|2,0,0]=4 188 B11R1.16 CCO[C@@H](C)c1ccccc1 e4f11a13dd3f609e6f25ac3a3b969fe2 [0,1,1,0,0,0|2,0,0]=4 189 B11R1.16 CCO[C@@H](C)c1ccccn1 d31d85c16530817c2b81fb1a03fe7e57 [0,1,1,0,0,0|1,0,0]=3 190 B11R1.16 CCO[C@@H](C)c1cccnc1 4f79e80bc80f924c1d9263e4c7a80e48 [0,1,1,0,0,0|1,0,0]=3 191 B11R1.16 CCO[C@@H](C)c1ccncn1 ecda7948a20662ef60b97d1988299e8d [0,1,1,0,0,0|2,0,0]=4 192 B11R1.16 CCO[C@@H](C)c1cnccn1 8a6e3a914bc27167363a585a0aa27251 [0,1,1,0,0,0|0,0,0]=2 193 B11R1.16 CCO[C@@H](C)c1ncccn1 4240750fe2b64fee8772620e302ddfbe [0,1,1,0,0,0|2,0,0]=4 194 B11R1.16 CCO[C@H](C)c1ccccc1 54694971b3853f962e687b61e7c698c1 [0,1,1,0,0,0|2,0,0]=4 195 B11R1.16 CCO[C@H](C)c1ccccn1 c768b24f1cd72ff8137851b753ae2d04 [0,1,1,0,0,0|1,0,0]=3 196 B11R1.16 CCO[C@H](C)c1cccnc1 cd637b20fb4bf525c6de41c7953f4069 [0,1,1,0,0,0|1,0,0]=3 197 B11R1.16 CCO[C@H](C)c1cccnn1 5e113335bfa1da5c764374cee09167f3 [0,1,1,0,0,0|2,0,0]=4 198 B11R1.16 CCO[C@H](C)c1cnccn1 5d3b5896b879729f1ffbe4449af13432 [0,1,1,0,0,0|0,0,0]=2 199 B11R1.16 CCO[C@H](C)c1ncccn1 f16129f9fc3238ad0c96779a2995a1df [0,1,1,0,0,0|2,0,0]=4 200 B11R1.16 CN(CC#N)c1cnccn1 2750c9dd243c5e4c9ca0dba46b480f8b [0,1,1,0,0,0|1,0,1]=4 201 B11R1.16 CN(CC=O)c1cnccn1 7c6a09d326b306da2afe6afe92255679 [0,1,1,0,0,0|1,0,1]=4 202 B11R1.16 CN(CCF)c1cccnc1 0c417327f73403e17ed488303ca6b0c4 [0,1,1,0,0,0|2,0,0]=4 203 B11R1.16 CN(CCF)c1cnccn1 15a039d9d714db4512792a8b200b4dff [0,1,1,0,0,0|1,0,0]=3 204 B11R1.16 CN(CCF)c1nccnn1 8656614548b5621cb5a908eee1cfbb00 [0,1,1,0,0,0|2,0,0]=4 205 B11R1.16 CN(CCO)c1ccccn1 e37523a54a1bd0bac80e99fe2cbc8f05 [0,1,1,0,0,0|2,0,0]=4 206 B11R1.16 CN(CCO)c1cccnc1 47cb1f96fe61f8c7bd838cc6c9d317ed [0,1,1,0,0,0|2,0,0]=4 207 B11R1.16 CN(CCO)c1cnccn1 bdad212bbcc3afe5eea664c568345e02 [0,1,1,0,0,0|1,0,0]=3 208 B11R1.16 CN(CCO)c1nccnn1 7675091b8971bd54ac25295670a68d09 [0,1,1,0,0,0|2,0,0]=4 209 B11R1.16 CN(CCS)c1ccccn1 de84abbd40dd1eead0c63b1f2ba48791 [0,1,1,0,0,0|2,0,0]=4 210 B11R1.16 CN(CCS)c1cccnc1 5bb9078bc645c6a66ca8b72acfaf15de [0,1,1,0,0,0|2,0,0]=4 211 B11R1.16 CN(CCS)c1cnccn1 2d08c2d6ba147f261632e0f21f55f174 [0,1,1,0,0,0|1,0,0]=3 212 B11R1.16 CN(CCS)c1nccnn1 f3d42f2c666b799a8bc4682caab95570 [0,1,1,0,0,0|2,0,0]=4 213 B11R1.16 COCN(C)c1ccccn1 66cbdeedae67899dab62ab4e4b9abfe2 [0,1,1,0,0,0|2,0,0]=4 214 B11R1.16 COCN(C)c1cccnc1 eee1a900430cbd2ead764847823e4249 [0,1,1,0,0,0|2,0,0]=4 215 B11R1.16 COCN(C)c1cnccn1 a76b0fd1dcf67b9f677e7bf23a60c424 [0,1,1,0,0,0|1,0,0]=3 216 B11R1.16 COCN(C)c1nccnn1 abfde58b22f88a0b4db5b20c87779c46 [0,1,1,0,0,0|2,0,0]=4 217 B11R1.16 CSCN(C)c1ccccn1 b50faf9300869282fdd09bc9d262195a [0,1,1,0,0,0|2,0,0]=4 218 B11R1.16 CSCN(C)c1cccnc1 85210a97edc62a2031929b5c7394c57b [0,1,1,0,0,0|2,0,0]=4 219 B11R1.16 CSCN(C)c1cnccn1 fa59e1713876a768b8d84e8b5846f50c [0,1,1,0,0,0|1,0,0]=3 220 B11R1.16 CSCN(C)c1nccnn1 63daa4e22b2c3595256bc34fc79192b1 [0,1,1,0,0,0|2,0,0]=4 221 B11R1.16 C[C@@H](NCF)c1ccccn1 99b97b5aa9cfaef5c750c0b6f424a155 [0,1,1,0,0,0|2,0,0]=4 222 B11R1.16 C[C@@H](NCF)c1cccnc1 661209de32fd81ce54914e1bd942009a [0,1,1,0,0,0|2,0,0]=4 223 B11R1.16 C[C@@H](NCO)c1ccccn1 06a1df171fb3e867c231d94d30fe4c59 [0,1,1,0,0,0|2,0,0]=4 224 B11R1.16 C[C@@H](NCO)c1cccnc1 cf5dbaaa37b8cb4e2f16350a55683027 [0,1,1,0,0,0|2,0,0]=4 225 B11R1.16 C[C@@H](OCF)c1ccccn1 452563b793d445f90c7b5445d0861252 [0,1,1,0,0,0|2,0,0]=4 226 B11R1.16 C[C@@H](OCF)c1cccnc1 700f73ac95c9eff915753055610d6829 [0,1,1,0,0,0|2,0,0]=4 227 B11R1.16 C[C@@H](OCF)c1cnccn1 4ec1a495205071e6cae2957a86acc99e [0,1,1,0,0,0|1,0,0]=3 228 B11R1.16 C[C@H](NCF)c1ccccn1 3f81f6af69df7aaa916f5a60f5ffdf6c [0,1,1,0,0,0|2,0,0]=4 229 B11R1.16 C[C@H](NCF)c1cccnc1 66a2dcad38cbf0d519df63526d229e46 [0,1,1,0,0,0|2,0,0]=4 230 B11R1.16 C[C@H](NCO)c1ccccn1 d98746896574333cf45787ddae8ffaa8 [0,1,1,0,0,0|2,0,0]=4 231 B11R1.16 C[C@H](NCO)c1cccnc1 476af247167559627f6aa699dfa54495 [0,1,1,0,0,0|2,0,0]=4 232 B11R1.16 C[C@H](OCF)c1ccccn1 6ecec266ea2cccd56a91b2c7f7312784 [0,1,1,0,0,0|2,0,0]=4 233 B11R1.16 C[C@H](OCF)c1cccnc1 1642ade6f48ada445386d02dbd40b795 [0,1,1,0,0,0|2,0,0]=4 234 B11R1.16 C[C@H](OCF)c1cnccn1 3a4066349d3d9540ab63cf5616e22030 [0,1,1,0,0,0|1,0,0]=3 235 B11R1.22 CCN(C)c1ccc(cn1)C 09e547625bc47d07ffa7b31de636862b [0,1,1,0,0,0|2,0,0]=4 236 B11R1.22 CCN(C)c1ccc(cn1)Cl c558c548bcbb0876eff9f96eddc564c3 [0,1,1,0,0,0|2,0,0]=4 237 B11R1.22 CCN(C)c1ccc(cn1)F 48c4bff180c1cecc4a421b3eb0d4f7ed [0,1,1,0,0,0|2,0,0]=4 238 B11R1.22 CCN(C)c1ccc(cn1)I 5a436a740647170bba1c52d7e65abc74 [0,1,1,0,0,0|2,0,0]=4 239 B11R1.22 CCN(C)c1ccc(nc1)Br b6445fecc0c7fd88b71c31623fcd006b [0,1,1,0,0,0|2,0,0]=4 240 B11R1.22 CCN(C)c1ccc(nc1)Cl 98116e0be953dec717bcac000adb9db0 [0,1,1,0,0,0|2,0,0]=4 241 B11R1.22 CCN(C)c1ccc(nc1)F 5c2f83595d7ddc2f36ec5baf4ef48449 [0,1,1,0,0,0|2,0,0]=4 242 B11R1.22 CCN(C)c1cnc(cn1)C 6faeab9093eb09074dffc7f8c73a92a2 [0,1,1,0,0,0|1,0,0]=3 243 B11R1.22 CCN(C)c1cnc(cn1)Cl 93f5384ac0dd4da7faf1f1db35aa9761 [0,1,1,0,0,0|1,0,0]=3 244 B11R1.22 CN(CF)c1cnc(cn1)Br 19a72d80af90818655bede3809df2dba [0,1,1,0,0,0|2,0,0]=4 245 B11R1.22 CN(CF)c1cnc(cn1)Cl 7529e9fc0b86566686ded9900d345655 [0,1,1,0,0,0|2,0,0]=4 246 B11R1.22 CN(CO)c1cnc(cn1)Br 0dc5d64bb4009b63cb6f48837f243a4f [0,1,1,0,0,0|2,0,0]=4 247 B11R1.22 CN(CO)c1cnc(cn1)Cl b4bfe019135820eef64b446610128f9a [0,1,1,0,0,0|2,0,0]=4 248 B11R1.22 Cc1cnc(cn1)N(C)CF 13f2901f88383e0521de274972d55e0d [0,1,1,0,0,0|2,0,0]=4 249 B11R1.22 Cc1cnc(cn1)N(C)CO 354200276b0d807db76f5e2bf72ca03e [0,1,1,0,0,0|2,0,0]=4 250 B11R1.23 CCN(C)c1cc(ccn1)Br 04e0ce28cf290558a1b5ef23009381b2 [0,1,1,0,0,0|2,0,0]=4 251 B11R1.23 CCN(C)c1cc(ccn1)C a3fb3d506e0aa8bc01390f436b3f57fb [0,1,1,0,0,0|2,0,0]=4 252 B11R1.23 CCN(C)c1cc(ccn1)Cl 3d23dc5ff3e66bd32817f92db7d45321 [0,1,1,0,0,0|2,0,0]=4 253 B11R1.23 CCN(C)c1cc(ccn1)F acdf0fc420fc80413aa8e17060c46482 [0,1,1,0,0,0|2,0,0]=4 254 B11R1.23 CCN(C)c1cc(ccn1)I b295003db51738a864f3881b26ca4115 [0,1,1,0,0,0|2,0,0]=4 255 B11R1.23 CCN(C)c1cncc(c1)Br 4e8a54f314758cec6db1d44208066fb3 [0,1,1,0,0,0|2,0,0]=4 256 B11R1.23 CCN(C)c1cncc(c1)C c586f1c7bab338ac78be772791134673 [0,1,1,0,0,0|2,0,0]=4 257 B11R1.23 CCN(C)c1cncc(c1)F 9ab7e09f4c927efd8d017c75c729608f [0,1,1,0,0,0|2,0,0]=4 258 B11R1.23 CCN(C)c1cncc(n1)Cl 61a50d6a365170af804e0900e032e6ac [0,1,1,0,0,0|1,0,0]=3 259 B11R1.23 CN(CF)c1cncc(n1)Br f439bf2f22bb7c8ceacb396918b27ff4 [0,1,1,0,0,0|2,0,0]=4 260 B11R1.23 CN(CF)c1cncc(n1)Cl e9561598ddf5b7d19ab2467f54e44561 [0,1,1,0,0,0|2,0,0]=4 261 B11R1.23 CN(CO)c1cncc(n1)Br cadbfb7a95b20a1f502bef6bf41713f1 [0,1,1,0,0,0|2,0,0]=4 262 B11R1.23 CN(CO)c1cncc(n1)Cl 2a26466910b5ab47a38bf4d064a0f1f5 [0,1,1,0,0,0|2,0,0]=4 263 B11R1.23 Cc1cncc(n1)N(C)CO f833eb5ac3cec8147d9d3ea3585203bc [0,1,1,0,0,0|2,0,0]=4 264 B11R1.36 CC(=O)N(C)c1cnccn1 7d8fc7dfc94af72e401da7941f18789c [0,1,1,0,0,0|1,0,1]=4 265 B11R1.36 CC(C)N(C)c1nccnn1 86ce7014ad5046a842638b44b6a6e404 [0,1,1,0,0,0|2,0,0]=4 266 B11R1.222 CCN(C)c1cccnc1Br 2a9bac7653109ad7cb22a369e9423ffb [0,1,1,0,0,0|2,0,0]=4 267 B11R1.222 CCN(C)c1cccnc1C 0ddb97fac4b005bf5151e63b04814336 [0,1,1,0,0,0|2,0,0]=4 268 B11R1.222 CCN(C)c1cccnc1Cl 583cec184083a5a308a72f647a6e90c8 [0,1,1,0,0,0|2,0,0]=4 269 B11R1.222 CCN(C)c1cccnc1F 60886e25b7b16c0395a71018cc5328fb [0,1,1,0,0,0|2,0,0]=4 270 B11R1.222 CCN(C)c1cnccc1C 15650ab426688eaaa83948de77c329f3 [0,1,1,0,0,0|2,0,0]=4 271 B11R1.222 CCN(C)c1cnccc1Cl 7d79648c65c6505b388546f3ddc49f07 [0,1,1,0,0,0|2,0,0]=4 272 B11R1.222 CCN(C)c1cnccc1F fe6028fb3ed3222dd3d425a51ab84bcb [0,1,1,0,0,0|2,0,0]=4 273 B11R1.222 CCN(C)c1ncc[nH]c1=O 5394ead30c6342275e87532007228ce3 [0,1,1,0,0,0|1,0,1]=4 274 B11R1.222 CCN(C)c1ncccc1C 1e30fac82468209390e0b5f96fc3f6e5 [0,1,1,0,0,0|2,0,0]=4 275 B11R1.222 CCN(C)c1ncccc1Cl 83cf3b72625659b2ba48d78213030296 [0,1,1,0,0,0|2,0,0]=4 276 B11R1.222 CCN(C)c1ncccc1F 00a0e1fae815648efad6bba19128001c [0,1,1,0,0,0|2,0,0]=4 277 B11R1.222 CCN(C)c1ncccc1I adae5b28a255cf01c9ab2ebaac117c29 [0,1,1,0,0,0|2,0,0]=4 278 B11R1.222 CCN(C)c1nccnc1C 5d523a19a51f60cd39551c666cbc848c [0,1,1,0,0,0|1,0,0]=3 279 B11R1.222 CCN(C)c1nccnc1Cl 0aff53c8cad05f64b17a5c5b4df2c214 [0,1,1,0,0,0|1,0,0]=3 280 B11R1.222 CN(CF)c1nccnc1Cl 5334018f3d251e5e79e0994865ed9162 [0,1,1,0,0,0|2,0,0]=4 281 B11R1.222 CN(CO)c1nccnc1Cl 7db54e1531fa465bda330ad6c0239127 [0,1,1,0,0,0|2,0,0]=4 282 B11R1.222 Cc1nccnc1N(C)CF 20ace126cd985ce0955e893a80d5d172 [0,1,1,0,0,0|2,0,0]=4 283 B11R1.222 Cc1nccnc1N(C)CO f1e1ceafafa3cb3a2476908de66105b7 [0,1,1,0,0,0|2,0,0]=4 284 B11R1.1 CCCNc1ccc(cn1)Br 21ad52c0b7cad2f16279c41b12c3dd20 [0,1,1,0,0,0|2,0,0]=4 285 B11R1.1 CCCNc1ccc(cn1)C 49b1b111cca17d95ac5b969044ae90fe [0,1,1,0,0,0|2,0,0]=4 286 B11R1.1 CCCNc1ccc(cn1)Cl a95c01f05e53613156fba3b0f8d7f780 [0,1,1,0,0,0|2,0,0]=4 287 B11R1.1 CCCNc1ccc(cn1)F bd191ccc5254163826bb8b5b65ee6ba9 [0,1,1,0,0,0|2,0,0]=4 288 B11R1.1 CCCNc1ccc(cn1)I 3117f77f4a2d396d13ad23c0ed5be14e [0,1,1,0,0,0|2,0,0]=4 289 B11R1.1 CCCNc1ccc(nc1)Br c94a8cb0ce30ba24f74624f4b9b038a4 [0,1,1,0,0,0|2,0,0]=4 290 B11R1.1 CCCNc1ccc(nc1)C 7d88a307944adac731bde6f988e446cd [0,1,1,0,0,0|2,0,0]=4 291 B11R1.1 CCCNc1ccc(nc1)Cl b1c722121661a42e5d6842a9b28519ac [0,1,1,0,0,0|2,0,0]=4 292 B11R1.1 CCCNc1ccc(nc1)F 85865fae01c522e244e3ef69d8b38878 [0,1,1,0,0,0|2,0,0]=4 293 B11R1.1 CCCNc1ccc(nc1)I b4159aeffce60ad6131e4364b9368e94 [0,1,1,0,0,0|2,0,0]=4 294 B11R1.1 CCCNc1cnc(cn1)Br 3dbfefa68fc5da70500dcddd3fcb8c8f [0,1,1,0,0,0|1,0,0]=3 295 B11R1.1 CCCNc1cnc(cn1)C 8a7aa0209c65f0751183b5a5e627c60d [0,1,1,0,0,0|1,0,0]=3 296 B11R1.1 CCCNc1cnc(cn1)Cl 6e2e446e145945cda8558d44b29bbfd9 [0,1,1,0,0,0|1,0,0]=3 297 B11R1.1 CCCNc1cnc(cn1)I 6202f119a68d18841749f02b15b96196 [0,1,1,0,0,0|1,0,0]=3 298 B11R1.1 CCCNc1ncc(nn1)Br a1fd23f7a6ad306e41d6b406a07b5c0a [0,1,1,0,0,0|2,0,0]=4 299 B11R1.1 CCCOc1ccc(cn1)C a2aa3425c184ebbd01762c44679803c0 [0,1,1,0,0,0|2,0,0]=4 300 B11R1.1 CCCOc1ccc(cn1)Cl 0c1b7fe9f246d104ebcbc468a16004c1 [0,1,1,0,0,0|2,0,0]=4 301 B11R1.1 CCCOc1ccc(cn1)F 6a93fffcdab2ace921c013c1d2a630f1 [0,1,1,0,0,0|2,0,0]=4 302 B11R1.1 CCCOc1ccc(cn1)I ca1682e59f74f1735f8a64800a62750a [0,1,1,0,0,0|2,0,0]=4 303 B11R1.1 CCCOc1ccc(nc1)Br c0aef75a4817cab606425a2121c50d36 [0,1,1,0,0,0|2,0,0]=4 304 B11R1.1 CCCOc1ccc(nc1)C e7dbc804100b6abbbe2b0f45f45546ba [0,1,1,0,0,0|2,0,0]=4 305 B11R1.1 CCCOc1ccc(nc1)Cl 18ab5a610d56358eac2068ee56cbca89 [0,1,1,0,0,0|2,0,0]=4 306 B11R1.1 CCCOc1ccc(nc1)F d5473478a7dbdb85a03b2038e1b4207d [0,1,1,0,0,0|2,0,0]=4 307 B11R1.1 CCCOc1ccc(nc1)I 8a80b63748b30da8afc9dd9cedc24183 [0,1,1,0,0,0|2,0,0]=4 308 B11R1.1 CCCOc1cnc(cn1)Br eb7d8eeeed4e6306f134f86a21893054 [0,1,1,0,0,0|1,0,0]=3 309 B11R1.1 CCCOc1cnc(cn1)C 03ab54fe3c16961ce0c5fdc0fd5a9600 [0,1,1,0,0,0|1,0,0]=3 310 B11R1.1 CCCOc1cnc(cn1)Cl a5a301809a45e660e1887859209b0546 [0,1,1,0,0,0|1,0,0]=3 311 B11R1.1 CCCOc1cnc(cn1)I 16281406a510ee3ee4a386b2674a0229 [0,1,1,0,0,0|1,0,0]=3 312 B11R1.1 CCNCc1ccc(cn1)Br 882a30c5c31be62d8df2ad05ade9700e [0,1,1,0,0,0|2,0,0]=4 313 B11R1.1 CCNCc1ccc(cn1)C ce28a7edd6e5cb339d15632619449df9 [0,1,1,0,0,0|2,0,0]=4 314 B11R1.1 CCNCc1ccc(cn1)Cl a8b3098af6f06b71ef76b0a789adb905 [0,1,1,0,0,0|2,0,0]=4 315 B11R1.1 CCNCc1ccc(cn1)F 8ce16a3c3b9cfcc722411ae28895539b [0,1,1,0,0,0|2,0,0]=4 316 B11R1.1 CCNCc1ccc(nc1)Br 459eae4b7edb145b4c74858ed5083f2a [0,1,1,0,0,0|2,0,0]=4 317 B11R1.1 CCNCc1ccc(nc1)C be9f6396d87f569ee4a97d2c73536694 [0,1,1,0,0,0|2,0,0]=4 318 B11R1.1 CCNCc1ccc(nc1)Cl e61d7305db5ae395b6483f66380e1fe0 [0,1,1,0,0,0|2,0,0]=4 319 B11R1.1 CCNCc1ccc(nc1)F bfcb52b611bb6fe9e54b00a336ddce06 [0,1,1,0,0,0|2,0,0]=4 320 B11R1.1 CCNCc1cnc(cn1)Br 75b2c18e8299485b63bfe9e5d4135615 [0,1,1,0,0,0|1,0,0]=3 321 B11R1.1 CCNCc1cnc(cn1)C c7cd472ae379c00b6048324cd973a09b [0,1,1,0,0,0|1,0,0]=3 322 B11R1.1 CCNCc1cnc(cn1)Cl e187dc8018fb65cbf1b762ca3fbfe810 [0,1,1,0,0,0|1,0,0]=3 323 B11R1.1 CCOCc1ccc(cn1)Br 7fa2d6660ca0fac0c5d496c90646d302 [0,1,1,0,0,0|2,0,0]=4 324 B11R1.1 CCOCc1ccc(cn1)C d87497b35c5f44e142aec59de5813e88 [0,1,1,0,0,0|2,0,0]=4 325 B11R1.1 CCOCc1ccc(cn1)Cl 6991b553b81a946d1923a2d827bfdbc3 [0,1,1,0,0,0|2,0,0]=4 326 B11R1.1 CCOCc1ccc(cn1)F c13b565598015e639c197d30e6fbe232 [0,1,1,0,0,0|2,0,0]=4 327 B11R1.1 CCOCc1ccc(cn1)I 401d1ae041509fd6bf393ad89597efa1 [0,1,1,0,0,0|2,0,0]=4 328 B11R1.1 CCOCc1ccc(nc1)Br 16508d9e74e22116b4378afff1fa9aa5 [0,1,1,0,0,0|2,0,0]=4 329 B11R1.1 CCOCc1ccc(nc1)C a880cc0302e1c9d4e4d89c1a296d8d06 [0,1,1,0,0,0|2,0,0]=4 330 B11R1.1 CCOCc1ccc(nc1)Cl 78e1cd2f782133a4dfac861a528ccf0c [0,1,1,0,0,0|2,0,0]=4 331 B11R1.1 CCOCc1ccc(nc1)F 965c536d19c11eee65b05ccac1580358 [0,1,1,0,0,0|2,0,0]=4 332 B11R1.1 CCOCc1cnc(cn1)Br 0b1905360ed53097dd5446844fb9d44e [0,1,1,0,0,0|1,0,0]=3 333 B11R1.1 CCOCc1cnc(cn1)C b885c2b2dd24eed4b75af88d0f2ca8e7 [0,1,1,0,0,0|1,0,0]=3 334 B11R1.1 CCOCc1cnc(cn1)Cl 37e2370a54551fed3ce526f1f0ca25f7 [0,1,1,0,0,0|1,0,0]=3 335 B11R1.1 COCNc1cnc(cn1)Br 0b49f70ce00475eb1a0a3df87d7c14c7 [0,1,1,0,0,0|2,0,0]=4 336 B11R1.1 COCNc1cnc(cn1)C 8e85dc8e7034a3470175c4342f07ed93 [0,1,1,0,0,0|2,0,0]=4 337 B11R1.1 COCNc1cnc(cn1)Cl 8ac7c4fd7c05636829197d595d92d3b3 [0,1,1,0,0,0|2,0,0]=4 338 B11R1.1 COCNc1cnc(cn1)I 8437a9227237c1883d271f7d25cc8a22 [0,1,1,0,0,0|2,0,0]=4 339 B11R1.1 COCOc1cnc(cn1)Br 40b37b0f94d4896ff201464d3611163b [0,1,1,0,0,0|2,0,0]=4 340 B11R1.1 COCOc1cnc(cn1)C 4475b105f4a2048faee1f2ecb47844b5 [0,1,1,0,0,0|2,0,0]=4 341 B11R1.1 COCOc1cnc(cn1)Cl e43da791ffc80fbbbc6a9a3e5763e1da [0,1,1,0,0,0|2,0,0]=4 342 B11R1.1 COCOc1cnc(cn1)I a190a0a920493f2b26668c23abae2cf8 [0,1,1,0,0,0|2,0,0]=4 343 B11R1.1 CSCNc1cnc(cn1)Br bfd5141141fa2785440a4684970eb66e [0,1,1,0,0,0|2,0,0]=4 344 B11R1.1 CSCNc1cnc(cn1)C c24fd09b3ea24e803bb51a1280bea81a [0,1,1,0,0,0|2,0,0]=4 345 B11R1.1 CSCNc1cnc(cn1)Cl eaa89aa3a4caed839de327dc7641423b [0,1,1,0,0,0|2,0,0]=4 346 B11R1.1 CSCOc1cnc(cn1)Br 4aefdebf8559edec730caae62dd58573 [0,1,1,0,0,0|2,0,0]=4 347 B11R1.1 CSCOc1cnc(cn1)C 71270f8fd091b1f58683f862118ded52 [0,1,1,0,0,0|2,0,0]=4 348 B11R1.1 CSCOc1cnc(cn1)Cl 9aa103e456910721612c485c6280b66f [0,1,1,0,0,0|2,0,0]=4 349 B11R1.1 CSCOc1cnc(cn1)I c010750edf6f12e20f78b3de4c209cb9 [0,1,1,0,0,0|2,0,0]=4 350 B11R1.1 Cc1cnc(cn1)CNCF e5b1fac23703a58295c66d28ba99c9bd [0,1,1,0,0,0|2,0,0]=4 351 B11R1.1 Cc1cnc(cn1)COCF b5ec7e3fce47adf833cc38e45ee6aed3 [0,1,1,0,0,0|2,0,0]=4 352 B11R1.1 Cc1cnc(cn1)NCCF e0c7fa2c0ed0c7e499587eacc5b78c8d [0,1,1,0,0,0|2,0,0]=4 353 B11R1.1 Cc1cnc(cn1)NCCO 35684728c0cb15cce6eb02578594fc19 [0,1,1,0,0,0|2,0,0]=4 354 B11R1.1 Cc1cnc(cn1)NCCS 2d2b8568dc7a9f38d65a161b574269d0 [0,1,1,0,0,0|2,0,0]=4 355 B11R1.1 Cc1cnc(cn1)OCCF 497216d2b6be584cad6948c14fa1e2c4 [0,1,1,0,0,0|2,0,0]=4 356 B11R1.1 Cc1cnc(cn1)OCCS 4394973d0f7be755e51c9f0848650be4 [0,1,1,0,0,0|2,0,0]=4 357 B11R1.1 FCCNc1cnc(cn1)Br 461f6d96e1cd464d8f0005fc6e5e7e7f [0,1,1,0,0,0|2,0,0]=4 358 B11R1.1 FCCNc1cnc(cn1)Cl 2b0f81d0f26dd3246d633ea60ae2918b [0,1,1,0,0,0|2,0,0]=4 359 B11R1.1 FCCNc1cnc(cn1)I 799163dcc5b2ebb3b9d5cf378c8522d3 [0,1,1,0,0,0|2,0,0]=4 360 B11R1.1 FCCOc1cnc(cn1)Br 0db891f26706eacab8f5f5bcc0e8d8b9 [0,1,1,0,0,0|2,0,0]=4 361 B11R1.1 FCCOc1cnc(cn1)Cl 3ab4cc7252f7c3d01a9394d09c8b66c8 [0,1,1,0,0,0|2,0,0]=4 362 B11R1.1 FCCOc1cnc(cn1)I aa0fc9268845d3f4b9f11cc02a113bea [0,1,1,0,0,0|2,0,0]=4 363 B11R1.1 FCNCc1cnc(cn1)Br f44c780a7cf5fad8ff74ddfb6e2bfeb5 [0,1,1,0,0,0|2,0,0]=4 364 B11R1.1 FCNCc1cnc(cn1)Cl e542f6da3e8282f8d7017995a718d119 [0,1,1,0,0,0|2,0,0]=4 365 B11R1.1 FCOCc1cnc(cn1)Br 7df8877632c227a191c5ae0099fb43cb [0,1,1,0,0,0|2,0,0]=4 366 B11R1.1 FCOCc1cnc(cn1)Cl f19d429796c5c9d3591c9ae82ef417a4 [0,1,1,0,0,0|2,0,0]=4 367 B11R1.1 OCCNc1cnc(cn1)Br 20fe9251d0c738c5527f8b56b1f1ba7c [0,1,1,0,0,0|2,0,0]=4 368 B11R1.1 OCCNc1cnc(cn1)Cl 0ea215975f7f6db418166cc2cff98f1f [0,1,1,0,0,0|2,0,0]=4 369 B11R1.1 OCCNc1cnc(cn1)I 3c706fd531edea1583e0b154201ed19f [0,1,1,0,0,0|2,0,0]=4 370 B11R1.1 OCNCc1cnc(cn1)Br a0e3c91b97a30433bfae5a1fef465a87 [0,1,1,0,0,0|2,0,0]=4 371 B11R1.1 OCNCc1cnc(cn1)Cl b98f361b115c5bfee317450a51d8d536 [0,1,1,0,0,0|2,0,0]=4 372 B11R1.1 SCCNc1cnc(cn1)Br 97c6c10edda386d5b05c026d46924c54 [0,1,1,0,0,0|2,0,0]=4 373 B11R1.1 SCCNc1cnc(cn1)Cl d492b8792f2e4550bfdde5924c24a3bf [0,1,1,0,0,0|2,0,0]=4 374 B11R1.1 SCCNc1cnc(cn1)I da02149fc872e586b41a51ab8ca32573 [0,1,1,0,0,0|2,0,0]=4 375 B11R1.1 SCCOc1cnc(cn1)Br 6ac24f0ff2faae95f24b70b5d7871b18 [0,1,1,0,0,0|2,0,0]=4 376 B11R1.1 SCCOc1cnc(cn1)Cl cf1c341a90fc16c06b63e5a669ff5502 [0,1,1,0,0,0|2,0,0]=4 377 B11R1.1 SCCOc1cnc(cn1)I f8adaed60765a9fbd9f9694bd5b98dc9 [0,1,1,0,0,0|2,0,0]=4 378 B11R1.17 CCCNc1cccnc1Br 806ab32b880ec60eaa8de37c8b9a09b3 [0,1,1,0,0,0|2,0,0]=4 379 B11R1.17 CCCNc1cccnc1C 22a2471d4061d7e8b2734dc78b59847f [0,1,1,0,0,0|2,0,0]=4 380 B11R1.17 CCCNc1cccnc1Cl d863e25eb1d7fae0beb4f2a560b9b1a5 [0,1,1,0,0,0|2,0,0]=4 381 B11R1.17 CCCNc1cccnc1F 6429f1513f49f5fa6ff7fe16885b526b [0,1,1,0,0,0|2,0,0]=4 382 B11R1.17 CCCNc1cccnc1I 9bb718503ad944c42a1784cec5f7c8f8 [0,1,1,0,0,0|2,0,0]=4 383 B11R1.17 CCCNc1cnccc1Br 007b289babfb84404970e908ef031a59 [0,1,1,0,0,0|2,0,0]=4 384 B11R1.17 CCCNc1cnccc1C dcefa786e0d72c346e2c2a750f3eb355 [0,1,1,0,0,0|2,0,0]=4 385 B11R1.17 CCCNc1cnccc1Cl 2b75a2dd8a9c947a7db5a224583f2e53 [0,1,1,0,0,0|2,0,0]=4 386 B11R1.17 CCCNc1cnccc1F 0c96675d5ae34365508907ee1228ef3a [0,1,1,0,0,0|2,0,0]=4 387 B11R1.17 CCCNc1cnccc1I 39c336e4f6a77f3ce348958797714058 [0,1,1,0,0,0|2,0,0]=4 388 B11R1.17 CCCNc1ncccc1Br afdad602cc18eba6538110beb8225730 [0,1,1,0,0,0|2,0,0]=4 389 B11R1.17 CCCNc1ncccc1C abec0375ee082a7d48f7cf43776cf112 [0,1,1,0,0,0|2,0,0]=4 390 B11R1.17 CCCNc1ncccc1Cl b509a2ca435f1e67a922e5764a1cf9c5 [0,1,1,0,0,0|2,0,0]=4 391 B11R1.17 CCCNc1ncccc1F af3a157f218544df912ffebf16be14cb [0,1,1,0,0,0|2,0,0]=4 392 B11R1.17 CCCNc1ncccc1I c4c7e827ce85817f94824160ced25561 [0,1,1,0,0,0|2,0,0]=4 393 B11R1.17 CCCNc1nccnc1Br b2deb868e93ad8bfdc3d31ff074e6394 [0,1,1,0,0,0|1,0,0]=3 394 B11R1.17 CCCNc1nccnc1C 7959f3a041ff51b3c70e5e598f2f50d9 [0,1,1,0,0,0|1,0,0]=3 395 B11R1.17 CCCNc1nccnc1Cl 1504070ee0177f27ed1d51a2c4390e7f [0,1,1,0,0,0|1,0,0]=3 396 B11R1.17 CCCNc1nccnc1I 25f1a795720059dbef86476449229e6c [0,1,1,0,0,0|1,0,0]=3 397 B11R1.17 CCCOc1cccnc1Br 115afbdd34d18eb1d8ab3c1f8d43d3be [0,1,1,0,0,0|2,0,0]=4 398 B11R1.17 CCCOc1cccnc1C 1ed437f8fbe2f5e0b870ba84e31d17c0 [0,1,1,0,0,0|2,0,0]=4 399 B11R1.17 CCCOc1cccnc1Cl edf30018692c32749c24b87a6d0498a1 [0,1,1,0,0,0|2,0,0]=4 400 B11R1.17 CCCOc1cccnc1F 5ee70f4822753bd9da31b99184a90a77 [0,1,1,0,0,0|2,0,0]=4 401 B11R1.17 CCCOc1cccnc1I 3e57bebc485592a1e6ceadbef8f3a8b5 [0,1,1,0,0,0|2,0,0]=4 402 B11R1.17 CCCOc1cnccc1Br 33eee72d4b7297486d5285207fea74a8 [0,1,1,0,0,0|2,0,0]=4 403 B11R1.17 CCCOc1cnccc1C 45ff092a3d49118757409dc90c0d8b53 [0,1,1,0,0,0|2,0,0]=4 404 B11R1.17 CCCOc1cnccc1Cl 129434639f839466cae39279066d29a9 [0,1,1,0,0,0|2,0,0]=4 405 B11R1.17 CCCOc1cnccc1F 7275b9af8dd5f2cc96d1a4ae1db2b570 [0,1,1,0,0,0|2,0,0]=4 406 B11R1.17 CCCOc1cnccc1I 398d79496d40e0c234bb46c874339373 [0,1,1,0,0,0|2,0,0]=4 407 B11R1.17 CCCOc1ncccc1Br 591cb4e29b3d78165b95627fad6003be [0,1,1,0,0,0|2,0,0]=4 408 B11R1.17 CCCOc1ncccc1C 75d7921d560a6b2f851a2acab9f2614a [0,1,1,0,0,0|2,0,0]=4 409 B11R1.17 CCCOc1ncccc1Cl 0a16720fcbf52b5cf544018f35b8eeec [0,1,1,0,0,0|2,0,0]=4 410 B11R1.17 CCCOc1ncccc1F ee3952c45bf36a13ea36600dcc4a174a [0,1,1,0,0,0|2,0,0]=4 411 B11R1.17 CCCOc1nccnc1Br c34189a6173cc4621130f2580d00b8c6 [0,1,1,0,0,0|1,0,0]=3 412 B11R1.17 CCCOc1nccnc1C 0b16d5dccf3e1318f521652f165dafab [0,1,1,0,0,0|1,0,0]=3 413 B11R1.17 CCNCc1cccnc1Br 32ff08bdc8b36f4fd72794d17b8094db [0,1,1,0,0,0|2,0,0]=4 414 B11R1.17 CCNCc1cccnc1C 0a1b3485e2e73031e3e3fc0c87c75e22 [0,1,1,0,0,0|2,0,0]=4 415 B11R1.17 CCNCc1cccnc1Cl 9f0320d1cb7ffe46922a86002c904be4 [0,1,1,0,0,0|2,0,0]=4 416 B11R1.17 CCNCc1cccnc1F 2e93965ca7c62978c851e96fc991f385 [0,1,1,0,0,0|2,0,0]=4 417 B11R1.17 CCNCc1cnccc1C 4bf7654e6c7ab59c2c967e90494ba077 [0,1,1,0,0,0|2,0,0]=4 418 B11R1.17 CCNCc1ncccc1Br 09995fa96814a8c54c9bca09512a1c87 [0,1,1,0,0,0|2,0,0]=4 419 B11R1.17 CCNCc1ncccc1C 87bcb20686c74c1349ceb9aba049bbf8 [0,1,1,0,0,0|2,0,0]=4 420 B11R1.17 CCNCc1ncccc1Cl 3fcb8c6a497a9d9b3a48e230bfe378a1 [0,1,1,0,0,0|2,0,0]=4 421 B11R1.17 CCNCc1ncccc1F dda2cc3453d8ca1ee059e44555253881 [0,1,1,0,0,0|2,0,0]=4 422 B11R1.17 CCNCc1nccnc1Cl 312702593b26de5f36ebb20f79575628 [0,1,1,0,0,0|1,0,0]=3 423 B11R1.17 CCOCc1cccnc1Br 84c896bbf791f636167b96d78239b3f5 [0,1,1,0,0,0|2,0,0]=4 424 B11R1.17 CCOCc1cccnc1C 10fe290309f01ddd76b919ada33fcfb8 [0,1,1,0,0,0|2,0,0]=4 425 B11R1.17 CCOCc1cccnc1Cl 0fdb01e029eba9fd77978b05f349ad64 [0,1,1,0,0,0|2,0,0]=4 426 B11R1.17 CCOCc1cccnc1F 26b203b8b1a12b477d6336928b6ab8d4 [0,1,1,0,0,0|2,0,0]=4 427 B11R1.17 CCOCc1cnccc1Br 750cda4e9bc34f5a91eb935189c60ab8 [0,1,1,0,0,0|2,0,0]=4 428 B11R1.17 CCOCc1cnccc1C c7331a6c4dde5c450ee6a5c1e8ddd68f [0,1,1,0,0,0|2,0,0]=4 429 B11R1.17 CCOCc1cnccc1Cl d0ea2c29bb03569328f3a86c14865fe2 [0,1,1,0,0,0|2,0,0]=4 430 B11R1.17 CCOCc1cnccc1F 35e2ec5af2d1d295476ee94596fb4fa5 [0,1,1,0,0,0|2,0,0]=4 431 B11R1.17 CCOCc1ncccc1Br a900f8070f81c4dcfb6829872fbeb70d [0,1,1,0,0,0|2,0,0]=4 432 B11R1.17 CCOCc1ncccc1C 22c6c25dddf153fd6e4a707af4b8068f [0,1,1,0,0,0|2,0,0]=4 433 B11R1.17 CCOCc1ncccc1Cl 3c0fdcad26845cb45b2978d3ea158930 [0,1,1,0,0,0|2,0,0]=4 434 B11R1.17 CCOCc1ncccc1F 27994f3f8111644da417064253c7144c [0,1,1,0,0,0|2,0,0]=4 435 B11R1.17 CCOCc1nccnc1C 47c62f7c04b33077f76d36a56e394ddf [0,1,1,0,0,0|1,0,0]=3 436 B11R1.17 CCOCc1nccnc1Cl 35bc32266fe34371783b3188fae8c7a3 [0,1,1,0,0,0|1,0,0]=3 437 B11R1.17 COCNc1nccnc1Br 75a6f1b7e6cc056d4a11f892271a51ee [0,1,1,0,0,0|2,0,0]=4 438 B11R1.17 COCNc1nccnc1C f7a21258816bfef448bfb97023f7df6f [0,1,1,0,0,0|2,0,0]=4 439 B11R1.17 COCNc1nccnc1Cl 64c9a33aef6402682d1d9961e677f93d [0,1,1,0,0,0|2,0,0]=4 440 B11R1.17 COCNc1nccnc1I fc5a7e1bf7a79d84f869a225d696a50b [0,1,1,0,0,0|2,0,0]=4 441 B11R1.17 COCOc1nccnc1Br 308b86e7ca77ced8119559161c762dba [0,1,1,0,0,0|2,0,0]=4 442 B11R1.17 COCOc1nccnc1C 36aac378352b0c12566f983bf9b4e4ce [0,1,1,0,0,0|2,0,0]=4 443 B11R1.17 CSCNc1nccnc1Br 88099c56d56ae74910ba43613cbd02c9 [0,1,1,0,0,0|2,0,0]=4 444 B11R1.17 CSCNc1nccnc1C 85a0c663b554e7000ea021875a086850 [0,1,1,0,0,0|2,0,0]=4 445 B11R1.17 CSCNc1nccnc1Cl 8d8cbb01902adfeca79d434253c1b5c4 [0,1,1,0,0,0|2,0,0]=4 446 B11R1.17 CSCNc1nccnc1I 29c4c4b19a266655e63273c771b99fe0 [0,1,1,0,0,0|2,0,0]=4 447 B11R1.17 CSCOc1nccnc1Br 2039ecdf8b50bab8f7b6778385c6a9d2 [0,1,1,0,0,0|2,0,0]=4 448 B11R1.17 CSCOc1nccnc1C 3e6ba024dc9a04e0823f003c920ca735 [0,1,1,0,0,0|2,0,0]=4 449 B11R1.17 Cc1nccnc1COCF e38786363e40b0491bc2a209c6e78704 [0,1,1,0,0,0|2,0,0]=4 450 B11R1.17 Cc1nccnc1NCCF 8d2e9c2f4c0063d9bf02367ce15c7c4c [0,1,1,0,0,0|2,0,0]=4 451 B11R1.17 Cc1nccnc1NCCO d0ad8d72f79faf6fcc5be3bb779c12c3 [0,1,1,0,0,0|2,0,0]=4 452 B11R1.17 Cc1nccnc1NCCS 4357054951ca4e2125dfb5ab67f126b1 [0,1,1,0,0,0|2,0,0]=4 453 B11R1.17 Cc1nccnc1OCCF 0ced02cb053d97e019ccbdfa3447d9a4 [0,1,1,0,0,0|2,0,0]=4 454 B11R1.17 Cc1nccnc1OCCS fa15d6d156c64b9df3fac7dd58d19b44 [0,1,1,0,0,0|2,0,0]=4 455 B11R1.17 FCCNc1nccnc1Br 20e9bcb95004a18bce395faf4a798bc9 [0,1,1,0,0,0|2,0,0]=4 456 B11R1.17 FCCNc1nccnc1Cl ca2cf7a7a2fb515ed168ef038aa042d4 [0,1,1,0,0,0|2,0,0]=4 457 B11R1.17 FCCNc1nccnc1I 7566fbe0eeb98ec04b8fbc3064fa6246 [0,1,1,0,0,0|2,0,0]=4 458 B11R1.17 FCCOc1nccnc1Br 8f7f24d654a5ecdbcc41462f36518704 [0,1,1,0,0,0|2,0,0]=4 459 B11R1.17 FCNCc1nccnc1Cl 712ec97c55c257608e9de33b2a134969 [0,1,1,0,0,0|2,0,0]=4 460 B11R1.17 FCOCc1nccnc1Cl 08e530a8f63af8fa83cb47cb1b1d87c5 [0,1,1,0,0,0|2,0,0]=4 461 B11R1.17 Fc1nccnc1NCCS 68217e16032f3410171348a2f12299ef [0,1,1,0,0,0|2,0,0]=4 462 B11R1.17 OCCNc1nccnc1Br 0455803b690a11861704b627f2353598 [0,1,1,0,0,0|2,0,0]=4 463 B11R1.17 OCCNc1nccnc1Cl 18f94bea143288632f56cac0e4c600b7 [0,1,1,0,0,0|2,0,0]=4 464 B11R1.17 OCCNc1nccnc1I bdec6eb3ba7717537d84202488b38217 [0,1,1,0,0,0|2,0,0]=4 465 B11R1.17 OCNCc1nccnc1Cl 7234e46201f4bc12b5f2f81c58b16ce3 [0,1,1,0,0,0|2,0,0]=4 466 B11R1.17 SCCNc1nccnc1Br 388c77cd192f18fee737f34992a8c638 [0,1,1,0,0,0|2,0,0]=4 467 B11R1.17 SCCNc1nccnc1Cl 3e71bf2b3d54b0f6378e1c378363dd51 [0,1,1,0,0,0|2,0,0]=4 468 B11R1.17 SCCNc1nccnc1I 252ffe727280f67081e6bba5c23fc071 [0,1,1,0,0,0|2,0,0]=4 469 B11R1.17 SCCOc1nccnc1Br 035d1c1fdf1b19243cafec71410561ef [0,1,1,0,0,0|2,0,0]=4 470 B11R1.24 CCCNc1cc(ccn1)Br f1c13a780ea072a97f4918a3ae5fe793 [0,1,1,0,0,0|2,0,0]=4 471 B11R1.24 CCCNc1cc(ccn1)C 9dd4b3ccbbc29296234e9ff62794f94d [0,1,1,0,0,0|2,0,0]=4 472 B11R1.24 CCCNc1cc(ccn1)Cl e2748ea47500b5c43ad80436ec365351 [0,1,1,0,0,0|2,0,0]=4 473 B11R1.24 CCCNc1cc(ccn1)F 19627d65edc699fb72ffad9630193c09 [0,1,1,0,0,0|2,0,0]=4 474 B11R1.24 CCCNc1cc(ccn1)I 84f5d93869eede5ea29829b3c07bd844 [0,1,1,0,0,0|2,0,0]=4 475 B11R1.24 CCCNc1cccc(n1)Br 922806381eb036239ce652ef71179a3c [0,1,1,0,0,0|2,0,0]=4 476 B11R1.24 CCCNc1cccc(n1)C ac360e9e258569f548399e28fa3180d8 [0,1,1,0,0,0|2,0,0]=4 477 B11R1.24 CCCNc1cccc(n1)Cl dce45d6f17ac605453290d833800c971 [0,1,1,0,0,0|2,0,0]=4 478 B11R1.24 CCCNc1cccc(n1)F 6c39e109efcbcaf4d3a5d07f4418f5de [0,1,1,0,0,0|2,0,0]=4 479 B11R1.24 CCCNc1cccc(n1)I 257cf609e45e5409e5f7885d77dcd130 [0,1,1,0,0,0|2,0,0]=4 480 B11R1.24 CCCNc1cn[nH]c(=O)n1 53a4d88503ece216a2cf44a8f6bb5113 [0,1,1,0,0,0|2,0,0]=4 481 B11R1.24 CCCNc1cncc(c1)Br df91207309bb098127db46b0c6c28373 [0,1,1,0,0,0|2,0,0]=4 482 B11R1.24 CCCNc1cncc(c1)C 17cc7df963debf4f8ee3c67f6dbccd63 [0,1,1,0,0,0|2,0,0]=4 483 B11R1.24 CCCNc1cncc(c1)Cl 0c2e6062e8edca14a7c30617675a1f46 [0,1,1,0,0,0|2,0,0]=4 484 B11R1.24 CCCNc1cncc(c1)F ee0c8e82c86888a5308b2d5ae8e4dc3e [0,1,1,0,0,0|2,0,0]=4 485 B11R1.24 CCCNc1cncc(c1)I 6d9481f5c9f1d1a015a6a7e6ac1b7f83 [0,1,1,0,0,0|2,0,0]=4 486 B11R1.24 CCCNc1cncc(n1)Br 14e256debc40100632b783ca9e3f0377 [0,1,1,0,0,0|1,0,0]=3 487 B11R1.24 CCCNc1cncc(n1)C 7d065fb5278b04e394be53839a4f4b26 [0,1,1,0,0,0|1,0,0]=3 488 B11R1.24 CCCNc1cncc(n1)Cl ed5d58055eb33af3f370507db3afd9aa [0,1,1,0,0,0|1,0,0]=3 489 B11R1.24 CCCNc1cncc(n1)F 565d2a2cd861b4f047e60b3fa461c56a [0,1,1,0,0,0|1,0,0]=3 490 B11R1.24 CCCNc1cnnc(n1)C de5d854934181abf5a97df5c6bfd3e21 [0,1,1,0,0,0|2,0,0]=4 491 B11R1.24 CCCNc1cnnc(n1)Cl ea63721cde8fb3eb54716f176a96e033 [0,1,1,0,0,0|2,0,0]=4 492 B11R1.24 CCCOc1cc(ccn1)Br 733fbc0062452a6d408b5de5a71ee204 [0,1,1,0,0,0|2,0,0]=4 493 B11R1.24 CCCOc1cc(ccn1)C e0a5b7a4ceaf137253b09aaa74d8a523 [0,1,1,0,0,0|2,0,0]=4 494 B11R1.24 CCCOc1cc(ccn1)Cl 9bec7845ed0cc2ec4528299e79a75327 [0,1,1,0,0,0|2,0,0]=4 495 B11R1.24 CCCOc1cc(ccn1)F 0dc309ef3e091b80292d2495314d3e88 [0,1,1,0,0,0|2,0,0]=4 496 B11R1.24 CCCOc1cccc(n1)Br a9055c800f7a8bea8f5823944b85de73 [0,1,1,0,0,0|2,0,0]=4 497 B11R1.24 CCCOc1cccc(n1)C 39c146d9d455282915fb415280d9321f [0,1,1,0,0,0|2,0,0]=4 498 B11R1.24 CCCOc1cccc(n1)F 64f38a887ca7a2ad9537d774a3104a70 [0,1,1,0,0,0|2,0,0]=4 499 B11R1.24 CCCOc1cncc(c1)Br 6b4e60f933e3d32ce41374eabb594281 [0,1,1,0,0,0|2,0,0]=4 500 B11R1.24 CCCOc1cncc(c1)C d5edc0e29a183d0a30f574eab2102c23 [0,1,1,0,0,0|2,0,0]=4 501 B11R1.24 CCCOc1cncc(c1)Cl adace2f1506c9567632091a7287ad895 [0,1,1,0,0,0|2,0,0]=4 502 B11R1.24 CCCOc1cncc(c1)F 304c595ae441bc7dd304adfb8c15aedf [0,1,1,0,0,0|2,0,0]=4 503 B11R1.24 CCCOc1cncc(c1)I 4ab44cea02f047116b93f5e680e20338 [0,1,1,0,0,0|2,0,0]=4 504 B11R1.24 CCCOc1cncc(n1)Br 8acbc2197880f863ff3c8b69c5a65d3b [0,1,1,0,0,0|1,0,0]=3 505 B11R1.24 CCCOc1cncc(n1)C c2772f2207ed04c57882d6d72486141e [0,1,1,0,0,0|1,0,0]=3 506 B11R1.24 CCCOc1cncc(n1)Cl ba3c70e8a93a324604ef8bfd0449bb0d [0,1,1,0,0,0|1,0,0]=3 507 B11R1.24 CCNCc1cc(ccn1)Br e896276c8fa14cddbcb38ebcdac27e5d [0,1,1,0,0,0|2,0,0]=4 508 B11R1.24 CCNCc1cc(ccn1)C 774f66d8e453a57270dc32842d55134b [0,1,1,0,0,0|2,0,0]=4 509 B11R1.24 CCNCc1cc(ccn1)Cl 5028728b9ac7ebc1c9518284f0807fbd [0,1,1,0,0,0|2,0,0]=4 510 B11R1.24 CCNCc1cccc(n1)Br c978bb899b1e5a401c33708277506b25 [0,1,1,0,0,0|2,0,0]=4 511 B11R1.24 CCNCc1cccc(n1)C 152e97bb6eb9a6a331f50dff3115da53 [0,1,1,0,0,0|2,0,0]=4 512 B11R1.24 CCNCc1cccc(n1)Cl 1bd8ce8886953bed1784a34d49705dec [0,1,1,0,0,0|2,0,0]=4 513 B11R1.24 CCNCc1cccc(n1)F 6624bbae6e7a27ced67aeeba1b15f696 [0,1,1,0,0,0|2,0,0]=4 514 B11R1.24 CCNCc1cncc(c1)Br 53d212050b12d7981e083ad8ce2cf307 [0,1,1,0,0,0|2,0,0]=4 515 B11R1.24 CCNCc1cncc(c1)C a8be4d48927f0aa569ae65469d8564f6 [0,1,1,0,0,0|2,0,0]=4 516 B11R1.24 CCNCc1cncc(c1)Cl c844100d4e6cc69aa1cd866fcfd7b483 [0,1,1,0,0,0|2,0,0]=4 517 B11R1.24 CCNCc1cncc(c1)F c98b0bf2a9946ab8a72db48c349e2252 [0,1,1,0,0,0|2,0,0]=4 518 B11R1.24 CCNCc1cncc(n1)Cl ed106e7f77edef20e981894c6b487949 [0,1,1,0,0,0|1,0,0]=3 519 B11R1.24 CCOCc1cc(ccn1)Br 0726b8a141caded4ec904623fca2ab22 [0,1,1,0,0,0|2,0,0]=4 520 B11R1.24 CCOCc1cc(ccn1)C 2d5b6d2e2d714975e85774b9da739956 [0,1,1,0,0,0|2,0,0]=4 521 B11R1.24 CCOCc1cc(ccn1)Cl 158638af681bb2c0924168dfb0c4809a [0,1,1,0,0,0|2,0,0]=4 522 B11R1.24 CCOCc1cc(ccn1)F a0a517bf4ebe3f482da9efb1f014fd4e [0,1,1,0,0,0|2,0,0]=4 523 B11R1.24 CCOCc1cc(ccn1)I 52a26a3ba97e706ba155b551bf3cce2f [0,1,1,0,0,0|2,0,0]=4 524 B11R1.24 CCOCc1cccc(n1)Br 90a68360acfece20f90108990bcd1149 [0,1,1,0,0,0|2,0,0]=4 525 B11R1.24 CCOCc1cccc(n1)C 28a36ef1d20cbd44690d599ab87bdc5f [0,1,1,0,0,0|2,0,0]=4 526 B11R1.24 CCOCc1cccc(n1)Cl 82ebf630bd981fc4893dc75cb0bef897 [0,1,1,0,0,0|2,0,0]=4 527 B11R1.24 CCOCc1cccc(n1)F 2089888f25135651426c37a52be6c99b [0,1,1,0,0,0|2,0,0]=4 528 B11R1.24 CCOCc1cccc(n1)I fe037eb715fee04a280f82d502bd179d [0,1,1,0,0,0|2,0,0]=4 529 B11R1.24 CCOCc1cncc(c1)C 121fa46d697e1516e023ead6822cc1d1 [0,1,1,0,0,0|2,0,0]=4 530 B11R1.24 CCOCc1cncc(c1)Cl 1e91e3fbb4e3d0c3d9fd920c89ee7a2b [0,1,1,0,0,0|2,0,0]=4 531 B11R1.24 CCOCc1cncc(c1)F eb720cd1e153d372dc09203bc199f583 [0,1,1,0,0,0|2,0,0]=4 532 B11R1.24 CCOCc1cncc(c1)I c0a034a0c75135b9cb15b78e0a4a7802 [0,1,1,0,0,0|2,0,0]=4 533 B11R1.24 CCOCc1cncc(n1)Br 93b3c48b0f46fe40293e5c4d06ff7add [0,1,1,0,0,0|1,0,0]=3 534 B11R1.24 CCOCc1cncc(n1)Cl 4fc9209a0abdc2127432660e0653cfeb [0,1,1,0,0,0|1,0,0]=3 535 B11R1.24 COCNc1cncc(n1)Br 6291786e945ff82dcb9d5f69be5c17ca [0,1,1,0,0,0|2,0,0]=4 536 B11R1.24 COCNc1cncc(n1)C 2b6ec934ce08c5d786355e60e1b75b15 [0,1,1,0,0,0|2,0,0]=4 537 B11R1.24 COCNc1cncc(n1)Cl 33f5fcccca32b1d1dbb534d3025bc64f [0,1,1,0,0,0|2,0,0]=4 538 B11R1.24 COCNc1cncc(n1)F 1ec4ee6769e740c4e0d5102cdb38a25f [0,1,1,0,0,0|2,0,0]=4 539 B11R1.24 COCOc1cncc(n1)Br 500eac92c7ace03eb7f00541dd3eb004 [0,1,1,0,0,0|2,0,0]=4 540 B11R1.24 COCOc1cncc(n1)C e6cdc25d0a82d3aa5af1bc8661582846 [0,1,1,0,0,0|2,0,0]=4 541 B11R1.24 COCOc1cncc(n1)Cl fd556a26541e43f7c5930d91958d854e [0,1,1,0,0,0|2,0,0]=4 542 B11R1.24 CSCNc1cncc(n1)Br b15a9af5292382385e702071790523ca [0,1,1,0,0,0|2,0,0]=4 543 B11R1.24 CSCNc1cncc(n1)F 23ebb3c9fc6860c977423555f9ff63d0 [0,1,1,0,0,0|2,0,0]=4 544 B11R1.24 CSCOc1cncc(n1)Br c7ff3c628d66c5f60a4ac6b06834d243 [0,1,1,0,0,0|2,0,0]=4 545 B11R1.24 CSCOc1cncc(n1)C 974dcf491a63584a8fff5791f598f424 [0,1,1,0,0,0|2,0,0]=4 546 B11R1.24 CSCOc1cncc(n1)Cl 0438bca7d27c54e299bd5461cdb81b57 [0,1,1,0,0,0|2,0,0]=4 547 B11R1.24 Cc1cncc(n1)NCCF ac6504da407ff7537c08ea4064c5deab [0,1,1,0,0,0|2,0,0]=4 548 B11R1.24 Cc1cncc(n1)NCCO 47904cdd5e603ab7a46766f0cec85b7a [0,1,1,0,0,0|2,0,0]=4 549 B11R1.24 Cc1cncc(n1)NCCS 0f4a77c81b11a663e881049b2d52560e [0,1,1,0,0,0|2,0,0]=4 550 B11R1.24 Cc1cncc(n1)OCCS fe7f49dcb404af52f3840c323f3ba068 [0,1,1,0,0,0|2,0,0]=4 551 B11R1.24 FCCNc1cncc(n1)Br ea3d62104793edf28441037e23d0d3b5 [0,1,1,0,0,0|2,0,0]=4 552 B11R1.24 FCCNc1cncc(n1)Cl a93b92196b6b8ebd873774ec43345a69 [0,1,1,0,0,0|2,0,0]=4 553 B11R1.24 FCCNc1cncc(n1)F ce8ecd741dbbd205c6be7c5d83214dfa [0,1,1,0,0,0|2,0,0]=4 554 B11R1.24 FCCOc1cncc(n1)Cl 83344d2ad0f821b369886ad88666e8b8 [0,1,1,0,0,0|2,0,0]=4 555 B11R1.24 FCNCc1cncc(n1)Cl d21696eabe8c510fc2ee737cdf7fae65 [0,1,1,0,0,0|2,0,0]=4 556 B11R1.24 FCOCc1cncc(n1)Br 365786e4d96e95be27f52fa7c1e7f84f [0,1,1,0,0,0|2,0,0]=4 557 B11R1.24 FCOCc1cncc(n1)Cl 947308daaaa712aa8eb3f5f5a8725cf3 [0,1,1,0,0,0|2,0,0]=4 558 B11R1.24 Fc1cncc(n1)NCCBr d515881fcf1ea505e3eb76f242fe7c20 [0,1,1,0,0,0|2,0,0]=4 559 B11R1.24 Fc1cncc(n1)NCCS 89ef0a99712d3166fac3d116c9a5b2ee [0,1,1,0,0,0|2,0,0]=4 560 B11R1.24 OCCNc1cncc(n1)Cl 799745880a45cc81d31dc1ce09de79f1 [0,1,1,0,0,0|2,0,0]=4 561 B11R1.24 OCCNc1cncc(n1)F 4634e670d07b71133aab3bf274471ef4 [0,1,1,0,0,0|2,0,0]=4 562 B11R1.24 OCNCc1cncc(n1)Cl 1a1cdb2f40a47f713f3a31fdbb51dc67 [0,1,1,0,0,0|2,0,0]=4 563 B11R1.24 SCCNc1cncc(n1)Br 3b62e65655a63008d0f502126be12109 [0,1,1,0,0,0|2,0,0]=4 564 B11R1.24 SCCNc1cncc(n1)Cl 32ecf2fc1e01d71dfca7bd9d70814ed3 [0,1,1,0,0,0|2,0,0]=4 565 B11R1.24 SCCOc1cncc(n1)Br e56aea37c76a58f6c94dd61ecbabe368 [0,1,1,0,0,0|2,0,0]=4 566 B11R1.24 SCCOc1cncc(n1)Cl 7bd7e43a4b8265dd81afa87de0a24385 [0,1,1,0,0,0|2,0,0]=4 567 B11R1.28 BrCCNCc1ccccn1 90bb93ff46fc49bde9265b45b65f9d87 [0,1,1,0,0,0|2,0,0]=4 568 B11R1.28 BrCCNCc1cccnc1 a9888ba9b6c914af5c547c17a572df8f [0,1,1,0,0,0|2,0,0]=4 569 B11R1.28 C#CCCNc1cnccn1 70c1d21524b3bdc9f3520b790b2faf0d [0,1,1,0,0,0|0,0,2]=4 570 B11R1.28 C#CCCOc1cnccn1 6b34965dc48df2212b18c19b8085f010 [0,1,1,0,0,0|0,0,2]=4 571 B11R1.28 C#CCNCc1cnccn1 56cca75d363da247ece901a3a2792b88 [0,1,1,0,0,0|0,0,2]=4 572 B11R1.28 C#CCOCc1cnccn1 e6d6a3b2d057948931f2a63a3c31c099 [0,1,1,0,0,0|0,0,2]=4 573 B11R1.28 C/C=C/CNc1cnccn1 5d6aa3ff812a6eaf94686ca08968ea31 [0,1,1,0,0,0|0,0,2]=4 574 B11R1.28 C/C=C/COc1cnccn1 85823c1c6d2023da6588af5580a5caba [0,1,1,0,0,0|0,0,2]=4 575 B11R1.28 C/C=C\CNc1cnccn1 7027c690ceaa69d20b23aebd92f8f62a [0,1,1,0,0,0|0,0,2]=4 576 B11R1.28 C/C=C\COc1cnccn1 c00ea75da659218ea75bb003849efbfc [0,1,1,0,0,0|0,0,2]=4 577 B11R1.28 C=CCCNc1cnccn1 dddc9d6fd83ce426503af94a596f3771 [0,1,1,0,0,0|0,0,2]=4 578 B11R1.28 C=CCCOc1cnccn1 a60c2825e78c17c87f475ea128b8e1ab [0,1,1,0,0,0|0,0,2]=4 579 B11R1.28 C=CCNCc1cnccn1 24cfbc0193223b0523fcef83caaa72f4 [0,1,1,0,0,0|0,0,2]=4 580 B11R1.28 C=CCOCc1cnccn1 0fe8f6b1b5ee2d286128d9df862f343c [0,1,1,0,0,0|0,0,2]=4 581 B11R1.28 CC=CCNc1cnccn1 624a4e385f3a26516887975ae8830dc4 [0,1,1,0,0,0|0,0,2]=4 582 B11R1.28 CCCCNc1ccccc1 178647391839dfbe95aed182d7dc43ba [0,1,1,0,0,0|2,0,0]=4 583 B11R1.28 CCCCNc1ccccn1 91c5e93b79177d6bf2e79f08485f5335 [0,1,1,0,0,0|1,0,0]=3 584 B11R1.28 CCCCNc1cccnc1 b72453a6fd2f6ec63a951a849bd6d4ab [0,1,1,0,0,0|1,0,0]=3 585 B11R1.28 CCCCNc1cccnn1 3dfd51777ba04f9375640c74ab9fa2e6 [0,1,1,0,0,0|2,0,0]=4 586 B11R1.28 CCCCNc1ccncn1 285343aee96e8f045fe913fc70b195a9 [0,1,1,0,0,0|2,0,0]=4 587 B11R1.28 CCCCNc1ccnnc1 ff8398fcae5d1b92f9ec3bc78a562cec [0,1,1,0,0,0|2,0,0]=4 588 B11R1.28 CCCCNc1cnccn1 94ad2094a4d853e068f8fa7ebd18c7ff [0,1,1,0,0,0|0,0,0]=2 589 B11R1.28 CCCCNc1cncnc1 5898f2b85902d6f8660c7182ee3b2170 [0,1,1,0,0,0|2,0,0]=4 590 B11R1.28 CCCCNc1cnncn1 bdd7d665f8c7d76a076d062e16600b45 [0,1,1,0,0,0|1,0,0]=3 591 B11R1.28 CCCCNc1ncccn1 1c9a1ed7a4872dfade79e48decc1fc1d [0,1,1,0,0,0|2,0,0]=4 592 B11R1.28 CCCCNc1nccnn1 560ef2f12eabbad67e6661fe4624d7b9 [0,1,1,0,0,0|1,0,0]=3 593 B11R1.28 CCCCOc1ccccn1 6484ab4f70c598bfd74c056129d64bfe [0,1,1,0,0,0|1,0,0]=3 594 B11R1.28 CCCCOc1cccnc1 5afbbe8f7376fe71bb9dd4caf03cbd91 [0,1,1,0,0,0|1,0,0]=3 595 B11R1.28 CCCCOc1ccnnc1 667207acd2d82bae5786ac94d3b108de [0,1,1,0,0,0|2,0,0]=4 596 B11R1.28 CCCCOc1cnccn1 74c5e85aaa9b94ec4e088971edd3244b [0,1,1,0,0,0|0,0,0]=2 597 B11R1.28 CCCCOc1cncnc1 d754e073f477d30ef4fb9949b36048b9 [0,1,1,0,0,0|2,0,0]=4 598 B11R1.28 CCCCOc1cncnn1 dc395df6bfebd51ae61b86be3230a0bd [0,1,1,0,0,0|1,0,0]=3 599 B11R1.28 CCCCOc1ncccn1 cea963446efaea4e45d8684cc469bd67 [0,1,1,0,0,0|2,0,0]=4 600 B11R1.28 CCCNCc1ccccc1 6e74fa6187fccbc3617e9cc264b3e7aa [0,1,1,0,0,0|2,0,0]=4 601 B11R1.28 CCCNCc1ccccn1 80119cb7f5f54b354b4e2a1110975477 [0,1,1,0,0,0|1,0,0]=3 602 B11R1.28 CCCNCc1cccnc1 bc1eb1c5ec13776685acded27d44c636 [0,1,1,0,0,0|1,0,0]=3 603 B11R1.28 CCCNCc1cccnn1 f9771734910ebcad90f8cb14178ca09d [0,1,1,0,0,0|2,0,0]=4 604 B11R1.28 CCCNCc1ccncn1 4c6d605a0ccf50e124c7a439ea71cca1 [0,1,1,0,0,0|2,0,0]=4 605 B11R1.28 CCCNCc1ccnnc1 f0dc052fccb98d09ed6a02caf7ad77f6 [0,1,1,0,0,0|2,0,0]=4 606 B11R1.28 CCCNCc1cnccn1 c9890f6f5a4e09bed341b3daf3b2c549 [0,1,1,0,0,0|0,0,0]=2 607 B11R1.28 CCCNCc1cncnc1 b63f5b77d0d35d3228827f3601ca0c32 [0,1,1,0,0,0|2,0,0]=4 608 B11R1.28 CCCNCc1ncccn1 9d6cc7b3819df7e77a589192f2bf91c0 [0,1,1,0,0,0|2,0,0]=4 609 B11R1.28 CCCOCc1ccccc1 112c1e14e862b8fbffa225764759b8ec [0,1,1,0,0,0|2,0,0]=4 610 B11R1.28 CCCOCc1ccccn1 a2de9c7a7551b2ca6641b10a888e1203 [0,1,1,0,0,0|1,0,0]=3 611 B11R1.28 CCCOCc1cccnc1 02843d33c5a54d2140670eb60a4dfb7b [0,1,1,0,0,0|1,0,0]=3 612 B11R1.28 CCCOCc1cccnn1 b324e54ae74b0a57b2f9b766e3c0e490 [0,1,1,0,0,0|2,0,0]=4 613 B11R1.28 CCCOCc1ccncn1 c21e413653b185c946f470cd3c989a49 [0,1,1,0,0,0|2,0,0]=4 614 B11R1.28 CCCOCc1ccnnc1 835d98ea225e99027be93ac65a9ecaeb [0,1,1,0,0,0|2,0,0]=4 615 B11R1.28 CCCOCc1cnccn1 2f92d9f2b0d873450f90961d7406570a [0,1,1,0,0,0|0,0,0]=2 616 B11R1.28 CCCOCc1cncnc1 62dd4b6cbce5110705e084fd1f6898a2 [0,1,1,0,0,0|2,0,0]=4 617 B11R1.28 CCCOCc1ncccn1 aded070bc849868bd77e139f41cc86fb [0,1,1,0,0,0|2,0,0]=4 618 B11R1.28 CCNCCc1ccccc1 a4bcdd097e726e04ab2794cdb42f5f71 [0,1,1,0,0,0|2,0,0]=4 619 B11R1.28 CCNCCc1ccccn1 08ffb64a8c703d8e611cb4b81d73ea48 [0,1,1,0,0,0|1,0,0]=3 620 B11R1.28 CCNCCc1cccnc1 4a3a0c73e4e732e57ab84a312bb6bfb2 [0,1,1,0,0,0|1,0,0]=3 621 B11R1.28 CCNCCc1ccncn1 dba79812e975c4d64e5e25d258f9e6a6 [0,1,1,0,0,0|2,0,0]=4 622 B11R1.28 CCNCCc1cnccn1 2497cab3d04dd1dac7aa9e87fb020630 [0,1,1,0,0,0|0,0,0]=2 623 B11R1.28 CCNCCc1ncccn1 8878621879d60c35f5e690c8ce15ae29 [0,1,1,0,0,0|2,0,0]=4 624 B11R1.28 CCOCCc1ccccc1 4c8fc52cc53157c0b0cd10959d18f86a [0,1,1,0,0,0|2,0,0]=4 625 B11R1.28 CCOCCc1ccccn1 0d3553a98e2eb283c6e354f56bb7c09d [0,1,1,0,0,0|1,0,0]=3 626 B11R1.28 CCOCCc1cccnc1 fde9743ce24696d5aa5aa82dfaaaf4a7 [0,1,1,0,0,0|1,0,0]=3 627 B11R1.28 CCOCCc1ccncn1 bedc028f31c05778aab48e9543338256 [0,1,1,0,0,0|2,0,0]=4 628 B11R1.28 CCOCCc1cnccn1 df7cb588e7f62873ee34f1155b413714 [0,1,1,0,0,0|0,0,0]=2 629 B11R1.28 CCOCCc1cncnc1 58c96cb82c933f213a2e027db9cf3e79 [0,1,1,0,0,0|2,0,0]=4 630 B11R1.28 CCOCCc1ncccn1 3fe5ff61de16184188b5260ddcb372ea [0,1,1,0,0,0|2,0,0]=4 631 B11R1.28 CCOCNc1ccccn1 ac3729b96ca810b5bc3bde9ed19bf9fa [0,1,1,0,0,0|2,0,0]=4 632 B11R1.28 CCOCNc1cccnc1 d3b3fa022b30954b0290fed1cdafa77a [0,1,1,0,0,0|2,0,0]=4 633 B11R1.28 CCOCNc1cnccn1 b10f54b02233d2aa203f7b5134c91fdb [0,1,1,0,0,0|1,0,0]=3 634 B11R1.28 CCOCNc1cnncn1 e5079005038cb248c52698839680931f [0,1,1,0,0,0|2,0,0]=4 635 B11R1.28 CCOCNc1nccnn1 e0edc23dfc52a2e559a076a4158c0b6c [0,1,1,0,0,0|2,0,0]=4 636 B11R1.28 CCOCOc1ccccn1 54f1e3cb35931cbfff15b357666888af [0,1,1,0,0,0|2,0,0]=4 637 B11R1.28 CCOCOc1cccnc1 ead2fcc768ce8c5c30053e5139f1a3f8 [0,1,1,0,0,0|2,0,0]=4 638 B11R1.28 CCOCOc1cnccn1 bec42aacd144c9dd6c28b79c769a9705 [0,1,1,0,0,0|1,0,0]=3 639 B11R1.28 COCCNc1ccccn1 89ce959fbd9c09f77faba6fd797cd6ad [0,1,1,0,0,0|2,0,0]=4 640 B11R1.28 COCCNc1cccnc1 3616fb0bfda365de01dc790c24f19ca2 [0,1,1,0,0,0|2,0,0]=4 641 B11R1.28 COCCNc1cnccn1 89a57d49972f4332836b38e03ec7c28e [0,1,1,0,0,0|1,0,0]=3 642 B11R1.28 COCCNc1cncnn1 c62ae06f2077abe7018bf40c5b1f79b5 [0,1,1,0,0,0|2,0,0]=4 643 B11R1.28 COCCNc1cnncn1 8bed46e58ba55a169732af2571e75622 [0,1,1,0,0,0|2,0,0]=4 644 B11R1.28 COCCNc1nccnn1 e6e1e0e57193871e0c93f078772356d3 [0,1,1,0,0,0|2,0,0]=4 645 B11R1.28 COCCOc1ccccn1 c15a0f2a35a14a6120db222de8e43d40 [0,1,1,0,0,0|2,0,0]=4 646 B11R1.28 COCCOc1cccnc1 7d9dde4ce0ac45ab046b208edae409a9 [0,1,1,0,0,0|2,0,0]=4 647 B11R1.28 COCCOc1cnccn1 3195bf44c40b4cfe23cd964d6107e835 [0,1,1,0,0,0|1,0,0]=3 648 B11R1.28 COCCOc1cncnn1 dac8db74ace88b84001640c23c976840 [0,1,1,0,0,0|2,0,0]=4 649 B11R1.28 COCNCc1ccccn1 cb969ddff5a45a0c4df4b7717e547f81 [0,1,1,0,0,0|2,0,0]=4 650 B11R1.28 COCNCc1cccnc1 35b8b6083a32f9db8795c63f618b2f12 [0,1,1,0,0,0|2,0,0]=4 651 B11R1.28 COCNCc1cnccn1 e7da00a079ae82f27242b20b43289b5a [0,1,1,0,0,0|1,0,0]=3 652 B11R1.28 COCOCc1ccccn1 c7e2d466f64f2796a0fb099c19cb65e2 [0,1,1,0,0,0|2,0,0]=4 653 B11R1.28 COCOCc1cccnc1 f4d73442b3dd40c1495fadfe4fccda61 [0,1,1,0,0,0|2,0,0]=4 654 B11R1.28 COCOCc1cnccn1 6fe649a8173b64bf80af621a9eaae369 [0,1,1,0,0,0|1,0,0]=3 655 B11R1.28 CSCCNc1ccccn1 1ebdb7d56171ddc5a7c67867cc88039f [0,1,1,0,0,0|2,0,0]=4 656 B11R1.28 CSCCNc1cccnc1 5c27e85010b1a349b69a05e89d2c3c43 [0,1,1,0,0,0|2,0,0]=4 657 B11R1.28 CSCCNc1cnccn1 9eb52a287cd8fa8fe36dcf6953bf6294 [0,1,1,0,0,0|1,0,0]=3 658 B11R1.28 CSCCNc1cnncn1 8ae61226763cedef35c843b65bce1d0f [0,1,1,0,0,0|2,0,0]=4 659 B11R1.28 CSCCNc1nccnn1 ed4cf6e4f3604c7ae895584f6f1fbf29 [0,1,1,0,0,0|2,0,0]=4 660 B11R1.28 CSCCOc1ccccn1 8b8b6f4f12e2bd5052045e36f5e8d7b9 [0,1,1,0,0,0|2,0,0]=4 661 B11R1.28 CSCCOc1cccnc1 035ac2b2fc138dfaa1d6bea025347e4a [0,1,1,0,0,0|2,0,0]=4 662 B11R1.28 CSCCOc1cnccn1 eddb2cab03b974e07a130b3afd541113 [0,1,1,0,0,0|1,0,0]=3 663 B11R1.28 CSCCOc1cncnn1 8d39701af4984b6d184b031eb3a3179d [0,1,1,0,0,0|2,0,0]=4 664 B11R1.28 CSCNCc1ccccn1 2c467e079eb5903cc68e04796a70abe6 [0,1,1,0,0,0|2,0,0]=4 665 B11R1.28 CSCNCc1cccnc1 3f297bb785f90b40b12fe1a85e9c71ce [0,1,1,0,0,0|2,0,0]=4 666 B11R1.28 CSCNCc1cnccn1 b6d98476646f609643b9e079c1ea699d [0,1,1,0,0,0|1,0,0]=3 667 B11R1.28 CSCOCc1ccccn1 15e9634e2b7543dc2be21ac6d26f304b [0,1,1,0,0,0|2,0,0]=4 668 B11R1.28 CSCOCc1cccnc1 43f679691f8dba66a7e0f36103db118e [0,1,1,0,0,0|2,0,0]=4 669 B11R1.28 CSCOCc1cnccn1 06296d91c838cce0a2774d80459318b9 [0,1,1,0,0,0|1,0,0]=3 670 B11R1.28 ClCCCNc1ccccn1 8bdf4144e9a2a7a9c2cc08aafaf861f1 [0,1,1,0,0,0|2,0,0]=4 671 B11R1.28 ClCCCNc1cccnc1 46d49c887f9c8f9ac001059b66aa76f9 [0,1,1,0,0,0|2,0,0]=4 672 B11R1.28 ClCCCNc1cnccn1 95eb107627969ec22a7382f919b06d14 [0,1,1,0,0,0|1,0,0]=3 673 B11R1.28 FCCCNc1ccccn1 565f4368802921f33e165ca06a4e0884 [0,1,1,0,0,0|2,0,0]=4 674 B11R1.28 FCCCNc1cccnc1 bf0c678c727f753f2416107c8fb7c2aa [0,1,1,0,0,0|2,0,0]=4 675 B11R1.28 FCCCNc1cnccn1 89cb41b624fed856de26c1d3c4db977e [0,1,1,0,0,0|1,0,0]=3 676 B11R1.28 FCCCNc1cnncn1 67d9da37ccd6d3a23c466ba71e120dac [0,1,1,0,0,0|2,0,0]=4 677 B11R1.28 FCCCNc1nccnn1 3d033ac61011ec6dfe466d5f0389ab85 [0,1,1,0,0,0|2,0,0]=4 678 B11R1.28 FCCCOc1ccccn1 cbed731556df3029ce519d57f9054d0b [0,1,1,0,0,0|2,0,0]=4 679 B11R1.28 FCCCOc1cccnc1 c358cc6076a85c51e04e470481f11a56 [0,1,1,0,0,0|2,0,0]=4 680 B11R1.28 FCCCOc1cnccn1 d7f32d87b8dd0b90afb5b2f6bdc7d145 [0,1,1,0,0,0|1,0,0]=3 681 B11R1.28 FCCCOc1cncnn1 f84b3a9a896b3bc1f3ca1e236a2a592d [0,1,1,0,0,0|2,0,0]=4 682 B11R1.28 FCCNCc1ccccn1 4b02ff9e4d9d7623f6691b060ab82228 [0,1,1,0,0,0|2,0,0]=4 683 B11R1.28 FCCNCc1cccnc1 baa596bf0364075f3290f4a60a205b9b [0,1,1,0,0,0|2,0,0]=4 684 B11R1.28 FCCNCc1cnccn1 05b253d67f9070c628b10cb53c6f4f1d [0,1,1,0,0,0|1,0,0]=3 685 B11R1.28 FCCOCc1ccccn1 eeb2239e9027d0ce3a24146b5979566a [0,1,1,0,0,0|2,0,0]=4 686 B11R1.28 FCCOCc1cccnc1 e02a816ea65f063a58402293132849f2 [0,1,1,0,0,0|2,0,0]=4 687 B11R1.28 FCCOCc1cnccn1 d58701cb88fb9b58fb6be6651fc4e38c [0,1,1,0,0,0|1,0,0]=3 688 B11R1.28 FCNCCc1ccccn1 e15d9eaa28b96f67f0199ee7ab918bb8 [0,1,1,0,0,0|2,0,0]=4 689 B11R1.28 FCNCCc1cccnc1 ca44ff0aa2770a7476d8fe29ab7de27f [0,1,1,0,0,0|2,0,0]=4 690 B11R1.28 FCNCCc1cnccn1 a6fff95115e37691aedec5697188885d [0,1,1,0,0,0|1,0,0]=3 691 B11R1.28 FCOCCc1ccccn1 a87eac3bbe6c96cceb2ad793702bad9f [0,1,1,0,0,0|2,0,0]=4 692 B11R1.28 FCOCCc1cccnc1 95fb7ccc93ac5365251261a770f3e438 [0,1,1,0,0,0|2,0,0]=4 693 B11R1.28 FCOCCc1cnccn1 b992c651bab7313204deb41b6e2eb885 [0,1,1,0,0,0|1,0,0]=3 694 B11R1.28 ICCNCc1ccccn1 33a419599dd52be8486dfb89562c6ffa [0,1,1,0,0,0|2,0,0]=4 695 B11R1.28 ICCNCc1cccnc1 7ed4e3e46a4c12f8a4c531489f3ab39c [0,1,1,0,0,0|2,0,0]=4 696 B11R1.28 N#CCCNc1cnccn1 56408d673d0808eb1d453b2b8abfcb9a [0,1,1,0,0,0|1,0,1]=4 697 B11R1.28 N#CCCOc1cnccn1 886f8e5fe9273e000db8f5e449395f21 [0,1,1,0,0,0|1,0,1]=4 698 B11R1.28 N#CCNCc1cnccn1 e88bdbb63dcf8cfd70f3a654b77ff4e0 [0,1,1,0,0,0|1,0,1]=4 699 B11R1.28 N#CCOCc1cnccn1 ac90e51deba64c6460aa9629e3a59894 [0,1,1,0,0,0|1,0,1]=4 700 B11R1.28 NOCCNc1cnccn1 bb456b35dd039c8fd0aa232b7f0c9c37 [0,1,1,0,0,0|2,0,0]=4 701 B11R1.28 O=CCCNc1cnccn1 fe687cbaeeff5bc57114aceb909e83c3 [0,1,1,0,0,0|1,0,1]=4 702 B11R1.28 O=CCCOc1cnccn1 c66353c7d013ed88269a3337cffab1d8 [0,1,1,0,0,0|1,0,1]=4 703 B11R1.28 O=CCNCc1cnccn1 64e87f3a1a44784468df29ec03c2080d [0,1,1,0,0,0|1,0,1]=4 704 B11R1.28 O=CCOCc1cnccn1 989027f70e8c30d5e19e311378e95ebf [0,1,1,0,0,0|1,0,1]=4 705 B11R1.28 O=CNCCc1cnccn1 aa33cad7c82b76f9314494217572508e [0,1,1,0,0,0|1,0,1]=4 706 B11R1.28 OCCCNc1ccccn1 587693fe3960ae4ed00c51618661aeab [0,1,1,0,0,0|2,0,0]=4 707 B11R1.28 OCCCNc1cccnc1 90b07b63ba2da4339e6031d93f7df208 [0,1,1,0,0,0|2,0,0]=4 708 B11R1.28 OCCCNc1cnccn1 394ab3fd80b46dcc8203d15389985779 [0,1,1,0,0,0|1,0,0]=3 709 B11R1.28 OCCCNc1cnncn1 82a90744d3f091f67bc82d039cba59a8 [0,1,1,0,0,0|2,0,0]=4 710 B11R1.28 OCCCNc1nccnn1 5bd6014ecbd097f99153afdf98ebbe7a [0,1,1,0,0,0|2,0,0]=4 711 B11R1.28 OCCNCc1ccccn1 aee8d8851b64ae441b47dd7c19255c9b [0,1,1,0,0,0|2,0,0]=4 712 B11R1.28 OCCNCc1cccnc1 882a81680203d781920d7144e525a6cd [0,1,1,0,0,0|2,0,0]=4 713 B11R1.28 OCCNCc1cnccn1 2ee89dc8c04206d44948d3c79c8e8f8a [0,1,1,0,0,0|1,0,0]=3 714 B11R1.28 OCNCCc1ccccn1 870a6b93d6f817d2b7b76ee4a753e49e [0,1,1,0,0,0|2,0,0]=4 715 B11R1.28 OCNCCc1cccnc1 5a238842d821729331c809bafe95118a [0,1,1,0,0,0|2,0,0]=4 716 B11R1.28 OCNCCc1cnccn1 f4950c420442047f83981ab203d27aa5 [0,1,1,0,0,0|1,0,0]=3 717 B11R1.28 SCCCNc1ccccn1 6e9255137fb1e7130c483b51e209e603 [0,1,1,0,0,0|2,0,0]=4 718 B11R1.28 SCCCNc1cccnc1 9d7b88e69ec7c6b34ca7771b6e0b91e4 [0,1,1,0,0,0|2,0,0]=4 719 B11R1.28 SCCCNc1cnccn1 272fd3f48e11eac14ab86db0420f1e23 [0,1,1,0,0,0|1,0,0]=3 720 B11R1.28 SCCCNc1cnncn1 c11514a0f494cb68aad1b0f533866281 [0,1,1,0,0,0|2,0,0]=4 721 B11R1.28 SCCCNc1nccnn1 bba1a670685ba593dea01351476de250 [0,1,1,0,0,0|2,0,0]=4 722 B11R1.28 SCCCOc1ccccn1 a6c411fcae0c9e021a422469b3fdfe87 [0,1,1,0,0,0|2,0,0]=4 723 B11R1.28 SCCCOc1cccnc1 134743f8f7a869616fe16d61afd2d0e6 [0,1,1,0,0,0|2,0,0]=4 724 B11R1.28 SCCCOc1cnccn1 49e064e5a2490e0ef11744b13f45f2e7 [0,1,1,0,0,0|1,0,0]=3 725 B11R1.28 SCCCOc1cncnn1 017d5cc125823e9de2bbe6922fc2458f [0,1,1,0,0,0|2,0,0]=4 726 B11R1.28 SCCNCc1ccccn1 ace948b27200a431fbd41a7ba53deb87 [0,1,1,0,0,0|2,0,0]=4 727 B11R1.28 SCCNCc1cccnc1 8ab6cc5726329dc3b917c71b0e8e3a12 [0,1,1,0,0,0|2,0,0]=4 728 B11R1.28 SCCNCc1cnccn1 229e48027f123997f1a159293a108938 [0,1,1,0,0,0|1,0,0]=3 729 B11R1.28 SCCOCc1ccccn1 922bd68bb819886f081031e9f73951e2 [0,1,1,0,0,0|2,0,0]=4 730 B11R1.28 SCCOCc1cccnc1 c1c52e309e8814a28fb8d713bda79484 [0,1,1,0,0,0|2,0,0]=4 731 B11R1.28 SCCOCc1cnccn1 263e375ea74000ad515cd81e03dc4781 [0,1,1,0,0,0|1,0,0]=3 732 B11R1.40 CC(CO)Nc1cnccn1 bca12c198f8b3dcf3474883c473e477a [0,1,1,0,0,0|2,0,0]=4 733 B11R1.40 CCC(=O)Nc1cnccn1 e2ac897815fa11a06d867bf7943d000f [0,1,1,0,0,0|1,0,1]=4 734 B11R1.40 CCC(C)Nc1ccccn1 bb895d27f1d9ed94ab4cd5f93b01f0bd [0,1,1,0,0,0|2,0,0]=4 735 B11R1.40 CCC(C)Nc1cccnc1 a0e745f4d44915557790daf72381f523 [0,1,1,0,0,0|2,0,0]=4 736 B11R1.40 CCC(C)Nc1cnccn1 218f39b97d2fc8b56d7c106256492dff [0,1,1,0,0,0|1,0,0]=3 737 B11R1.40 CCC(C)Nc1cnncn1 b4ae1832d341449951660973d36dd2a7 [0,1,1,0,0,0|2,0,0]=4 738 B11R1.40 CCC(C)Nc1nccnn1 7aafbe768b9876c6c10b1c269bfe3a67 [0,1,1,0,0,0|2,0,0]=4 739 B11R1.40 CCC(C)Oc1ccccn1 b8b4a806c6af90298cf0d1454fda0647 [0,1,1,0,0,0|2,0,0]=4 740 B11R1.40 CCC(C)Oc1cccnc1 ea8ea3a935f9f1da0dc64162c872e010 [0,1,1,0,0,0|2,0,0]=4 741 B11R1.40 CCC(C)Oc1cnccn1 259d43a94fcc1396cf4ed5279619bad5 [0,1,1,0,0,0|1,0,0]=3 742 B11R1.40 CCC(C)Oc1cncnn1 c022991dbc7528d89b1ea0e28f6ee210 [0,1,1,0,0,0|2,0,0]=4 743 B11R1.40 CCN(C)Cc1ccccn1 e347cf6623c9ce49a1c94570b5d3844c [0,1,1,0,0,0|2,0,0]=4 744 B11R1.40 CCN(C)Cc1cccnc1 69e9bc72fe902e2c097b1bc797c43254 [0,1,1,0,0,0|2,0,0]=4 745 B11R1.40 CCN(C)Cc1cnccn1 13139f85f2c80541c7a741660f0206e2 [0,1,1,0,0,0|1,0,0]=3 746 B11R1.40 CC[C@@H](C)Nc1cccnc1 d5c354fec9aa4824593a6aa370b31f97 [0,1,1,0,0,0|2,0,0]=4 747 B11R1.40 CC[C@H](C)Nc1cccnc1 a188aeb369243191dc243d4fb98ce075 [0,1,1,0,0,0|2,0,0]=4 748 B11R1.40 CN(CF)Cc1cnccn1 d828fc4f5274d45411baef854e240efe [0,1,1,0,0,0|2,0,0]=4 749 B11R1.40 CN(CO)Cc1cnccn1 2612be83cbdd1e0199b6ab3c39c473bd [0,1,1,0,0,0|2,0,0]=4 750 B11R1.40 C[C@@H](CO)Nc1cnccn1 54f606e098d7069b6301fbd7ff24023c [0,1,1,0,0,0|2,0,0]=4 751 B11R1.40 C[C@H](CO)Nc1cnccn1 ad67c5623bc833af0ed62e39411a7055 [0,1,1,0,0,0|2,0,0]=4 752 B11R1.91 C=C(C)CNc1cnccn1 d0a9ee6c6179d7f99dc86f8b5699859d [0,1,1,0,0,0|1,0,1]=4 753 B11R1.91 C=C(C)COc1cnccn1 75b8877c41b529e2d05c6c78734c83aa [0,1,1,0,0,0|1,0,1]=4 754 B11R1.91 CC(=O)CNc1cnccn1 f505fd1e568103e89908ef11d0b9c40c [0,1,1,0,0,0|1,0,1]=4 755 B11R1.91 CC(=O)NCc1cnccn1 3bc7c046654e0b52f0e8fd5e1c64219d [0,1,1,0,0,0|1,0,1]=4 756 B11R1.91 CC(C)CNc1ccccn1 7b009ca04377ecc13f70ec3cf4ebfeda [0,1,1,0,0,0|2,0,0]=4 757 B11R1.91 CC(C)CNc1cccnc1 872c17275baf8dfc3e3fcfc1c6e8b0aa [0,1,1,0,0,0|2,0,0]=4 758 B11R1.91 CC(C)CNc1cnccn1 95ddfe6d68910c614f0cbdfaa85d0133 [0,1,1,0,0,0|1,0,0]=3 759 B11R1.91 CC(C)CNc1cnncn1 077dd4520b9c00d9ebe6adb526b19946 [0,1,1,0,0,0|2,0,0]=4 760 B11R1.91 CC(C)CNc1nccnn1 4d09253906936b3597d33f009e5aae20 [0,1,1,0,0,0|2,0,0]=4 761 B11R1.91 CC(C)COc1ccccn1 7b0823f232ca75667ab72b773cf2055c [0,1,1,0,0,0|2,0,0]=4 762 B11R1.91 CC(C)COc1cccnc1 639764ab0bac28311f80a0c1092bb51e [0,1,1,0,0,0|2,0,0]=4 763 B11R1.91 CC(C)COc1cnccn1 fca5516fc8fc749e126db826ec1364f8 [0,1,1,0,0,0|1,0,0]=3 764 B11R1.91 CC(C)COc1cncnn1 a6933c9df608223011362944059fe81f [0,1,1,0,0,0|2,0,0]=4 765 B11R1.91 CC(C)NCc1ccccn1 856545f5d02de0038284fed0716bf52b [0,1,1,0,0,0|2,0,0]=4 766 B11R1.91 CC(C)NCc1cccnc1 f83c1668bc1a0795e6062eecd9dab4fd [0,1,1,0,0,0|2,0,0]=4 767 B11R1.91 CC(C)NCc1cnccn1 320d7f2d7b3c9da90f951a37d43af864 [0,1,1,0,0,0|1,0,0]=3 768 B11R1.91 CC(C)OCc1ccccn1 0763eb944dcd10bf40a6049a3281f0fa [0,1,1,0,0,0|2,0,0]=4 769 B11R1.91 CC(C)OCc1cccnc1 15bee2bbdfea4851383d51503cc56958 [0,1,1,0,0,0|2,0,0]=4 770 B11R1.91 CC(C)OCc1cnccn1 e68303144f36400499d51e9b07ed6d5f [0,1,1,0,0,0|1,0,0]=3 771 B11R1.91 CC(O)CNc1ccccn1 0b02a9fc805d3fdc80aa58b252d76fac [0,1,1,0,0,0|2,0,0]=4 772 B11R1.91 CC(O)CNc1cccnc1 be948b4ea22210c06fa11f5ff0c44d9b [0,1,1,0,0,0|2,0,0]=4 773 B11R1.91 CC(O)CNc1cnccn1 f991222b12e39f41fc4f22d1360207a1 [0,1,1,0,0,0|1,0,0]=3 774 B11R1.91 CC(O)CNc1cnncn1 e9d744d012cb875341a25fa1c5edb17d [0,1,1,0,0,0|2,0,0]=4 775 B11R1.91 CC(O)CNc1nccnn1 079966ed897e1488fdb5a48945dead87 [0,1,1,0,0,0|2,0,0]=4 776 B11R1.91 CN(C)CNc1cnccn1 b2e8bec18797b7bb28e6e20f5edf5e23 [0,1,1,0,0,0|2,0,0]=4 777 B11R1.91 CN(C)COc1cnccn1 0bc79da095c240b1e1f95a99c0285d93 [0,1,1,0,0,0|2,0,0]=4 778 B11R1.91 C[C@@H](O)CNc1ccccn1 2f50c5c35f8b03d00f3a417683f2e1c8 [0,1,1,0,0,0|2,0,0]=4 779 B11R1.91 C[C@@H](O)CNc1cccnc1 0269da8e8da5f2bc75323d1a7b31953c [0,1,1,0,0,0|2,0,0]=4 780 B11R1.91 C[C@@H](O)CNc1cnccn1 eefedac70fb9e61b84978ca5f31e1024 [0,1,1,0,0,0|1,0,0]=3 781 B11R1.91 C[C@@H](O)CNc1cnncn1 ec8f16affeeb15fca88b483b81b727bd [0,1,1,0,0,0|2,0,0]=4 782 B11R1.91 C[C@@H](O)CNc1nccnn1 97fdbd1b5c4939a91b3631c209d843d4 [0,1,1,0,0,0|2,0,0]=4 783 B11R1.91 C[C@H](O)CNc1ccccn1 b5e1e178b39afd2578578a870577034a [0,1,1,0,0,0|2,0,0]=4 784 B11R1.91 C[C@H](O)CNc1cccnc1 13f963f21a32ff7cb405ad7d76f40567 [0,1,1,0,0,0|2,0,0]=4 785 B11R1.91 C[C@H](O)CNc1cnccn1 8436b233d47376aa6994f036c7608979 [0,1,1,0,0,0|1,0,0]=3 786 B11R1.91 C[C@H](O)CNc1cnncn1 70a6f470a69e2478a941d74a578a283f [0,1,1,0,0,0|2,0,0]=4 787 B11R1.91 C[C@H](O)CNc1nccnn1 4aeacf9a97ea5933405c1b517f46e8ff [0,1,1,0,0,0|2,0,0]=4 788 B11R1.91 FC(F)CNc1cnccn1 044391ced47c9eaa868f2d3136bc246e [0,1,1,0,0,0|2,0,0]=4 789 B11R1.91 FC(F)COc1cnccn1 a08431a794976ce612934d8b1139152d [0,1,1,0,0,0|2,0,0]=4 790 B11R1.41 C#Cc1nccnc1NCC 814056e9040ec9d750e1f56bb3f325ae [0,1,1,0,0,0|0,0,2]=4 791 B11R1.41 CCNc1cccnc1CC 4f4b575e131b0479c2e59b3a14179001 [0,1,1,0,0,0|1,0,0]=3 792 B11R1.41 CCNc1cccnc1CCl c6d62a3683a935723c4144e31f930a92 [0,1,1,0,0,0|2,0,0]=4 793 B11R1.41 CCNc1cccnc1CO 7f7012eab9ad261463e30449d846f6d1 [0,1,1,0,0,0|2,0,0]=4 794 B11R1.41 CCNc1cccnc1OC 6c16951aa28eb8640f69e778236dcc64 [0,1,1,0,0,0|2,0,0]=4 795 B11R1.41 CCNc1cncnc1CC feddd09e0bd4a20ccfcf16249e4283f9 [0,1,1,0,0,0|2,0,0]=4 796 B11R1.41 CCNc1ncccc1CC 86f1aca5e9b7451ffcff7846ea8be432 [0,1,1,0,0,0|1,0,0]=3 797 B11R1.41 CCNc1ncccc1CCl d6359fa04219dbb49be3e0249bb24c6a [0,1,1,0,0,0|2,0,0]=4 798 B11R1.41 CCNc1ncccc1CO db617cee5148168fe31815bf4dd081c0 [0,1,1,0,0,0|2,0,0]=4 799 B11R1.41 CCNc1ncccc1OC e11a6d486ebd6d3676b1c4bdb22a578b [0,1,1,0,0,0|2,0,0]=4 800 B11R1.41 CCNc1ncccc1SC b7dccf5a75922163ebbd2a1ff2b4440e [0,1,1,0,0,0|2,0,0]=4 801 B11R1.41 CCNc1nccnc1C#N f582a533128143b12ed7aa1ca79be747 [0,1,1,0,0,0|1,0,1]=4 802 B11R1.41 CCNc1nccnc1C=O c7e35837c65b46e7218e074b67e54192 [0,1,1,0,0,0|1,0,1]=4 803 B11R1.41 CCNc1nccnc1CC e07e25d7d6008e66a997d60209a22bf4 [0,1,1,0,0,0|0,0,0]=2 804 B11R1.41 CCNc1nccnc1CO 2c7722c380df68d22bd2841f9b891007 [0,1,1,0,0,0|1,0,0]=3 805 B11R1.41 CCNc1nccnc1OC 3dc342deca17865f68170508aef23954 [0,1,1,0,0,0|1,0,0]=3 806 B11R1.41 CCOc1ccccc1CC c0cbeca9621d471e16db2adc053bd410 [0,1,1,0,0,0|2,0,0]=4 807 B11R1.41 CCOc1cccnc1CC c989c2c26e1ed5cf83633d96ad9aa2bc [0,1,1,0,0,0|1,0,0]=3 808 B11R1.41 CCOc1cccnc1OC 7bbc4184d60a18d7ecb599265150ad82 [0,1,1,0,0,0|2,0,0]=4 809 B11R1.41 CCOc1ncccc1CC 36d68d57d658301e72d95866a9d02ecb [0,1,1,0,0,0|1,0,0]=3 810 B11R1.41 CCOc1ncncc1CC f9d00ceb6a665a377ca43f4debd0d8bf [0,1,1,0,0,0|2,0,0]=4 811 B11R1.41 CCc1cccnc1NCF 79b98f3f645739e3c8c0183d036baaed [0,1,1,0,0,0|2,0,0]=4 812 B11R1.41 CCc1cccnc1NCO 79e2d22cdb818b54f97165c9e9ff1a7b [0,1,1,0,0,0|2,0,0]=4 813 B11R1.41 CCc1cccnc1OCF 3eefab2b48a89bee2b2b93a0e9133bfc [0,1,1,0,0,0|2,0,0]=4 814 B11R1.41 CCc1ncccc1NCO 8def9462b4d3408652c8d04c365636b2 [0,1,1,0,0,0|2,0,0]=4 815 B11R1.41 CCc1ncccc1OCF f627c6330784b0d07ff7a1315ca5f79c [0,1,1,0,0,0|2,0,0]=4 816 B11R1.41 CCc1nccnc1NC#N 538851f22aa1a28eb82b45007807b07f [0,1,1,0,0,0|1,0,1]=4 817 B11R1.41 CCc1nccnc1NC=O 619ab142ddd8ffd8cc79e691509afd80 [0,1,1,0,0,0|1,0,1]=4 818 B11R1.41 CCc1nccnc1NCF 486115acda7d734983e0b13818ef236f [0,1,1,0,0,0|1,0,0]=3 819 B11R1.41 CCc1nccnc1NCO 2ac635d3f17a2c0c22976fdb1330769b [0,1,1,0,0,0|1,0,0]=3 820 B11R1.41 COc1nccnc1NCF 8c29c411549f717b4155c0bd1106d0ac [0,1,1,0,0,0|2,0,0]=4 821 B11R1.41 COc1nccnc1NCO 4679584531f3e420c46cede4443d9182 [0,1,1,0,0,0|2,0,0]=4 822 B11R1.41 OCNc1nccnc1CO 41e786d7fc5e3d1c90268722c5ac1f17 [0,1,1,0,0,0|2,0,0]=4 823 B11R1.41 OCc1nccnc1NCF 9ff477a45116bc2eac317a0b9773e85c [0,1,1,0,0,0|2,0,0]=4 824 B11R2.191 CCN1CCn2c1ccn2 9e78d5a87d61b8ea3372a8dd69f1e5c0 [0,1,0,0,1,0|2,0,0]=4 825 B11R2.191 CCN1CCn2c1ncc2 775632a8104bb09a5ce83a4884274c22 [0,1,0,0,1,0|2,0,0]=4 826 B11R2.191 FCN1CCn2c1ccn2 ccbc74f7af12b4731b14c40afd3bef58 [0,1,0,0,1,0|2,0,0]=4 827 B11R2.191 FCN1CCn2c1ncc2 def8e676a80c458d68f4e9a9a04be957 [0,1,0,0,1,0|2,0,0]=4 828 B11R2.191 OCN1CCn2c1ccn2 1202e0831bc31e34fceba4b238d3e09f [0,1,0,0,1,0|2,0,0]=4 829 B11R2.191 OCN1CCn2c1ncc2 0caff1d9f7e9970d2651e91beae9a3c0 [0,1,0,0,1,0|2,0,0]=4 830 B13R2.57 CCN1CCc2cccnc2C1 160eb86c6c9eb49a0fb1a941d9d819bb [0,1,0,0,0,1|2,0,0]=4 831 B13R2.57 CCN1CCc2ncccc2C1 2449173e173d150dc402eb195871d698 [0,1,0,0,0,1|2,0,0]=4 832 B13R2.57 CCN1CCc2nccnc2C1 09580c921c955e79c21a72d2bdb8edfa [0,1,0,0,0,1|1,0,0]=3 833 B13R2.57 FCN1CCc2cccnc2C1 b8262f17c9287d9a4bbe4f9d71d2b8f9 [0,1,0,0,0,1|2,0,0]=4 834 B13R2.57 FCN1CCc2ncccc2C1 c2f3938450f3656d2e9059f57ccf27fa [0,1,0,0,0,1|2,0,0]=4 835 B13R2.57 FCN1CCc2nccnc2C1 178a1ea3d04d2f29fc884e42e7ee97ae [0,1,0,0,0,1|1,0,0]=3 836 B13R2.57 O=CN1CCc2nccnc2C1 c18611b598be9c18e6455a5e6a1dfa8c [0,1,0,0,0,1|1,0,1]=4 837 B13R2.57 OCN1CCc2cccnc2C1 89c2754128e6c90c44f538a3649ab259 [0,1,0,0,0,1|2,0,0]=4 838 B13R2.57 OCN1CCc2ncccc2C1 2b25c768df1338c2684f5a58055fb958 [0,1,0,0,0,1|2,0,0]=4 839 B13R2.57 OCN1CCc2nccnc2C1 86f4f242be5b168a11781aa8f7bf8806 [0,1,0,0,0,1|1,0,0]=3 840 B13R2.1613 CCN1CCCc2c1cccn2 91f020e516095b0875f3f56b601d3d59 [0,1,0,0,0,1|2,0,0]=4 841 B13R2.1613 CCN1CCCc2c1nccc2 515a0cca732104e386c736bc99c21ff5 [0,1,0,0,0,1|2,0,0]=4 842 B13R2.1613 CCN1CCOc2c1cccn2 a3f3c344bf9d41252eda7f608567705d [0,1,0,0,0,1|2,0,0]=4 843 B13R2.1613 CCN1CCOc2c1nccc2 8b97dfdc1b202f59fd544b1b8add5e9f [0,1,0,0,0,1|2,0,0]=4 844 B13R2.1613 CCN1CCSc2c1cccn2 b82a1195e9fd304fd5340226f679a323 [0,1,0,0,0,1|2,0,0]=4 845 B13R2.1613 FCN1CCCc2c1cccn2 777776ee94d600732d33433523defa1c [0,1,0,0,0,1|2,0,0]=4 846 B13R2.1613 FCN1CCCc2c1nccc2 b64eb6488247ff8dcaac9756f56850db [0,1,0,0,0,1|2,0,0]=4 847 B13R2.1613 FCN1CCOc2c1cccn2 b112fd7bc64fb0fca6134d1c0293ee6f [0,1,0,0,0,1|2,0,0]=4 848 B13R2.1613 FCN1CCOc2c1nccc2 e3734d978f6dc61d2980be5a6e9c83b0 [0,1,0,0,0,1|2,0,0]=4 849 B13R2.1613 FCN1CCSc2c1cccn2 582f07cc4daeb627a8d971d6d7eb6bea [0,1,0,0,0,1|2,0,0]=4 850 B13R2.1613 OCN1CCCc2c1cccn2 0ae2cd4133a645443e1816bcef44fb80 [0,1,0,0,0,1|2,0,0]=4 851 B13R2.1613 OCN1CCCc2c1nccc2 d17935420481d3030910ec38a6cfe9f3 [0,1,0,0,0,1|2,0,0]=4 852 B13R2.1613 OCN1CCOc2c1cccn2 a5c75ca0e2350931354849a9b9917444 [0,1,0,0,0,1|2,0,0]=4 853 B13R2.1613 OCN1CCOc2c1nccc2 7428f5fc5e451e7fa08154770c8b5331 [0,1,0,0,0,1|2,0,0]=4 854 B13R2.1613 OCN1CCSc2c1cccn2 e41ca1881149aba96df4f49b8525c70d [0,1,0,0,0,1|2,0,0]=4 855 B13R2.1 C#CCN1CCc2c1cccn2 d3cb51cb5cce10233825871f656d307f [0,2,0,0,0,0|2,0,0]=4 856 B13R2.1 C#CCN1CCc2c1nccc2 2084d996b3d35a634f38ed927a9c36c1 [0,2,0,0,0,0|2,0,0]=4 857 B13R2.1 C#CCN1CCc2c1nccn2 2831dfe2313e22e37c63635ae503b09f [0,2,0,0,0,0|1,0,0]=3 858 B13R2.1 C=CCN1CCc2c1cccn2 ab4dd48f8b03bd190fda2e73575619e0 [0,2,0,0,0,0|2,0,0]=4 859 B13R2.1 C=CCN1CCc2c1nccc2 0ccfe1cd8c1c7cb21bed61e3e1197bb4 [0,2,0,0,0,0|2,0,0]=4 860 B13R2.1 C=CCN1CCc2c1nccn2 b711bb22a1ac6f525c8b184a71e465b4 [0,2,0,0,0,0|1,0,0]=3 861 B13R2.1 CCCN1CCc2c1cccn2 1db857eceba67d82bc1cf19a8f34bf48 [0,2,0,0,0,0|2,0,0]=4 862 B13R2.1 CCCN1CCc2c1nccc2 10767a9047d37830e846b7ba1b507cb7 [0,2,0,0,0,0|2,0,0]=4 863 B13R2.1 CCCN1CCc2c1nccn2 cbbfb9c78851d336bf3dc3ff863681aa [0,2,0,0,0,0|1,0,0]=3 864 B13R2.1 CCNC1CCc2c1cccc2 a2f9a7034c524e36dce9da570b8eed38 [0,2,0,0,0,0|2,0,0]=4 865 B13R2.1 CCNC1CCc2c1cccn2 b3b2e90c68f62fb1ac1e2f62a18647d5 [0,2,0,0,0,0|1,0,0]=3 866 B13R2.1 CCNC1CCc2c1nccc2 2d5979d9df982eff9cb602abe8f6fdd4 [0,2,0,0,0,0|1,0,0]=3 867 B13R2.1 CCNC1COc2c1cccn2 5f79db25effbb04df968bf0898ffe111 [0,2,0,0,0,0|2,0,0]=4 868 B13R2.1 CCN[C@@H]1CCc2c1cccc2 5aed7c7d3dcee97baa206f32f1362e41 [0,2,0,0,0,0|2,0,0]=4 869 B13R2.1 CCN[C@@H]1CCc2c1cccn2 dfbe01a2bcf28fefda2d3faef7d66293 [0,2,0,0,0,0|1,0,0]=3 870 B13R2.1 CCN[C@H]1CCc2c1cccc2 f19fd7a3a0767a9c0a83a9bd087dc982 [0,2,0,0,0,0|2,0,0]=4 871 B13R2.1 CCN[C@H]1CCc2c1cccn2 377b65ef739f583520e4d6dcfffb9079 [0,2,0,0,0,0|1,0,0]=3 872 B13R2.1 CCOC1CCc2c1cccc2 0a564ddb836ef50c1bf85fb2687fd49d [0,2,0,0,0,0|2,0,0]=4 873 B13R2.1 CCOC1CCc2c1cccn2 c6c0f5cd67dfc92d9347f34d8def883b [0,2,0,0,0,0|1,0,0]=3 874 B13R2.1 CCOC1CCc2c1nccc2 46712bc3b3957fef0d0bc81ccd2508cf [0,2,0,0,0,0|1,0,0]=3 875 B13R2.1 CCOC1COc2c1cccn2 7db7034ef22074140fa8502d3ed3aba8 [0,2,0,0,0,0|2,0,0]=4 876 B13R2.1 CCO[C@@H]1CCc2c1cccc2 d45cdcdf972d77a1482368de502027ba [0,2,0,0,0,0|2,0,0]=4 877 B13R2.1 CCO[C@@H]1CCc2c1cccn2 739a4562b2841b730dd2ec77ecb5597d [0,2,0,0,0,0|1,0,0]=3 878 B13R2.1 CCO[C@@H]1CCc2c1nccc2 d9478c8d6e3fa6b9f56b689a5a2f4ea9 [0,2,0,0,0,0|1,0,0]=3 879 B13R2.1 CCO[C@H]1CCc2c1cccc2 9fc25a59177ef73a2d9f07d6b3cf667c [0,2,0,0,0,0|2,0,0]=4 880 B13R2.1 CCO[C@H]1CCc2c1cccn2 7a0c9d9931ea97de8e992f51b791ed97 [0,2,0,0,0,0|1,0,0]=3 881 B13R2.1 CCO[C@H]1CCc2c1nccc2 49fc56ef3be913f89d886a0adc99dfba [0,2,0,0,0,0|1,0,0]=3 882 B13R2.1 COCN1CCc2c1cccn2 4f5fd1b6836b12cfdbda021487c79c4f [0,2,0,0,0,0|2,0,0]=4 883 B13R2.1 COCN1CCc2c1nccc2 4bb3bb987d5963e03f7854edbd04af49 [0,2,0,0,0,0|2,0,0]=4 884 B13R2.1 COCN1CCc2c1nccn2 c50ad1e855d62508624ac5fa41189a7e [0,2,0,0,0,0|1,0,0]=3 885 B13R2.1 CSCN1CCc2c1cccn2 ea64c59aa01f298f36e82d2f788dd00e [0,2,0,0,0,0|2,0,0]=4 886 B13R2.1 CSCN1CCc2c1nccc2 60c1d660946f2bfa593227f3f9cbffe6 [0,2,0,0,0,0|2,0,0]=4 887 B13R2.1 CSCN1CCc2c1nccn2 323c142ca8bd22de6b5bdb576ef306b0 [0,2,0,0,0,0|1,0,0]=3 888 B13R2.1 FCCN1CCc2c1cccn2 47f3a55426a81e65f70a939a3eb2cd35 [0,2,0,0,0,0|2,0,0]=4 889 B13R2.1 FCCN1CCc2c1nccc2 f84fed7986e4c53ec920747f8ee7bfa4 [0,2,0,0,0,0|2,0,0]=4 890 B13R2.1 FCCN1CCc2c1nccn2 91ed380a0e62265fc556a735a3587358 [0,2,0,0,0,0|1,0,0]=3 891 B13R2.1 FCNC1CCc2c1cccc2 103eb8093388b5304c3d889b2159e580 [0,2,0,0,0,0|2,0,0]=4 892 B13R2.1 FCNC1CCc2c1cccn2 65500a1e299aeba7d35987dab434c71c [0,2,0,0,0,0|1,0,0]=3 893 B13R2.1 FCNC1CCc2c1nccc2 84fe8dbf067646183b5e4bce341e3e00 [0,2,0,0,0,0|1,0,0]=3 894 B13R2.1 FCNC1COc2c1cccn2 18df408466a3318a00a1a01445f83ef9 [0,2,0,0,0,0|2,0,0]=4 895 B13R2.1 FCN[C@@H]1CCc2c1cccc2 80f4a364666628aaed4078d05ba64d81 [0,2,0,0,0,0|2,0,0]=4 896 B13R2.1 FCN[C@@H]1CCc2c1cccn2 fd2bf79e1015495a188ecc4cbb93174f [0,2,0,0,0,0|1,0,0]=3 897 B13R2.1 FCN[C@H]1CCc2c1cccc2 e2bc57269246b588ccdae838b66bcdab [0,2,0,0,0,0|2,0,0]=4 898 B13R2.1 FCN[C@H]1CCc2c1cccn2 885e10c327e51bb62f2c05713f94a754 [0,2,0,0,0,0|1,0,0]=3 899 B13R2.1 FCOC1CCc2c1cccc2 220ffcfcb17950e6863e8cf7c77f0e80 [0,2,0,0,0,0|2,0,0]=4 900 B13R2.1 FCOC1CCc2c1cccn2 8d2431df3fa165c464921c4c9b505418 [0,2,0,0,0,0|1,0,0]=3 901 B13R2.1 FCOC1CCc2c1nccc2 ee7af43b956b32c2730a27b2f7d46a96 [0,2,0,0,0,0|1,0,0]=3 902 B13R2.1 FCOC1COc2c1cccn2 c146a4e48e7b634585ae33dc8c475431 [0,2,0,0,0,0|2,0,0]=4 903 B13R2.1 FCO[C@@H]1CCc2c1cccc2 b81c2aa02363e23e2aa7fd5b72680552 [0,2,0,0,0,0|2,0,0]=4 904 B13R2.1 FCO[C@@H]1CCc2c1cccn2 2eb2a346635122374af5fba1b76db14e [0,2,0,0,0,0|1,0,0]=3 905 B13R2.1 FCO[C@@H]1CCc2c1nccc2 3eae3d078c920eaf10c57e2c4f31cd3f [0,2,0,0,0,0|1,0,0]=3 906 B13R2.1 FCO[C@H]1CCc2c1cccc2 f0246c395c555c6bc0fc361803df6be2 [0,2,0,0,0,0|2,0,0]=4 907 B13R2.1 FCO[C@H]1CCc2c1cccn2 88dd3fc1edc745f1a691f7f8debd8268 [0,2,0,0,0,0|1,0,0]=3 908 B13R2.1 FCO[C@H]1CCc2c1nccc2 1483d0d60c2910495ba3eaedf065222a [0,2,0,0,0,0|1,0,0]=3 909 B13R2.1 N#CCN1CCc2c1cccn2 3da14a8ed670e76c42f1f59dcf7c26ce [0,2,0,0,0,0|2,0,0]=4 910 B13R2.1 N#CCN1CCc2c1nccc2 558a9d1e525263a81e313c31ba8e08d7 [0,2,0,0,0,0|2,0,0]=4 911 B13R2.1 N#CCN1CCc2c1nccn2 59d2e00e807968045331161f6e08ec90 [0,2,0,0,0,0|1,0,0]=3 912 B13R2.1 O=CCN1CCc2c1cccn2 89990832e33d93cf74817c449dd4c659 [0,2,0,0,0,0|2,0,0]=4 913 B13R2.1 O=CCN1CCc2c1nccc2 0e221b69d263d9f771aa35d60cfd7298 [0,2,0,0,0,0|2,0,0]=4 914 B13R2.1 O=CCN1CCc2c1nccn2 1b90a5e2f47bb123b37c43f78387e9e1 [0,2,0,0,0,0|1,0,0]=3 915 B13R2.1 O=CNC1CCc2c1cccn2 ddfb6bd05eb47a61156db8243f90f75b [0,2,0,0,0,0|1,0,1]=4 916 B13R2.1 O=CNC1CCc2c1nccc2 959ba76c57fd66cdd9cd46e919a87adb [0,2,0,0,0,0|1,0,1]=4 917 B13R2.1 O=CN[C@@H]1CCc2c1cccn2 7762682a2e9133aa38422f608642f459 [0,2,0,0,0,0|1,0,1]=4 918 B13R2.1 O=CN[C@H]1CCc2c1cccn2 edd5838a867407c5fd356ce800d508c4 [0,2,0,0,0,0|1,0,1]=4 919 B13R2.1 OCCN1CCc2c1cccn2 6571c7532817bb33f872175dc5e9c927 [0,2,0,0,0,0|2,0,0]=4 920 B13R2.1 OCCN1CCc2c1nccc2 9250335ff3e92326d06256a35a67f935 [0,2,0,0,0,0|2,0,0]=4 921 B13R2.1 OCCN1CCc2c1nccn2 a757e554c173ff5f1ebb52279d2d6207 [0,2,0,0,0,0|1,0,0]=3 922 B13R2.1 OCNC1CCc2c1cccc2 68947de79947f48a5d80c9a9590ab777 [0,2,0,0,0,0|2,0,0]=4 923 B13R2.1 OCNC1CCc2c1cccn2 55db694eefad1dbd2ad306b99edfa53c [0,2,0,0,0,0|1,0,0]=3 924 B13R2.1 OCNC1CCc2c1nccc2 f1d406249594b336ec75de0b9acf1c38 [0,2,0,0,0,0|1,0,0]=3 925 B13R2.1 OCNC1COc2c1cccn2 be056dec23f5145bed9d6c59832548d4 [0,2,0,0,0,0|2,0,0]=4 926 B13R2.1 OCN[C@@H]1CCc2c1cccc2 6205c97f0245589d6d4ddfad23eea2a6 [0,2,0,0,0,0|2,0,0]=4 927 B13R2.1 OCN[C@@H]1CCc2c1cccn2 fb36946e03810824aa4d0aebe93c4067 [0,2,0,0,0,0|1,0,0]=3 928 B13R2.1 OCN[C@H]1CCc2c1cccc2 8cbbf6faa09157d41905fc38137a0b18 [0,2,0,0,0,0|2,0,0]=4 929 B13R2.1 OCN[C@H]1CCc2c1cccn2 22cfe29a7001e7e1be286839d5aa87ee [0,2,0,0,0,0|1,0,0]=3 930 B13R2.1 SCCN1CCc2c1cccn2 6ace48428331d3599904ed10fce0aff4 [0,2,0,0,0,0|2,0,0]=4 931 B13R2.1 SCCN1CCc2c1nccc2 ce426cfe106cbe07dca15fe895646dd5 [0,2,0,0,0,0|2,0,0]=4 932 B13R2.1 SCCN1CCc2c1nccn2 b53214e4045bbe28b1d7cbb65bf679bc [0,2,0,0,0,0|1,0,0]=3 933 B13R2.9 CCN1CCc2c1nccc2Br 2220c05588a0fc72c9f61e40e61f7a1d [0,2,0,0,0,0|2,0,0]=4 934 B13R2.9 CCN1CCc2c1nccc2Cl 039b1b635bcc553f02098305c6cc639a [0,2,0,0,0,0|2,0,0]=4 935 B13R2.9 CCN1CCc2c1nccc2I 509948c6a89ee05c9c353a573726c2a1 [0,2,0,0,0,0|2,0,0]=4 936 B13R2.9 FCN1CCc2c1nccc2Br 9cf25897caa3d54baca44526bafb4b16 [0,2,0,0,0,0|2,0,0]=4 937 B13R2.9 FCN1CCc2c1nccc2Cl fc9cd7979ac4330b51fb8b3f106daa9e [0,2,0,0,0,0|2,0,0]=4 938 B13R2.9 FCN1CCc2c1nccc2I 69b7a7078055343173edb4f7f7ea6344 [0,2,0,0,0,0|2,0,0]=4 939 B13R2.9 OCN1CCc2c1nccc2Br b29c1984beca35a277cb79d22231b93e [0,2,0,0,0,0|2,0,0]=4 940 B13R2.9 OCN1CCc2c1nccc2Cl c50659649d2f8aada79e776d93965cbf [0,2,0,0,0,0|2,0,0]=4 941 B13R2.9 OCN1CCc2c1nccc2I 46408da190c06b5d92e4fe7856c080d4 [0,2,0,0,0,0|2,0,0]=4 942 B13R2.72 CC(=O)N1CCc2c1cccn2 cace13d03125c22f0b076fa307071656 [0,2,0,0,0,0|2,0,0]=4 943 B13R2.72 CC(=O)N1CCc2c1nccc2 a50667ae9032d1830af5e23281a81a70 [0,2,0,0,0,0|2,0,0]=4 944 B13R2.72 CC(=O)N1CCc2c1nccn2 ef49b0853e146abf21112fc3fd70e4ef [0,2,0,0,0,0|1,0,0]=3 945 B13R2.72 CC(C)N1CCc2c1cccn2 a94148289c0ed61288ba27d3b9239f5c [0,2,0,0,0,0|2,0,0]=4 946 B13R2.72 CC(C)N1CCc2c1nccc2 7adac50c72ac57d13f806e8e59be3150 [0,2,0,0,0,0|2,0,0]=4 947 B13R2.72 CC(C)N1CCc2c1nccn2 fda165b87175b3b2af0807f5a678c8eb [0,2,0,0,0,0|1,0,0]=3 948 B13R2.135 CC1Cc2cccnc2N1CF 7b97c316f0da403c588df6bfa3a70a25 [0,2,0,0,0,0|2,0,0]=4 949 B13R2.135 CC1Cc2cccnc2N1CO c4b0448ebd120209111c45d78861a030 [0,2,0,0,0,0|2,0,0]=4 950 B13R2.135 CCN1c2ncccc2CC1C e6c090fb09c5c68d277a3133ee828234 [0,2,0,0,0,0|2,0,0]=4 951 B13R2.662 CCN1CCc2c1ccc(n2)Br 7a64b15e5e8d9b74cf5fe5802868dd64 [0,2,0,0,0,0|2,0,0]=4 952 B13R2.662 CCN1CCc2c1ccc(n2)Cl 632e13e14534b557b8c36d3da4909834 [0,2,0,0,0,0|2,0,0]=4 953 B13R2.662 CCN1CCc2c1ncc(c2)Br ea7ba6ba2817e944c532588614c38684 [0,2,0,0,0,0|2,0,0]=4 954 B13R2.662 CCN1CCc2c1ncc(c2)Cl c514a1e2f1d01edaa338c59486e99c41 [0,2,0,0,0,0|2,0,0]=4 955 B13R2.662 CCN1CCc2c1ncc(c2)F 4e3f55719b8ad2c5b93057e43c035ab5 [0,2,0,0,0,0|2,0,0]=4 956 B13R2.662 CCN1CCc2c1ncc(c2)I 0a90c3cb80c7ac0cf4b4551878a09c11 [0,2,0,0,0,0|2,0,0]=4 957 B13R2.662 FCN1CCc2c1ccc(n2)Br 16f14be9155de941aec94bea95537fdf [0,2,0,0,0,0|2,0,0]=4 958 B13R2.662 FCN1CCc2c1ccc(n2)Cl 9ce4f585014eef3bb896b658a7f82674 [0,2,0,0,0,0|2,0,0]=4 959 B13R2.662 FCN1CCc2c1ncc(c2)Br 98e2dd04ca6a2c02e4555a07284c598f [0,2,0,0,0,0|2,0,0]=4 960 B13R2.662 FCN1CCc2c1ncc(c2)Cl bcc2156f27a6ec1c46613fb62ea6bbd0 [0,2,0,0,0,0|2,0,0]=4 961 B13R2.662 FCN1CCc2c1ncc(c2)F 3a20dbcb5c7d885d621f17ae11f40e42 [0,2,0,0,0,0|2,0,0]=4 962 B13R2.662 FCN1CCc2c1ncc(c2)I 4d4bb550f20c32eb2c90eb2cc95c4076 [0,2,0,0,0,0|2,0,0]=4 963 B13R2.662 OCN1CCc2c1ccc(n2)Br 255fd7106b360ac89fc844c52671396d [0,2,0,0,0,0|2,0,0]=4 964 B13R2.662 OCN1CCc2c1ccc(n2)Cl e23b13900d3c50d05e95f495fb40b5a6 [0,2,0,0,0,0|2,0,0]=4 965 B13R2.662 OCN1CCc2c1ncc(c2)Br e8bce9a886288a4ee602e1ed087ac8b1 [0,2,0,0,0,0|2,0,0]=4 966 B13R2.662 OCN1CCc2c1ncc(c2)Cl 6de2490bf719b17d78e860228eedf53b [0,2,0,0,0,0|2,0,0]=4 967 B13R2.662 OCN1CCc2c1ncc(c2)F 2e307353b37f9d1d34597574fb073f07 [0,2,0,0,0,0|2,0,0]=4 968 B13R2.662 OCN1CCc2c1ncc(c2)I bca2ea3b3ed90ab58e8b0eebf9e7d8c1 [0,2,0,0,0,0|2,0,0]=4 969 B13R2.2136 CCN1CCc2c1cc(cn2)Br c3c2d39029a9382a9a952e3197c0460f [0,2,0,0,0,0|2,0,0]=4 970 B13R2.2136 CCN1CCc2c1cc(cn2)F a2bb69ee74f46bd53f8b8d21b4079b98 [0,2,0,0,0,0|2,0,0]=4 971 B13R2.2136 CCN1CCc2c1nc(cc2)Br 4741a65cdc6cbb2c6de7a5c5db6f39d2 [0,2,0,0,0,0|2,0,0]=4 972 B13R2.2136 CCN1CCc2c1nc(cc2)Cl 4235667c4124c97408c9fe41170e2818 [0,2,0,0,0,0|2,0,0]=4 973 B13R2.2136 FCN1CCc2c1cc(cn2)Br 00533cac2a2a470d3eb634531a369300 [0,2,0,0,0,0|2,0,0]=4 974 B13R2.2136 FCN1CCc2c1cc(cn2)F 7a094044619001d7ce2314d7f98e231d [0,2,0,0,0,0|2,0,0]=4 975 B13R2.2136 FCN1CCc2c1nc(cc2)Br 71b6f53f6ae14d7cc7d4dcf74308508e [0,2,0,0,0,0|2,0,0]=4 976 B13R2.2136 FCN1CCc2c1nc(cc2)Cl 1d216357f4a253e99d2d0e7ee7efeecf [0,2,0,0,0,0|2,0,0]=4 977 B13R2.2136 OCN1CCc2c1cc(cn2)Br 45b616e63f383d3582d7a4a01379a76f [0,2,0,0,0,0|2,0,0]=4 978 B13R2.2136 OCN1CCc2c1cc(cn2)F ab8c1040cc8923b379f6927384194946 [0,2,0,0,0,0|2,0,0]=4 979 B13R2.2136 OCN1CCc2c1nc(cc2)Br cc242cca2d52b6cc29d11cbcb715a4bb [0,2,0,0,0,0|2,0,0]=4 980 B13R2.2136 OCN1CCc2c1nc(cc2)Cl 83a6d3a47f5d6cb42a808d86c9000bad [0,2,0,0,0,0|2,0,0]=4 981 B11R2.238 c1ccc(nc1)OC2CC2 05f70841461656fba19d4e6cae35b4c4 [0,0,1,1,0,0|2,0,0]=4 982 B11R2.238 c1cnc(nn1)NC2CC2 6fa5c774385a17a538cf31ccbb47b005 [0,0,1,1,0,0|2,0,0]=4 983 B11R2.238 c1cncc(c1)NC2CC2 faca6d2d50c0b4a3e50cda13d58850cf [0,0,1,1,0,0|2,0,0]=4 984 B11R2.238 c1cncc(c1)OC2CC2 e02f03b072be3d2fd90f9a4a8c487a8f [0,0,1,1,0,0|2,0,0]=4 985 B9R1.11 CCN(C)c1cc[nH]n1 749ccf1c4175e9714bd2edef8b8b302c [0,0,1,0,1,0|2,0,0]=4 986 B9R1.11 CCN(C)c1ccns1 a19f7fc213bd5bd88b24d5f68e4afa8f [0,0,1,0,1,0|2,0,0]=4 987 B9R1.11 CCN(C)c1ccon1 2ce8321b2704db34980c07b5e78f5b31 [0,0,1,0,1,0|2,0,0]=4 988 B9R1.11 CCN(C)c1ccsc1 9d7f231018bb5b4ffa353066f71ec39b [0,0,1,0,1,0|2,0,0]=4 989 B9R1.11 CCN(C)c1cnoc1 ebcef11536f5a6665808aa76960976cb [0,0,1,0,1,0|2,0,0]=4 990 B9R1.11 CCN(C)c1cnsc1 234ead277f66496a296320f9bd87b6b4 [0,0,1,0,1,0|2,0,0]=4 991 B9R1.11 CCN(C)c1cnsn1 3a87d241c8e885db48e5196d80e6e20f [0,0,1,0,1,0|2,0,0]=4 992 B9R1.11 CCN(C)c1ncc[nH]1 6558320edd02b7a06d6c6cd1d7a09bd3 [0,0,1,0,1,0|1,0,1]=4 993 B9R1.11 CCN(C)c1ncco1 e68e12067f5d470a1f9ce47452eec061 [0,0,1,0,1,0|2,0,0]=4 994 B9R1.11 CCN(C)c1nccs1 f916cd2d893b9e379f0396f320d15301 [0,0,1,0,1,0|2,0,0]=4 995 B11R1.86 CC(=O)Nc1nccnc1C 91307da892d26270c50ec6b371044d57 [0,0,1,0,0,1|1,0,1]=4 996 B11R1.86 CC(C)Nc1cccnc1Br a687380e5aa8756bf4d5d1c2e5895a79 [0,0,1,0,0,1|2,0,0]=4 997 B11R1.86 CC(C)Nc1cccnc1Cl 69ea8d619084b1b2778d6c21db2c80fb [0,0,1,0,0,1|2,0,0]=4 998 B11R1.86 CC(C)Nc1cccnc1F 893908ba00122d7cec7a3e9e3be67dd0 [0,0,1,0,0,1|2,0,0]=4 999 B11R1.86 CC(C)Nc1cccnc1I 51a846c9c1560b89c89fa64730a3deb3 [0,0,1,0,0,1|2,0,0]=4 1000 B11R1.86 CC(C)Nc1ncccc1F 6f5840dc300786776e2e321fcdb5f56b [0,0,1,0,0,1|2,0,0]=4 1001 B11R1.86 CC(C)Nc1ncccc1I 532c9ce1b71264e87c45674524d2fb56 [0,0,1,0,0,1|2,0,0]=4 1002 B11R1.86 CC(C)Nc1nccnc1Br 64f273542fcdef7892171fa21df651e1 [0,0,1,0,0,1|1,0,0]=3 1003 B11R1.86 CC(C)Nc1nccnc1Cl 0f9c256412e7d20f9195319d8444aeb5 [0,0,1,0,0,1|1,0,0]=3 1004 B11R1.86 CC(C)Nc1nccnc1I 13ad7ab334c3ad8089a1f994056eeee3 [0,0,1,0,0,1|1,0,0]=3 1005 B11R1.86 CC(C)Oc1cccnc1Br 41da9105aa46a4cc5b28d1151f766f7c [0,0,1,0,0,1|2,0,0]=4 1006 B11R1.86 CC(C)Oc1cccnc1Cl 5f47c201110ae76c3f20771d30f413ac [0,0,1,0,0,1|2,0,0]=4 1007 B11R1.86 CC(C)Oc1cccnc1F 5024034c0e002e24ad11e1d6328a6435 [0,0,1,0,0,1|2,0,0]=4 1008 B11R1.86 CC(C)Oc1cccnc1I 452ebdc4006c876f552145b479069297 [0,0,1,0,0,1|2,0,0]=4 1009 B11R1.86 CC(C)Oc1ncccc1Br 3d4ea0f45df93141b027452ac7d893d8 [0,0,1,0,0,1|2,0,0]=4 1010 B11R1.86 CC(C)Oc1ncccc1Cl 9581b31c20e69ea270ecf789bba7b204 [0,0,1,0,0,1|2,0,0]=4 1011 B11R1.86 CC(C)Oc1ncccc1F 366877e5493bef2aca6740e317ad0785 [0,0,1,0,0,1|2,0,0]=4 1012 B11R1.86 CC(C)Oc1nccnc1Br 08bd2cad7f32b307a8d1015974c10f7a [0,0,1,0,0,1|1,0,0]=3 1013 B11R1.86 Cc1ccccc1OC(C)C e336697c807367b5d2038eeb2d20cb38 [0,0,1,0,0,1|2,0,0]=4 1014 B11R1.86 Cc1cccnc1NC(C)C ca53f8740b6496eebb84463f2bacb5a7 [0,0,1,0,0,1|1,0,0]=3 1015 B11R1.86 Cc1cccnc1OC(C)C 2f4605dd9175a92f8b23a3625dc7655c [0,0,1,0,0,1|1,0,0]=3 1016 B11R1.86 Cc1ccnnc1NC(C)C 4058e84abac9e4c55544fad10c869b2f [0,0,1,0,0,1|2,0,0]=4 1017 B11R1.86 Cc1ccnnc1OC(C)C 2d8f76e95dd7a9d99351d31aa0c546e3 [0,0,1,0,0,1|2,0,0]=4 1018 B11R1.86 Cc1ncccc1NC(C)C ab0ea95484d50f8fd20357062d11cc88 [0,0,1,0,0,1|1,0,0]=3 1019 B11R1.86 Cc1ncccc1OC(C)C 3bc8395d80b6d7a4cbb4afe4d1590f68 [0,0,1,0,0,1|1,0,0]=3 1020 B11R1.86 Cc1nccnc1NC(C)C 487af012b2415642e3b4830cd3838913 [0,0,1,0,0,1|0,0,0]=2 1021 B11R1.86 Cc1nccnc1OC(C)C 4c698fd515c5e4f6b0bc546fe95a926a [0,0,1,0,0,1|0,0,0]=2 1022 B11R1.86 Cc1ncncc1OC(C)C 26859b4d7fefc04fb2bcd8b5ccae26d4 [0,0,1,0,0,1|2,0,0]=4 1023 B11R1.86 Cc1nnccc1NC(C)C 81a1216e9e76b925b148babc306f6804 [0,0,1,0,0,1|2,0,0]=4