0 B10R1.17 BrCCNc1ccccc1 08c39138e90dcc3ad4c25fdba0569b67 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.17 BrCCNc1ccccn1 3e3884def368abe14a8394ce1a1093e4 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.17 BrCCNc1cccnc1 2d13be8c88ebb7269676c6abc03a383d [0,0,0,0,0,0|4,0,0]=4 3 B10R1.17 BrCCNc1ccncc1 aa3f433af4f4f2183977f3124b404d50 [0,0,0,0,0,0|4,0,0]=4 4 B10R1.17 C#CCNc1ccccc1 61f0baab40ac49dd5c7bdcf3c0e69fb4 [0,0,0,0,0,0|2,0,1]=3 5 B10R1.17 C#CCNc1ccccn1 d6e1769cae1c3272157b84417d737e93 [0,0,0,0,0,0|3,0,1]=4 6 B10R1.17 C#CCNc1cccnc1 eab2f89c8ef7db5012639b0af7544f62 [0,0,0,0,0,0|3,0,1]=4 7 B10R1.17 C#CCNc1ccncc1 b1c9ee8cf5d9966ad401dfaa8153f485 [0,0,0,0,0,0|3,0,1]=4 8 B10R1.17 C#CCOc1ccccn1 ed1d9c134ad2cbb060972098b462edbb [0,0,0,0,0,0|3,0,1]=4 9 B10R1.17 C#CCOc1cccnc1 a0b168844b4ce712744918a8214c551f [0,0,0,0,0,0|3,0,1]=4 10 B10R1.17 C#CCOc1ccncc1 c4e73a58c8af5a2457ec87cf359e9578 [0,0,0,0,0,0|3,0,1]=4 11 B10R1.17 C=CCNc1ccccc1 47db636c74d7e6cdd4488df2cb146b26 [0,0,0,0,0,0|2,0,1]=3 12 B10R1.17 C=CCNc1ccccn1 a09a0780182f6d8fa8752ca3713a2f3e [0,0,0,0,0,0|3,0,1]=4 13 B10R1.17 C=CCNc1cccnc1 91b240dd75d71a218918690927e5881a [0,0,0,0,0,0|3,0,1]=4 14 B10R1.17 C=CCNc1ccncc1 fc2828cd8f2e538daa95abd157d2f583 [0,0,0,0,0,0|3,0,1]=4 15 B10R1.17 C=CCOc1ccccn1 eb9f74f9d52407e143455993efad096c [0,0,0,0,0,0|3,0,1]=4 16 B10R1.17 C=CCOc1cccnc1 7fb30f1efe498d0d31dd0f3d48945875 [0,0,0,0,0,0|3,0,1]=4 17 B10R1.17 C=CCOc1ccncc1 c45ea9f8d1069d36df9c7358e1f29e58 [0,0,0,0,0,0|3,0,1]=4 18 B10R1.17 CCCNc1ccccc1 b539dcf8361adb43cc5ffbb8617222f9 [0,0,0,0,0,0|2,0,0]=2 19 B10R1.17 CCCNc1ccccn1 d0e3424364e1c8a55b80e6e83d3696ba [0,0,0,0,0,0|3,0,0]=3 20 B10R1.17 CCCNc1cccnc1 54f0ece250e78709faf1eb2fd4dc869b [0,0,0,0,0,0|3,0,0]=3 21 B10R1.17 CCCNc1cccnn1 563334c6dadea743653cde03719d759b [0,0,0,0,0,0|4,0,0]=4 22 B10R1.17 CCCNc1ccncc1 d6095b2a5c05617a6cec49b81fb053c5 [0,0,0,0,0,0|3,0,0]=3 23 B10R1.17 CCCNc1ccncn1 b9fcfeaf51b4e3f06d605d771d307526 [0,0,0,0,0,0|4,0,0]=4 24 B10R1.17 CCCNc1ccnnc1 2caee9d9c90b98666cbfecfa06fa8cff [0,0,0,0,0,0|4,0,0]=4 25 B10R1.17 CCCNc1cnccn1 21846cbecedbe2640cf1187c9cb12883 [0,0,0,0,0,0|4,0,0]=4 26 B10R1.17 CCCNc1cncnc1 2bb7fb2ced184242938c7fda4c6e1a37 [0,0,0,0,0,0|4,0,0]=4 27 B10R1.17 CCCNc1ncccn1 75419027ddb25105c51dd1506820ccba [0,0,0,0,0,0|4,0,0]=4 28 B10R1.17 CCCOc1ccccn1 6e04423b9fd777130a88eaa9fd38fe0c [0,0,0,0,0,0|3,0,0]=3 29 B10R1.17 CCCOc1cccnc1 a97f517fc793a805aaab3ac7468bbd26 [0,0,0,0,0,0|3,0,0]=3 30 B10R1.17 CCCOc1ccncc1 f349ca52270425380eacc7a2a158cca4 [0,0,0,0,0,0|3,0,0]=3 31 B10R1.17 CCCOc1ccnnc1 3c9c3d60b434f5a1bdb1673f40955496 [0,0,0,0,0,0|4,0,0]=4 32 B10R1.17 CCCOc1cnccn1 63621ef82dd8a608febe84451551c55a [0,0,0,0,0,0|4,0,0]=4 33 B10R1.17 CCCOc1cncnc1 3e9abc9b1ba148ce4f151dd0bc3facae [0,0,0,0,0,0|4,0,0]=4 34 B10R1.17 CCCOc1ncccn1 5c5a6b9b9ac104a48d6c4b0d32992f0c [0,0,0,0,0,0|4,0,0]=4 35 B10R1.17 CCNCc1ccccc1 b1285c6596ffdf0473a3780bf23df272 [0,0,0,0,0,0|2,0,0]=2 36 B10R1.17 CCNCc1ccccn1 18cfef8413e038075fdfe85720c8bb60 [0,0,0,0,0,0|3,0,0]=3 37 B10R1.17 CCNCc1cccnc1 ef83bfb13d2744bc293d6f1d68f67b86 [0,0,0,0,0,0|3,0,0]=3 38 B10R1.17 CCNCc1cccnn1 d81bd9bf1bc516576c473bbc4cf064a6 [0,0,0,0,0,0|4,0,0]=4 39 B10R1.17 CCNCc1ccncc1 2e26d8de78e71e06bcd28df387653244 [0,0,0,0,0,0|3,0,0]=3 40 B10R1.17 CCNCc1ccncn1 ae6a093ba5aef71c0ed8d67651e0dd26 [0,0,0,0,0,0|4,0,0]=4 41 B10R1.17 CCNCc1ccnnc1 dc0861acfe2535501016a881a15b8655 [0,0,0,0,0,0|4,0,0]=4 42 B10R1.17 CCNCc1cnccn1 e42a4917d2a6a9dffed5bdafd4c5a5d6 [0,0,0,0,0,0|4,0,0]=4 43 B10R1.17 CCNCc1cncnc1 f9703e58bb488c49affd31e2d844b19f [0,0,0,0,0,0|4,0,0]=4 44 B10R1.17 CCNCc1ncccn1 7e64da8f6dedc74d9803d8b0ac5afe0e [0,0,0,0,0,0|4,0,0]=4 45 B10R1.17 CCOCc1ccccc1 551a24ad73c54bc42b4e27015fdb411f [0,0,0,0,0,0|2,0,0]=2 46 B10R1.17 CCOCc1ccccn1 0c63694580ac3136b3801886d248907b [0,0,0,0,0,0|3,0,0]=3 47 B10R1.17 CCOCc1cccnc1 5f09f824e7a9d5177841898d80553992 [0,0,0,0,0,0|3,0,0]=3 48 B10R1.17 CCOCc1cccnn1 a18ecdaafc84bd92138525fb2f4ad399 [0,0,0,0,0,0|4,0,0]=4 49 B10R1.17 CCOCc1ccncc1 1d1afe04b02325a5cf955e686c22ba10 [0,0,0,0,0,0|3,0,0]=3 50 B10R1.17 CCOCc1ccncn1 d55d0b80fa8d405bad8866668c0f9fa7 [0,0,0,0,0,0|4,0,0]=4 51 B10R1.17 CCOCc1ccnnc1 eb3f0189714571d275860574016314ed [0,0,0,0,0,0|4,0,0]=4 52 B10R1.17 CCOCc1cnccn1 7fb271123056acc990d03d3767398eec [0,0,0,0,0,0|4,0,0]=4 53 B10R1.17 CCOCc1cncnc1 c69748ab8bdd1b31da65e1fc4248cd6d [0,0,0,0,0,0|4,0,0]=4 54 B10R1.17 CCOCc1ncccn1 ba95357c7224be2db8f523f6aa6f9bb0 [0,0,0,0,0,0|4,0,0]=4 55 B10R1.17 COCCN1CC=CCC1 70dd2fb6fa9c4625cf82c4c794681de6 [0,0,0,0,0,0|1,0,3]=4 56 B10R1.17 COCNc1ccccc1 6c62c6b48b6ce69fe29d4b52e03d5674 [0,0,0,0,0,0|1,0,0]=1 57 B10R1.17 COCNc1ccccn1 a7abef3468bc69aa80ea510854a664da [0,0,0,0,0,0|2,0,0]=2 58 B10R1.17 COCNc1cccnc1 06eb298a8599044156c09f99ea626504 [0,0,0,0,0,0|2,0,0]=2 59 B10R1.17 COCNc1cccnn1 81506436050659ef73117567fa6791d8 [0,0,0,0,0,0|3,0,0]=3 60 B10R1.17 COCNc1ccncc1 cff9bc6476b5f7fb176472d400021849 [0,0,0,0,0,0|2,0,0]=2 61 B10R1.17 COCNc1ccncn1 0121271d6ad38ca03fde203df163daca [0,0,0,0,0,0|3,0,0]=3 62 B10R1.17 COCNc1ccnnc1 45f0a2cd8410106cda79b7a687ce8831 [0,0,0,0,0,0|3,0,0]=3 63 B10R1.17 COCNc1cnccn1 e1b86a322d65d71968ad3b0b53c14350 [0,0,0,0,0,0|3,0,0]=3 64 B10R1.17 COCNc1cncnc1 bc5d34e0d8f01ead88e91841539995d3 [0,0,0,0,0,0|3,0,0]=3 65 B10R1.17 COCNc1cnncn1 3a26bcd1f3e8d8efbe9997a4eb33c66f [0,0,0,0,0,0|4,0,0]=4 66 B10R1.17 COCNc1ncccn1 3760316947979d077818f7dd79f44e4b [0,0,0,0,0,0|3,0,0]=3 67 B10R1.17 COCNc1nccnn1 440d61370a2427eaa09d1568352aa4db [0,0,0,0,0,0|4,0,0]=4 68 B10R1.17 COCNc1ncncn1 bd272a3e69cfb4bd21e063c23c06e757 [0,0,0,0,0,0|4,0,0]=4 69 B10R1.17 COCOc1ccccn1 20cd252a71a5a01c3e93af63053a4326 [0,0,0,0,0,0|2,0,0]=2 70 B10R1.17 COCOc1cccnc1 d9b37fb8d6b9f459b8606485db596791 [0,0,0,0,0,0|2,0,0]=2 71 B10R1.17 COCOc1ccncc1 18fbb570a0961cb423d27776329da350 [0,0,0,0,0,0|2,0,0]=2 72 B10R1.17 COCOc1ccnnc1 5746e5661eb8bdd9f7470ef224e7a8c7 [0,0,0,0,0,0|3,0,0]=3 73 B10R1.17 COCOc1cnccn1 91692ef16c539c2f51ce9f654d4e167a [0,0,0,0,0,0|3,0,0]=3 74 B10R1.17 COCOc1cncnc1 c8928e72aff7270067cebc8e3780eb48 [0,0,0,0,0,0|3,0,0]=3 75 B10R1.17 COCOc1cncnn1 01c19f731c4638ba64dd0f8b9a46b308 [0,0,0,0,0,0|4,0,0]=4 76 B10R1.17 COCOc1ncccn1 2bd9fff082f7aee48935ad67be70ba10 [0,0,0,0,0,0|3,0,0]=3 77 B10R1.17 CSCNc1ccccc1 7a27a5c68b132b0ae36908396631930e [0,0,0,0,0,0|1,1,0]=2 78 B10R1.17 CSCNc1ccccn1 cc0ec9b3c5cc0b5eddbb2cfb429d6e35 [0,0,0,0,0,0|2,1,0]=3 79 B10R1.17 CSCNc1cccnc1 e9d3d08db46089fcfbd01833b3252a03 [0,0,0,0,0,0|2,1,0]=3 80 B10R1.17 CSCNc1cccnn1 25ab19c91bfa446099e97e2e9884abac [0,0,0,0,0,0|3,1,0]=4 81 B10R1.17 CSCNc1ccncc1 b2728812347dbf5a187f75cde2f2f0f7 [0,0,0,0,0,0|2,1,0]=3 82 B10R1.17 CSCNc1ccncn1 c8f5e25272793ac1621ccdc638520744 [0,0,0,0,0,0|3,1,0]=4 83 B10R1.17 CSCNc1ccnnc1 a85c8ee67fb4c3c2ce9026ea5cfc88c5 [0,0,0,0,0,0|3,1,0]=4 84 B10R1.17 CSCNc1cnccn1 930f16f0ffaab42f985807a52dc0c6d1 [0,0,0,0,0,0|3,1,0]=4 85 B10R1.17 CSCNc1cncnc1 828be2e55be0b994fef15bd27d5d65c3 [0,0,0,0,0,0|3,1,0]=4 86 B10R1.17 CSCNc1ncccn1 c2922d243c5be83b9b56350e712309ad [0,0,0,0,0,0|3,1,0]=4 87 B10R1.17 CSCOc1ccccn1 af78560ad465f4d707ca132fa83d0e3a [0,0,0,0,0,0|2,1,0]=3 88 B10R1.17 CSCOc1cccnc1 ba5df6f707d429b8683f03b4c7f7b4a6 [0,0,0,0,0,0|2,1,0]=3 89 B10R1.17 CSCOc1ccncc1 4513be07dbfed35afed2a35144dfb259 [0,0,0,0,0,0|2,1,0]=3 90 B10R1.17 CSCOc1ccnnc1 0070046e2fad809de4ff6148194da845 [0,0,0,0,0,0|3,1,0]=4 91 B10R1.17 CSCOc1cnccn1 52ffcd2be78a9b2f46dfb44270cb610f [0,0,0,0,0,0|3,1,0]=4 92 B10R1.17 CSCOc1cncnc1 5aaddc6f81bda81f76fb85fc9a4c08c2 [0,0,0,0,0,0|3,1,0]=4 93 B10R1.17 CSCOc1ncccn1 f123fda50715e79ccef9ccaf5caca47e [0,0,0,0,0,0|3,1,0]=4 94 B10R1.17 FCCNc1ccccc1 f275d2eb426a2818882d3c7dcacca572 [0,0,0,0,0,0|3,0,0]=3 95 B10R1.17 FCCNc1ccccn1 6ab197fb6cbd8dea7ad6d85c80356b58 [0,0,0,0,0,0|4,0,0]=4 96 B10R1.17 FCCNc1cccnc1 948881de1f8cebdb00d3305a89cccf21 [0,0,0,0,0,0|4,0,0]=4 97 B10R1.17 FCCNc1ccncc1 261e26a80d82936049687c2cbf67d868 [0,0,0,0,0,0|4,0,0]=4 98 B10R1.17 FCCOc1ccccn1 06b65dfb48082d4779fc37c34dadb476 [0,0,0,0,0,0|4,0,0]=4 99 B10R1.17 FCCOc1cccnc1 7a88b89adbe5c70a007fa3204bf675ab [0,0,0,0,0,0|4,0,0]=4 100 B10R1.17 FCCOc1ccncc1 7674fd5219d4fad9f3b2390ff6ade4b7 [0,0,0,0,0,0|4,0,0]=4 101 B10R1.17 FCNCc1ccccc1 0dcd541b35f2d813e3bd4529f13aa61b [0,0,0,0,0,0|3,0,0]=3 102 B10R1.17 FCNCc1ccccn1 14327276004818c05fc55a3ce987673c [0,0,0,0,0,0|4,0,0]=4 103 B10R1.17 FCNCc1cccnc1 303a68c3e72902076a5285aac654492a [0,0,0,0,0,0|4,0,0]=4 104 B10R1.17 FCNCc1ccncc1 f86a74e0d1d92929ce958fb624476f4c [0,0,0,0,0,0|4,0,0]=4 105 B10R1.17 FCOCc1ccccc1 602c85a0828834d1798ab6d91c5aa92b [0,0,0,0,0,0|3,0,0]=3 106 B10R1.17 FCOCc1ccccn1 52de5aacdb8cde16edb0cbea31183c40 [0,0,0,0,0,0|4,0,0]=4 107 B10R1.17 FCOCc1cccnc1 d58467b55ec7fcb175961d4ef6210edb [0,0,0,0,0,0|4,0,0]=4 108 B10R1.17 FCOCc1ccncc1 90104d817a6745d762aa8ebc5bd6efa2 [0,0,0,0,0,0|4,0,0]=4 109 B10R1.17 ICCNc1ccccc1 2e8d29f41a7952c3a309dd8ce57744b3 [0,0,0,0,0,0|3,0,0]=3 110 B10R1.17 ICCNc1cccnc1 bd2873fb4e8705ac6b2391510b61aca0 [0,0,0,0,0,0|4,0,0]=4 111 B10R1.17 N#CCNc1ccccc1 fb8b42e8ff84ada914e54c1d3d6bf55b [0,0,0,0,0,0|3,0,0]=3 112 B10R1.17 N#CCNc1ccccn1 49c7d19f4d4a23e5bd1952f105c61103 [0,0,0,0,0,0|4,0,0]=4 113 B10R1.17 N#CCNc1cccnc1 aef19f28ef5503c740dae1a61fe37e81 [0,0,0,0,0,0|4,0,0]=4 114 B10R1.17 N#CCNc1ccncc1 d14ae359b70ff1be7431f7ed6c2110a2 [0,0,0,0,0,0|4,0,0]=4 115 B10R1.17 N#CCOc1ccccn1 34a3895b8030e0f5731db636d99745cf [0,0,0,0,0,0|4,0,0]=4 116 B10R1.17 N#CCOc1cccnc1 1683bec3c106a0c94f6430f126b41bb0 [0,0,0,0,0,0|4,0,0]=4 117 B10R1.17 N#CCOc1ccncc1 93109e100db6bb2c885530bed1dae33a [0,0,0,0,0,0|4,0,0]=4 118 B10R1.17 N#CNCc1ccccc1 a34d70ab939a88101ebb668f17250d10 [0,0,0,0,0,0|3,0,0]=3 119 B10R1.17 N#CNCc1ccccn1 73d970ffa881cb91d14134c59642f4f6 [0,0,0,0,0,0|4,0,0]=4 120 B10R1.17 N#CNCc1cccnc1 b7cd89e5cd4646b42c64988159c94b48 [0,0,0,0,0,0|4,0,0]=4 121 B10R1.17 O=CCNc1ccccc1 c4995b86d7297371e551e9130c388474 [0,0,0,0,0,0|3,0,0]=3 122 B10R1.17 O=CCNc1ccccn1 b00390cf782e1a66064d84fbb4455a3c [0,0,0,0,0,0|4,0,0]=4 123 B10R1.17 O=CCNc1cccnc1 e9d89fc8f59db8f4ca1573408ae38233 [0,0,0,0,0,0|4,0,0]=4 124 B10R1.17 O=CCNc1ccncc1 b936de0afb8269a2a61f35e281fea4e9 [0,0,0,0,0,0|4,0,0]=4 125 B10R1.17 O=CCOc1ccccn1 78f53edacda55ffdc5004f3168d63b47 [0,0,0,0,0,0|4,0,0]=4 126 B10R1.17 O=CCOc1cccnc1 1d2e939a386c96cb8d89a6882c0c8d7c [0,0,0,0,0,0|4,0,0]=4 127 B10R1.17 O=CCOc1ccncc1 1ccec03aa34336841de9232973adaefb [0,0,0,0,0,0|4,0,0]=4 128 B10R1.17 O=CNCc1ccccc1 8c79f42269c527e7ed1741ce8019791f [0,0,0,0,0,0|3,0,0]=3 129 B10R1.17 O=CNCc1ccccn1 2a4bd7c465ac0ab8804867d1eeb7fd18 [0,0,0,0,0,0|4,0,0]=4 130 B10R1.17 O=CNCc1cccnc1 86ebf2990a9293a0c4bc35942f9e4571 [0,0,0,0,0,0|4,0,0]=4 131 B10R1.17 O=CNCc1ccncc1 1f2ebcdeb77286cfab7ddcdf6ac042b2 [0,0,0,0,0,0|4,0,0]=4 132 B10R1.17 OCCNc1ccccc1 39a30f826fab6ed2b66a9ec4a9dddbdb [0,0,0,0,0,0|3,0,0]=3 133 B10R1.17 OCCNc1ccccn1 14d1f9671b0391e7cf5b318b74673aa8 [0,0,0,0,0,0|4,0,0]=4 134 B10R1.17 OCCNc1cccnc1 528072d5adbbf320415662e70c05db36 [0,0,0,0,0,0|4,0,0]=4 135 B10R1.17 OCCNc1ccncc1 2d153fc0224e0960cc8e262d108ccf9f [0,0,0,0,0,0|4,0,0]=4 136 B10R1.17 OCNCc1ccccc1 c4aaeb48f32c090af3c65531a6e27cd4 [0,0,0,0,0,0|3,0,0]=3 137 B10R1.17 OCNCc1ccccn1 9488b9a65408dc593594baac432012ff [0,0,0,0,0,0|4,0,0]=4 138 B10R1.17 OCNCc1cccnc1 86bd6343ace558a3752eaa3d1a554844 [0,0,0,0,0,0|4,0,0]=4 139 B10R1.17 OCNCc1ccncc1 31d693e5cbaa1006fa13d8924b3493eb [0,0,0,0,0,0|4,0,0]=4 140 B10R1.17 SCCNc1ccccc1 9bbad99372906cf90d9dd5df1e41681f [0,0,0,0,0,0|3,0,0]=3 141 B10R1.17 SCCNc1ccccn1 de2447df01f4514b4267a28db291424f [0,0,0,0,0,0|4,0,0]=4 142 B10R1.17 SCCNc1cccnc1 d7661b93dffeb3e5de5eb3930ee71345 [0,0,0,0,0,0|4,0,0]=4 143 B10R1.17 SCCNc1ccncc1 577353449c24c89c4540584279fd2c55 [0,0,0,0,0,0|4,0,0]=4 144 B10R1.17 SCCOc1ccccn1 80884e7103538d273738856f1f9d4222 [0,0,0,0,0,0|4,0,0]=4 145 B10R1.17 SCCOc1cccnc1 84b759d60311f3e5695c1f1ffc5005e0 [0,0,0,0,0,0|4,0,0]=4 146 B10R1.17 SCCOc1ccncc1 bcb2c22e459aa7ecd2660e818a75429e [0,0,0,0,0,0|4,0,0]=4 147 B9R1.8 CCNc1ccccc1 33257e4a9e1d882742dfd4cfddb78cda [1,0,0,0,0,0|1,0,0]=2 148 B9R1.8 CCNc1ccccn1 2525c23bd886b96c78c0be1e9ad1905b [1,0,0,0,0,0|2,0,0]=3 149 B9R1.8 CCNc1cccnc1 e16c06cad87ecb5a3a4a58b6d8537631 [1,0,0,0,0,0|2,0,0]=3 150 B9R1.8 CCNc1cccnn1 8ce46420a68f085572db040256d5d2b7 [1,0,0,0,0,0|3,0,0]=4 151 B9R1.8 CCNc1ccncc1 76118d388bf159fc52a5b3b43773c6d0 [1,0,0,0,0,0|2,0,0]=3 152 B9R1.8 CCNc1ccncn1 e04846be86a5c479e545d0cb402fe182 [1,0,0,0,0,0|3,0,0]=4 153 B9R1.8 CCNc1ccnnc1 84df08ea46526da8091efc8e7dc98bc3 [1,0,0,0,0,0|3,0,0]=4 154 B9R1.8 CCNc1cnccn1 692286fa82997f2fb685e4d3ad5b2443 [1,0,0,0,0,0|3,0,0]=4 155 B9R1.8 CCNc1cncnc1 d22064ed1cc1956224a6568ef26d5099 [1,0,0,0,0,0|3,0,0]=4 156 B9R1.8 CCNc1ncccn1 e5f30c193b5ab11515bad37a4470b1a9 [1,0,0,0,0,0|3,0,0]=4 157 B9R1.8 CCOc1ccccn1 8b10ed115fcb5b65f209d3b07c05b728 [1,0,0,0,0,0|2,0,0]=3 158 B9R1.8 CCOc1cccnc1 efa582b018c37c3ab155936515b551ea [1,0,0,0,0,0|2,0,0]=3 159 B9R1.8 CCOc1ccncc1 365c1eef106f5326bc3144a980f01ba5 [1,0,0,0,0,0|2,0,0]=3 160 B9R1.8 CCOc1ccnnc1 495bf99ef1353fb62f88bfe5786129d6 [1,0,0,0,0,0|3,0,0]=4 161 B9R1.8 CCOc1cnccn1 aa9d1d61b4f8dce5da42fe3ddcc6df85 [1,0,0,0,0,0|3,0,0]=4 162 B9R1.8 CCOc1cncnc1 8629022d8ea6564de249e44f3cfd1da9 [1,0,0,0,0,0|3,0,0]=4 163 B9R1.8 CCOc1ncccn1 c537ae1cbb412be3ee508a248bc8885d [1,0,0,0,0,0|3,0,0]=4 164 B9R1.8 FCNc1ccccc1 c8185de2a7206057ede93409452a493c [1,0,0,0,0,0|2,0,0]=3 165 B9R1.8 FCNc1ccccn1 e54f22e64e1a3858aca2c223c703a3f4 [1,0,0,0,0,0|3,0,0]=4 166 B9R1.8 FCNc1cccnc1 cd4b988ac9022e9beb52f2fd6e6d3819 [1,0,0,0,0,0|3,0,0]=4 167 B9R1.8 FCNc1ccncc1 b2ec03e01efad68d3352b8bfa837899b [1,0,0,0,0,0|3,0,0]=4 168 B9R1.8 FCOc1ccccn1 104b8f973c7a9ebb04a489743f7e956b [1,0,0,0,0,0|3,0,0]=4 169 B9R1.8 FCOc1cccnc1 613341899f57b52454964b4cd6fd2e82 [1,0,0,0,0,0|3,0,0]=4 170 B9R1.8 FCOc1ccncc1 ac9d070deb144d6d363d1c265a3b25fa [1,0,0,0,0,0|3,0,0]=4 171 B9R1.8 OCNc1ccccc1 6a26daba1a11b7282126aadb7f7b8f97 [1,0,0,0,0,0|1,0,0]=2 172 B9R1.8 OCNc1ccccn1 d59bc8d9974c705420d0aeed6cce1b06 [1,0,0,0,0,0|2,0,0]=3 173 B9R1.8 OCNc1cccnc1 68add967e09ec2eee2b71061a3bb94f5 [1,0,0,0,0,0|2,0,0]=3 174 B9R1.8 OCNc1cccnn1 d8959988e09873d44f8b640f1fe386e3 [1,0,0,0,0,0|3,0,0]=4 175 B9R1.8 OCNc1ccncc1 25e64b963b18028da179c82ed337c929 [1,0,0,0,0,0|2,0,0]=3 176 B9R1.8 OCNc1ccncn1 5807087c5c4108ffa8c52d7444f962d7 [1,0,0,0,0,0|3,0,0]=4 177 B9R1.8 OCNc1ccnnc1 3894cb787e7b8600c63a04771d062bff [1,0,0,0,0,0|3,0,0]=4 178 B9R1.8 OCNc1cnccn1 a22ea0b3c17d02d754f571b9860bc923 [1,0,0,0,0,0|3,0,0]=4 179 B9R1.8 OCNc1cncnc1 f94e24e43a9b982a2515c894be0cdeee [1,0,0,0,0,0|3,0,0]=4 180 B9R1.8 OCNc1ncccn1 9fc76ad0c84f53b08af40c3faa9bb85c [1,0,0,0,0,0|3,0,0]=4 181 B11R1.1 C#CCNc1ccc(cc1)Br 05bed8b415056736c647e58b7b2f9202 [0,1,0,0,0,0|2,0,1]=4 182 B11R1.1 C#CCNc1ccc(cc1)C 34c9f197f971da874ae7626a0b74173e [0,1,0,0,0,0|2,0,1]=4 183 B11R1.1 C#CCNc1ccc(cc1)Cl c0d447e42332fe7792c40cc6848a76c2 [0,1,0,0,0,0|2,0,1]=4 184 B11R1.1 C#CCNc1ccc(cc1)F 41e3db4964670c905a488dbe2d238ff1 [0,1,0,0,0,0|2,0,1]=4 185 B11R1.1 C#CCNc1ccc(cc1)I 0ca24471589bd50d7bf0a837994f4d5f [0,1,0,0,0,0|2,0,1]=4 186 B11R1.1 C#CCNc1ccc(cc1)S bf9c2d2a34562279d7f7314fd803f98c [0,1,0,0,0,0|2,0,1]=4 187 B11R1.1 C#CCOc1ccc(cc1)Br 4060fdb277e13444e48fd8ffc2e01d06 [0,1,0,0,0,0|2,0,1]=4 188 B11R1.1 C#CCOc1ccc(cc1)C 896547e9686664dd8ea557b7ec0e9941 [0,1,0,0,0,0|2,0,1]=4 189 B11R1.1 C#CCOc1ccc(cc1)Cl 4412f9679d6b6c5bb1c7afaf4d63837c [0,1,0,0,0,0|2,0,1]=4 190 B11R1.1 C#CCOc1ccc(cc1)F f5ee94ae0ebda38907ff4450ba45b6e7 [0,1,0,0,0,0|2,0,1]=4 191 B11R1.1 C#CCOc1ccc(cc1)I 4d37462fd18b6cf07845e2db48718c8b [0,1,0,0,0,0|2,0,1]=4 192 B11R1.1 C#CCOc1ccc(cc1)S 0f5e88c4a670425d2c1de69cb9a0702c [0,1,0,0,0,0|2,0,1]=4 193 B11R1.1 C=CCNc1ccc(cc1)Br 8b2a9bff3ffe25a417572a2ff271e5fc [0,1,0,0,0,0|2,0,1]=4 194 B11R1.1 C=CCNc1ccc(cc1)C 62056623a0561a4540c8c52e6e31e32f [0,1,0,0,0,0|2,0,1]=4 195 B11R1.1 C=CCNc1ccc(cc1)Cl 0abc2df2ac22be65b98841965971ccfd [0,1,0,0,0,0|2,0,1]=4 196 B11R1.1 C=CCNc1ccc(cc1)F fefad214b2afc5e82912832cf062e6a3 [0,1,0,0,0,0|2,0,1]=4 197 B11R1.1 C=CCNc1ccc(cc1)I 10233b6ee7006f40e50da9f11b95a16b [0,1,0,0,0,0|2,0,1]=4 198 B11R1.1 C=CCNc1ccc(cc1)S 719398e8412f8b050af1b35db7f6d7b4 [0,1,0,0,0,0|2,0,1]=4 199 B11R1.1 C=CCOc1ccc(cc1)Br 4caddf4c4fa821b8a23c3e22b37a63a5 [0,1,0,0,0,0|2,0,1]=4 200 B11R1.1 C=CCOc1ccc(cc1)C cef0428792cf4168ad9fd81785326672 [0,1,0,0,0,0|2,0,1]=4 201 B11R1.1 C=CCOc1ccc(cc1)Cl d433b2e6e63cf4589dfcd18b4828cc35 [0,1,0,0,0,0|2,0,1]=4 202 B11R1.1 C=CCOc1ccc(cc1)F 623e09165a78fc8bfadfaf0dca3fcb71 [0,1,0,0,0,0|2,0,1]=4 203 B11R1.1 C=CCOc1ccc(cc1)I 92187a6fbc41b07a7b0a3b019b772fa1 [0,1,0,0,0,0|2,0,1]=4 204 B11R1.1 C=CCOc1ccc(cc1)S 6f29ee42ebfe44e544a0b50ff22fc196 [0,1,0,0,0,0|2,0,1]=4 205 B11R1.1 CCCNc1ccc(=O)[nH]c1 788491b37865b7508a806e3465be9c1e [0,1,0,0,0,0|3,0,0]=4 206 B11R1.1 CCCNc1ccc(cc1)Br 95e3de2d252597fde5ce9a477304d00e [0,1,0,0,0,0|2,0,0]=3 207 B11R1.1 CCCNc1ccc(cc1)C 60206ed79d50ce0b51d2c9baa6a9bfd8 [0,1,0,0,0,0|2,0,0]=3 208 B11R1.1 CCCNc1ccc(cc1)Cl 78619a742ccf6ba08a4394e2ee033c54 [0,1,0,0,0,0|2,0,0]=3 209 B11R1.1 CCCNc1ccc(cc1)F 03593481ab116133e85310d463cb3940 [0,1,0,0,0,0|2,0,0]=3 210 B11R1.1 CCCNc1ccc(cc1)I 1d619469e460bbb1d49ca10b65682c62 [0,1,0,0,0,0|2,0,0]=3 211 B11R1.1 CCCNc1ccc(cc1)S 5de90476a8c0464c76157dc952d2c04c [0,1,0,0,0,0|2,0,0]=3 212 B11R1.1 CCCNc1ccc(cn1)Br 21ad52c0b7cad2f16279c41b12c3dd20 [0,1,0,0,0,0|3,0,0]=4 213 B11R1.1 CCCNc1ccc(cn1)C 49b1b111cca17d95ac5b969044ae90fe [0,1,0,0,0,0|3,0,0]=4 214 B11R1.1 CCCNc1ccc(cn1)Cl a95c01f05e53613156fba3b0f8d7f780 [0,1,0,0,0,0|3,0,0]=4 215 B11R1.1 CCCNc1ccc(cn1)F bd191ccc5254163826bb8b5b65ee6ba9 [0,1,0,0,0,0|3,0,0]=4 216 B11R1.1 CCCNc1ccc(cn1)I 3117f77f4a2d396d13ad23c0ed5be14e [0,1,0,0,0,0|3,0,0]=4 217 B11R1.1 CCCNc1ccc(nc1)Br c94a8cb0ce30ba24f74624f4b9b038a4 [0,1,0,0,0,0|3,0,0]=4 218 B11R1.1 CCCNc1ccc(nc1)C 7d88a307944adac731bde6f988e446cd [0,1,0,0,0,0|3,0,0]=4 219 B11R1.1 CCCNc1ccc(nc1)Cl b1c722121661a42e5d6842a9b28519ac [0,1,0,0,0,0|3,0,0]=4 220 B11R1.1 CCCNc1ccc(nc1)F 85865fae01c522e244e3ef69d8b38878 [0,1,0,0,0,0|3,0,0]=4 221 B11R1.1 CCCNc1ccc(nc1)I b4159aeffce60ad6131e4364b9368e94 [0,1,0,0,0,0|3,0,0]=4 222 B11R1.1 CCCOc1ccc(cc1)Br fcee74d69e8e023a5434abc8b0385424 [0,1,0,0,0,0|2,0,0]=3 223 B11R1.1 CCCOc1ccc(cc1)C 4fdcf2ff939bb0420513a197f77843e9 [0,1,0,0,0,0|2,0,0]=3 224 B11R1.1 CCCOc1ccc(cc1)Cl 6ca291266ab2c05a274ea67a7fbcb647 [0,1,0,0,0,0|2,0,0]=3 225 B11R1.1 CCCOc1ccc(cc1)F 18444060e70b801a4550e15d090495f3 [0,1,0,0,0,0|2,0,0]=3 226 B11R1.1 CCCOc1ccc(cc1)I 1cc2cc68a2ed4244fd1e94b3d6df9d5e [0,1,0,0,0,0|2,0,0]=3 227 B11R1.1 CCCOc1ccc(cc1)S 5c2ad8fc9e5698065bd7177da22c3e46 [0,1,0,0,0,0|2,0,0]=3 228 B11R1.1 CCCOc1ccc(cn1)C a2aa3425c184ebbd01762c44679803c0 [0,1,0,0,0,0|3,0,0]=4 229 B11R1.1 CCCOc1ccc(cn1)Cl 0c1b7fe9f246d104ebcbc468a16004c1 [0,1,0,0,0,0|3,0,0]=4 230 B11R1.1 CCCOc1ccc(cn1)F 6a93fffcdab2ace921c013c1d2a630f1 [0,1,0,0,0,0|3,0,0]=4 231 B11R1.1 CCCOc1ccc(cn1)I ca1682e59f74f1735f8a64800a62750a [0,1,0,0,0,0|3,0,0]=4 232 B11R1.1 CCCOc1ccc(nc1)Br c0aef75a4817cab606425a2121c50d36 [0,1,0,0,0,0|3,0,0]=4 233 B11R1.1 CCCOc1ccc(nc1)C e7dbc804100b6abbbe2b0f45f45546ba [0,1,0,0,0,0|3,0,0]=4 234 B11R1.1 CCCOc1ccc(nc1)Cl 18ab5a610d56358eac2068ee56cbca89 [0,1,0,0,0,0|3,0,0]=4 235 B11R1.1 CCCOc1ccc(nc1)F d5473478a7dbdb85a03b2038e1b4207d [0,1,0,0,0,0|3,0,0]=4 236 B11R1.1 CCCOc1ccc(nc1)I 8a80b63748b30da8afc9dd9cedc24183 [0,1,0,0,0,0|3,0,0]=4 237 B11R1.1 CCNCc1ccc(=O)[nH]c1 1254ebee348ff16c368fd1d2a91b5fef [0,1,0,0,0,0|3,0,0]=4 238 B11R1.1 CCNCc1ccc(cc1)Br 2cd51938999c20d02733c25a0b5c4804 [0,1,0,0,0,0|2,0,0]=3 239 B11R1.1 CCNCc1ccc(cc1)C 587aa1ee1f45a7f7f3762adcf6ab1e89 [0,1,0,0,0,0|2,0,0]=3 240 B11R1.1 CCNCc1ccc(cc1)Cl 521dc09ab663236062b599824b274153 [0,1,0,0,0,0|2,0,0]=3 241 B11R1.1 CCNCc1ccc(cc1)F 507a49f5c428a46a95718b00a3fd1bd9 [0,1,0,0,0,0|2,0,0]=3 242 B11R1.1 CCNCc1ccc(cc1)I cb00fc5924e1405950f010ec806d6a94 [0,1,0,0,0,0|2,0,0]=3 243 B11R1.1 CCNCc1ccc(cn1)Br 882a30c5c31be62d8df2ad05ade9700e [0,1,0,0,0,0|3,0,0]=4 244 B11R1.1 CCNCc1ccc(cn1)C ce28a7edd6e5cb339d15632619449df9 [0,1,0,0,0,0|3,0,0]=4 245 B11R1.1 CCNCc1ccc(cn1)Cl a8b3098af6f06b71ef76b0a789adb905 [0,1,0,0,0,0|3,0,0]=4 246 B11R1.1 CCNCc1ccc(cn1)F 8ce16a3c3b9cfcc722411ae28895539b [0,1,0,0,0,0|3,0,0]=4 247 B11R1.1 CCNCc1ccc(nc1)Br 459eae4b7edb145b4c74858ed5083f2a [0,1,0,0,0,0|3,0,0]=4 248 B11R1.1 CCNCc1ccc(nc1)C be9f6396d87f569ee4a97d2c73536694 [0,1,0,0,0,0|3,0,0]=4 249 B11R1.1 CCNCc1ccc(nc1)Cl e61d7305db5ae395b6483f66380e1fe0 [0,1,0,0,0,0|3,0,0]=4 250 B11R1.1 CCNCc1ccc(nc1)F bfcb52b611bb6fe9e54b00a336ddce06 [0,1,0,0,0,0|3,0,0]=4 251 B11R1.1 CCOCc1cc[n+](cc1)[O-] c821ee3885c58d89975b7f31b845487a [0,1,0,0,0,0|3,0,0]=4 252 B11R1.1 CCOCc1ccc(cc1)Br 55e365425e5287f17bedcdf9c6cf8797 [0,1,0,0,0,0|2,0,0]=3 253 B11R1.1 CCOCc1ccc(cc1)C 4d215a4a9529a309b910ed7006942890 [0,1,0,0,0,0|2,0,0]=3 254 B11R1.1 CCOCc1ccc(cc1)Cl 162fb8a5396843344a75f2243153a2a9 [0,1,0,0,0,0|2,0,0]=3 255 B11R1.1 CCOCc1ccc(cc1)F 67e386059816bee45125127b16cfcbee [0,1,0,0,0,0|2,0,0]=3 256 B11R1.1 CCOCc1ccc(cc1)I 25d977d51d9f47d9f153070d57dca8b8 [0,1,0,0,0,0|2,0,0]=3 257 B11R1.1 CCOCc1ccc(cc1)S 51de74da01a41ad35713330690173be6 [0,1,0,0,0,0|2,0,0]=3 258 B11R1.1 CCOCc1ccc(cn1)Br 7fa2d6660ca0fac0c5d496c90646d302 [0,1,0,0,0,0|3,0,0]=4 259 B11R1.1 CCOCc1ccc(cn1)C d87497b35c5f44e142aec59de5813e88 [0,1,0,0,0,0|3,0,0]=4 260 B11R1.1 CCOCc1ccc(cn1)Cl 6991b553b81a946d1923a2d827bfdbc3 [0,1,0,0,0,0|3,0,0]=4 261 B11R1.1 CCOCc1ccc(cn1)F c13b565598015e639c197d30e6fbe232 [0,1,0,0,0,0|3,0,0]=4 262 B11R1.1 CCOCc1ccc(cn1)I 401d1ae041509fd6bf393ad89597efa1 [0,1,0,0,0,0|3,0,0]=4 263 B11R1.1 CCOCc1ccc(nc1)Br 16508d9e74e22116b4378afff1fa9aa5 [0,1,0,0,0,0|3,0,0]=4 264 B11R1.1 CCOCc1ccc(nc1)C a880cc0302e1c9d4e4d89c1a296d8d06 [0,1,0,0,0,0|3,0,0]=4 265 B11R1.1 CCOCc1ccc(nc1)Cl 78e1cd2f782133a4dfac861a528ccf0c [0,1,0,0,0,0|3,0,0]=4 266 B11R1.1 CCOCc1ccc(nc1)F 965c536d19c11eee65b05ccac1580358 [0,1,0,0,0,0|3,0,0]=4 267 B11R1.1 COCNc1ccc(=O)[nH]c1 b4a2449cedb2e1b491a9c0d57d7f1632 [0,1,0,0,0,0|2,0,0]=3 268 B11R1.1 COCNc1ccc(cc1)Br 239c0132d7f14bf3bf07ff69790489a4 [0,1,0,0,0,0|1,0,0]=2 269 B11R1.1 COCNc1ccc(cc1)C e4f246b36607f9f18bc5aa859e62100a [0,1,0,0,0,0|1,0,0]=2 270 B11R1.1 COCNc1ccc(cc1)Cl 9367c645aa9d92ecdc3a5eedabcc13c5 [0,1,0,0,0,0|1,0,0]=2 271 B11R1.1 COCNc1ccc(cc1)F f296a10dbbbc66104f13afdffc18051f [0,1,0,0,0,0|1,0,0]=2 272 B11R1.1 COCNc1ccc(cc1)I 021e3c73bb722af1abf9e932759670c7 [0,1,0,0,0,0|1,0,0]=2 273 B11R1.1 COCNc1ccc(cc1)S b5677477be0bd1f2c09ba9bfaae89e50 [0,1,0,0,0,0|1,0,0]=2 274 B11R1.1 COCNc1ccc(cn1)Br 1c720799b81f195c61b333a1f89190a8 [0,1,0,0,0,0|2,0,0]=3 275 B11R1.1 COCNc1ccc(cn1)C dfa9e7f1e71b67e682014a3887f5529f [0,1,0,0,0,0|2,0,0]=3 276 B11R1.1 COCNc1ccc(cn1)Cl 97b49df12f3a921c9e3552ee1e5e784a [0,1,0,0,0,0|2,0,0]=3 277 B11R1.1 COCNc1ccc(cn1)F 5ab2d6422d4a1c3846fcacb1a633ff1f [0,1,0,0,0,0|2,0,0]=3 278 B11R1.1 COCNc1ccc(cn1)I 79f06f1a860ef23cb3610db9ed31701e [0,1,0,0,0,0|2,0,0]=3 279 B11R1.1 COCNc1ccc(nc1)Br 576a477d66d4a73fd7400639413c0249 [0,1,0,0,0,0|2,0,0]=3 280 B11R1.1 COCNc1ccc(nc1)C f292d8e7950b5c4d802142ace58c7355 [0,1,0,0,0,0|2,0,0]=3 281 B11R1.1 COCNc1ccc(nc1)Cl 9ec86f4aea95838b4b5a8379674a00c5 [0,1,0,0,0,0|2,0,0]=3 282 B11R1.1 COCNc1ccc(nc1)F 00a09ed9ac86c28615a16970d030169e [0,1,0,0,0,0|2,0,0]=3 283 B11R1.1 COCNc1ccc(nc1)I 3596d767fe8815a1a0a06589c477669f [0,1,0,0,0,0|2,0,0]=3 284 B11R1.1 COCNc1ccc(nn1)Br 7bdc1950403d6858153428c16c84e0c4 [0,1,0,0,0,0|3,0,0]=4 285 B11R1.1 COCNc1ccc(nn1)C 2bda2cfb12c3c695488707372191af38 [0,1,0,0,0,0|3,0,0]=4 286 B11R1.1 COCNc1ccc(nn1)Cl 1c02c047f6f759d3810b2ffe912d7093 [0,1,0,0,0,0|3,0,0]=4 287 B11R1.1 COCNc1ccc(nn1)F 62c7250d61177d86fc293cd4771136ba [0,1,0,0,0,0|3,0,0]=4 288 B11R1.1 COCNc1ccc(nn1)I c5742df67535271a595e5ea3edf98970 [0,1,0,0,0,0|3,0,0]=4 289 B11R1.1 COCNc1cnc(=O)[nH]c1 b5db8b7af867e5f0319d164569f59a51 [0,1,0,0,0,0|3,0,0]=4 290 B11R1.1 COCNc1cnc(cn1)Br 0b49f70ce00475eb1a0a3df87d7c14c7 [0,1,0,0,0,0|3,0,0]=4 291 B11R1.1 COCNc1cnc(cn1)C 8e85dc8e7034a3470175c4342f07ed93 [0,1,0,0,0,0|3,0,0]=4 292 B11R1.1 COCNc1cnc(cn1)Cl 8ac7c4fd7c05636829197d595d92d3b3 [0,1,0,0,0,0|3,0,0]=4 293 B11R1.1 COCNc1cnc(cn1)I 8437a9227237c1883d271f7d25cc8a22 [0,1,0,0,0,0|3,0,0]=4 294 B11R1.1 COCNc1cnc(nc1)Br 411d5525b4fa95dccc38348e421175aa [0,1,0,0,0,0|3,0,0]=4 295 B11R1.1 COCNc1cnc(nc1)C ec4876fdb9ea674cb3ad3540b9c2246a [0,1,0,0,0,0|3,0,0]=4 296 B11R1.1 COCNc1cnc(nc1)Cl 4c830565c072e94cdf47599a9949292b [0,1,0,0,0,0|3,0,0]=4 297 B11R1.1 COCNc1cnc(nc1)I 8a79537b124f259d7dffb3cf61609844 [0,1,0,0,0,0|3,0,0]=4 298 B11R1.1 COCNc1ncc(cn1)Br c4726a3f1eb06da00821a989f8554b41 [0,1,0,0,0,0|3,0,0]=4 299 B11R1.1 COCNc1ncc(cn1)C 2009c2c5d35a62381bf8969416a4b494 [0,1,0,0,0,0|3,0,0]=4 300 B11R1.1 COCNc1ncc(cn1)Cl fa642040fe1528ca9527a34eecf8e7df [0,1,0,0,0,0|3,0,0]=4 301 B11R1.1 COCNc1ncc(cn1)F 5c2bb64e922e666a0f20c6b1d31d7ca5 [0,1,0,0,0,0|3,0,0]=4 302 B11R1.1 COCNc1ncc(cn1)I 69d768b0048960b3b90b0414ab866f0c [0,1,0,0,0,0|3,0,0]=4 303 B11R1.1 COCOc1ccc(cc1)Br 4c7a6b8e747219dccfee467c9fcd68b9 [0,1,0,0,0,0|1,0,0]=2 304 B11R1.1 COCOc1ccc(cc1)C 6de4302c41d46032c578a0645b570acc [0,1,0,0,0,0|1,0,0]=2 305 B11R1.1 COCOc1ccc(cc1)Cl fdd4da30c0d821dac2a0c1ce91307d0f [0,1,0,0,0,0|1,0,0]=2 306 B11R1.1 COCOc1ccc(cc1)F d726aa507ee8c13d395daa40b41c2957 [0,1,0,0,0,0|1,0,0]=2 307 B11R1.1 COCOc1ccc(cc1)I df653f5f1ee1638a0aae84a7d8d68f8d [0,1,0,0,0,0|1,0,0]=2 308 B11R1.1 COCOc1ccc(cc1)S eb0b44c1e1c77f48cae0fd09b89123bf [0,1,0,0,0,0|1,0,0]=2 309 B11R1.1 COCOc1ccc(cn1)C 1843af41304aa6e2c88f2a0c48329c6c [0,1,0,0,0,0|2,0,0]=3 310 B11R1.1 COCOc1ccc(cn1)Cl 76d137fbe0f9bd159ffa6657e8141956 [0,1,0,0,0,0|2,0,0]=3 311 B11R1.1 COCOc1ccc(cn1)F ea228b8dcd59e2d303f724d0e06cdd97 [0,1,0,0,0,0|2,0,0]=3 312 B11R1.1 COCOc1ccc(cn1)I 6a318e58869e2af374a0226b608f1874 [0,1,0,0,0,0|2,0,0]=3 313 B11R1.1 COCOc1ccc(nc1)Br 2704f489a020362de9b7145a86193846 [0,1,0,0,0,0|2,0,0]=3 314 B11R1.1 COCOc1ccc(nc1)C 67dbeac8ce2d0a66189b3e7d9573b367 [0,1,0,0,0,0|2,0,0]=3 315 B11R1.1 COCOc1ccc(nc1)Cl f6111026c443a1b1564066419f97c0ee [0,1,0,0,0,0|2,0,0]=3 316 B11R1.1 COCOc1ccc(nc1)F 2fe6784ad778bff9cb80932d266dfeb9 [0,1,0,0,0,0|2,0,0]=3 317 B11R1.1 COCOc1ccc(nc1)I 582423fe3f3a53fff996fd66abd09fd3 [0,1,0,0,0,0|2,0,0]=3 318 B11R1.1 COCOc1ccc(nn1)Br 759ff7653ddf06bdd571764c28bd396f [0,1,0,0,0,0|3,0,0]=4 319 B11R1.1 COCOc1ccc(nn1)C 13cc14b8f41875d1b3b245b7c5a7b601 [0,1,0,0,0,0|3,0,0]=4 320 B11R1.1 COCOc1ccc(nn1)Cl 91309330903c7dbabdb494a61e54da78 [0,1,0,0,0,0|3,0,0]=4 321 B11R1.1 COCOc1cnc(cn1)Br 40b37b0f94d4896ff201464d3611163b [0,1,0,0,0,0|3,0,0]=4 322 B11R1.1 COCOc1cnc(cn1)C 4475b105f4a2048faee1f2ecb47844b5 [0,1,0,0,0,0|3,0,0]=4 323 B11R1.1 COCOc1cnc(cn1)Cl e43da791ffc80fbbbc6a9a3e5763e1da [0,1,0,0,0,0|3,0,0]=4 324 B11R1.1 COCOc1cnc(cn1)I a190a0a920493f2b26668c23abae2cf8 [0,1,0,0,0,0|3,0,0]=4 325 B11R1.1 COCOc1cnc(nc1)Br 69e2107c0e3b0f38216cd7efaff9e7b4 [0,1,0,0,0,0|3,0,0]=4 326 B11R1.1 COCOc1cnc(nc1)C fa5cdcf151bf24cfb63e951238dc42d4 [0,1,0,0,0,0|3,0,0]=4 327 B11R1.1 COCOc1cnc(nc1)Cl a08aba6dd530a941dbc279bd9d956081 [0,1,0,0,0,0|3,0,0]=4 328 B11R1.1 COCOc1ncc(cn1)Br 505cbff5d528a428b7690e3ef753c405 [0,1,0,0,0,0|3,0,0]=4 329 B11R1.1 COCOc1ncc(cn1)C 50f0b838a9b5c65cb4225d6db9edb1bb [0,1,0,0,0,0|3,0,0]=4 330 B11R1.1 COCOc1ncc(cn1)F ec6bc92a19e0a3aa7aef36e817859c72 [0,1,0,0,0,0|3,0,0]=4 331 B11R1.1 COCOc1ncc(cn1)I 31a26d9a7f54437d947a0aa61c04694c [0,1,0,0,0,0|3,0,0]=4 332 B11R1.1 CSCNc1ccc(=O)[nH]c1 62ab78a03567958267bec0430980ef6f [0,1,0,0,0,0|2,1,0]=4 333 B11R1.1 CSCNc1ccc(cc1)Br 7d08b9f3e3f2fe34f6d8e854d51e1202 [0,1,0,0,0,0|1,1,0]=3 334 B11R1.1 CSCNc1ccc(cc1)C 7cc547f88ae9a9501b6ce615095d8aea [0,1,0,0,0,0|1,1,0]=3 335 B11R1.1 CSCNc1ccc(cc1)Cl bf742730b893efd050ccc2ddd2ce37af [0,1,0,0,0,0|1,1,0]=3 336 B11R1.1 CSCNc1ccc(cc1)F 475459e06b9cf82ddf55d707b377d320 [0,1,0,0,0,0|1,1,0]=3 337 B11R1.1 CSCNc1ccc(cc1)I 8b3c0b54c1e3dd9102ae085ef652923c [0,1,0,0,0,0|1,1,0]=3 338 B11R1.1 CSCNc1ccc(cc1)S b2c1b0484112c3320d0a0a482bf3fabe [0,1,0,0,0,0|1,1,0]=3 339 B11R1.1 CSCNc1ccc(cn1)Br d92ad14722de594cb72f592378f03b0e [0,1,0,0,0,0|2,1,0]=4 340 B11R1.1 CSCNc1ccc(cn1)C 7d8d228d08f638bf041a5d3c93910cdd [0,1,0,0,0,0|2,1,0]=4 341 B11R1.1 CSCNc1ccc(cn1)Cl b04370fd562137475983ddbca974054e [0,1,0,0,0,0|2,1,0]=4 342 B11R1.1 CSCNc1ccc(cn1)F 309f8c513d2fecfdc07e9f1a2e722d64 [0,1,0,0,0,0|2,1,0]=4 343 B11R1.1 CSCNc1ccc(cn1)I f5ba8214d3f7399c81b46c05a2c196a8 [0,1,0,0,0,0|2,1,0]=4 344 B11R1.1 CSCNc1ccc(nc1)Br 6a609440b229d0b06de8f79f20e90478 [0,1,0,0,0,0|2,1,0]=4 345 B11R1.1 CSCNc1ccc(nc1)C 3e2aaf6e003a3767539d4b7570883155 [0,1,0,0,0,0|2,1,0]=4 346 B11R1.1 CSCNc1ccc(nc1)Cl 00441936874621936042ff7229e394eb [0,1,0,0,0,0|2,1,0]=4 347 B11R1.1 CSCNc1ccc(nc1)F 59038a01298afe984646cd59d604ccfe [0,1,0,0,0,0|2,1,0]=4 348 B11R1.1 CSCNc1ccc(nc1)I 65b43c6bdcf6ea95fd2666b65cb6a0f7 [0,1,0,0,0,0|2,1,0]=4 349 B11R1.1 CSCOc1ccc(cc1)Br f5a0542c9ba04fa96a3d6a460de6215d [0,1,0,0,0,0|1,1,0]=3 350 B11R1.1 CSCOc1ccc(cc1)C 35277f269b6e4bad5ee1cc6923a583fd [0,1,0,0,0,0|1,1,0]=3 351 B11R1.1 CSCOc1ccc(cc1)Cl 818101ab26ff3d96beedc8f3f9d2fff2 [0,1,0,0,0,0|1,1,0]=3 352 B11R1.1 CSCOc1ccc(cc1)F aa65f6b5260241febe6e598cb66d47bd [0,1,0,0,0,0|1,1,0]=3 353 B11R1.1 CSCOc1ccc(cc1)I 0cc9619b354e201460eaff3ce7c4b6e3 [0,1,0,0,0,0|1,1,0]=3 354 B11R1.1 CSCOc1ccc(cc1)S 5eb766d81a2c5ac1d793ebde9bbc88c4 [0,1,0,0,0,0|1,1,0]=3 355 B11R1.1 CSCOc1ccc(cn1)C 23dab940603659dd1961d8dabf9e9d54 [0,1,0,0,0,0|2,1,0]=4 356 B11R1.1 CSCOc1ccc(cn1)Cl 267a2b42ae207e68f7e607ae81db2125 [0,1,0,0,0,0|2,1,0]=4 357 B11R1.1 CSCOc1ccc(cn1)F 5369a20d0af3e7b5d9bf45f8e5768082 [0,1,0,0,0,0|2,1,0]=4 358 B11R1.1 CSCOc1ccc(cn1)I 2e95527b9e2725ee105d852c39d59c2e [0,1,0,0,0,0|2,1,0]=4 359 B11R1.1 CSCOc1ccc(nc1)Br 78fdb59d6147dc2019e0a9b544f5eaf0 [0,1,0,0,0,0|2,1,0]=4 360 B11R1.1 CSCOc1ccc(nc1)C 6f8114890842d135092685d5d6777a64 [0,1,0,0,0,0|2,1,0]=4 361 B11R1.1 CSCOc1ccc(nc1)Cl 5d811a91df457bcf86d230ee079bbd08 [0,1,0,0,0,0|2,1,0]=4 362 B11R1.1 CSCOc1ccc(nc1)F de88ffba7cf9851ecec71607a72fd7cd [0,1,0,0,0,0|2,1,0]=4 363 B11R1.1 CSCOc1ccc(nc1)I 89a292478202e53919068cdff48480a8 [0,1,0,0,0,0|2,1,0]=4 364 B11R1.1 Cc1ccc(cc1)CNC#N 71ef650b7559551102b125c1e29d68e5 [0,1,0,0,0,0|3,0,0]=4 365 B11R1.1 Cc1ccc(cc1)CNC=O f28e952319097b22b95735c4699de02f [0,1,0,0,0,0|3,0,0]=4 366 B11R1.1 Cc1ccc(cc1)CNCF 3d235376bf58ba37ce4fc4687e7358b9 [0,1,0,0,0,0|3,0,0]=4 367 B11R1.1 Cc1ccc(cc1)CNCO a64a75f18e5667093ebf917d1b07eefc [0,1,0,0,0,0|3,0,0]=4 368 B11R1.1 Cc1ccc(cc1)COCF be23a3cdf78a8f91f485a087d32e2751 [0,1,0,0,0,0|3,0,0]=4 369 B11R1.1 Cc1ccc(cc1)NCC#N 136b2c6b9bc1df5a3223827f88881879 [0,1,0,0,0,0|3,0,0]=4 370 B11R1.1 Cc1ccc(cc1)NCC=O 4fda9751a355cee6e87b68007294a6d1 [0,1,0,0,0,0|3,0,0]=4 371 B11R1.1 Cc1ccc(cc1)NCCF 386681a63315a2a02458b9e317339172 [0,1,0,0,0,0|3,0,0]=4 372 B11R1.1 Cc1ccc(cc1)NCCI 021b0820ca00ee1bd1c722072e28fcea [0,1,0,0,0,0|3,0,0]=4 373 B11R1.1 Cc1ccc(cc1)NCCO c023022501f62f6373bdd984b07a8e61 [0,1,0,0,0,0|3,0,0]=4 374 B11R1.1 Cc1ccc(cc1)NCCS 6ed2fe969f35f3c0b0884c2a5f799763 [0,1,0,0,0,0|3,0,0]=4 375 B11R1.1 Cc1ccc(cc1)OCC#N 86188396c995adc062c1161e026ae446 [0,1,0,0,0,0|3,0,0]=4 376 B11R1.1 Cc1ccc(cc1)OCC=O 162ce958ced72925305b1c018b7b9598 [0,1,0,0,0,0|3,0,0]=4 377 B11R1.1 Cc1ccc(cc1)OCCF e658fde0065759000a395a993eb3f831 [0,1,0,0,0,0|3,0,0]=4 378 B11R1.1 Cc1ccc(cc1)OCCS 11a5d5c742743cac8e072d93bc1a4fc6 [0,1,0,0,0,0|3,0,0]=4 379 B11R1.1 FCCNc1ccc(cc1)Br 795a720a4c9b19afbc5301fa123947f2 [0,1,0,0,0,0|3,0,0]=4 380 B11R1.1 FCCNc1ccc(cc1)Cl e3d2a59ab56b1cb94b6555756f53e4df [0,1,0,0,0,0|3,0,0]=4 381 B11R1.1 FCCNc1ccc(cc1)F 7c335ec10923f1e5e1c0a802d22815aa [0,1,0,0,0,0|3,0,0]=4 382 B11R1.1 FCCNc1ccc(cc1)I 7a3114f1b82f1ae9c3e9d91f867c2aec [0,1,0,0,0,0|3,0,0]=4 383 B11R1.1 FCCNc1ccc(cc1)S 4cf1191b5d4fa0438db5fb212abc0568 [0,1,0,0,0,0|3,0,0]=4 384 B11R1.1 FCCOc1ccc(cc1)Br 44af21b9bd08ebef7a3593bbf1c00f13 [0,1,0,0,0,0|3,0,0]=4 385 B11R1.1 FCCOc1ccc(cc1)Cl f8953730f3c70ba1c351ddf061f5adb9 [0,1,0,0,0,0|3,0,0]=4 386 B11R1.1 FCCOc1ccc(cc1)F b8491737d875b8a9ba1853dfb7c71826 [0,1,0,0,0,0|3,0,0]=4 387 B11R1.1 FCCOc1ccc(cc1)I b3c3da697e2c7b319e1842d4b6e652a6 [0,1,0,0,0,0|3,0,0]=4 388 B11R1.1 FCCOc1ccc(cc1)S c0287c49d3bee2c771e7d9f8b8b1a91d [0,1,0,0,0,0|3,0,0]=4 389 B11R1.1 FCNCc1ccc(cc1)Br b716c1dcd41bf6fd6d535897c1b8ce0c [0,1,0,0,0,0|3,0,0]=4 390 B11R1.1 FCNCc1ccc(cc1)Cl 699409f205c611587d6f375bf5f31fce [0,1,0,0,0,0|3,0,0]=4 391 B11R1.1 FCNCc1ccc(cc1)F 25a744931aeb914e659c9f9632eb93fc [0,1,0,0,0,0|3,0,0]=4 392 B11R1.1 FCNCc1ccc(cc1)I d9e1151471912873877eda8a2b6050e5 [0,1,0,0,0,0|3,0,0]=4 393 B11R1.1 FCOCc1ccc(cc1)Br 5272f40abeb8f9788218e0855efe7f99 [0,1,0,0,0,0|3,0,0]=4 394 B11R1.1 FCOCc1ccc(cc1)Cl a424b465d05ec98f468ea1690dfb41e3 [0,1,0,0,0,0|3,0,0]=4 395 B11R1.1 FCOCc1ccc(cc1)F 40afdc034cb36d38932d0008a2d4420f [0,1,0,0,0,0|3,0,0]=4 396 B11R1.1 FCOCc1ccc(cc1)I 614cbd3d7d1898e18b49cf57a3be3c96 [0,1,0,0,0,0|3,0,0]=4 397 B11R1.1 FCOCc1ccc(cc1)S caeca7060fe6aa9edb0562b9e232c2bd [0,1,0,0,0,0|3,0,0]=4 398 B11R1.1 Fc1ccc(cc1)NCCS 96eb09cf1d4b57152e2f391fd4e4c79f [0,1,0,0,0,0|3,0,0]=4 399 B11R1.1 Fc1ccc(cc1)OCCS c98699e8299c427f19ef74ef43ecdb98 [0,1,0,0,0,0|3,0,0]=4 400 B11R1.1 N#CCNc1ccc(cc1)Br b186aa23ff1df063ca5f8ad1421ecf46 [0,1,0,0,0,0|3,0,0]=4 401 B11R1.1 N#CCNc1ccc(cc1)Cl 653168c81073969062d8b2f17ccc8652 [0,1,0,0,0,0|3,0,0]=4 402 B11R1.1 N#CCNc1ccc(cc1)F cb4dae95e3d3051c4a5f6253ca80a7e9 [0,1,0,0,0,0|3,0,0]=4 403 B11R1.1 N#CCNc1ccc(cc1)I 27a289db796165d1e6f70f28f898e7b3 [0,1,0,0,0,0|3,0,0]=4 404 B11R1.1 N#CCNc1ccc(cc1)S e169fab1d9fae0a8626bd29bae3c20f2 [0,1,0,0,0,0|3,0,0]=4 405 B11R1.1 N#CCOc1ccc(cc1)Br 871254db56e2004e5847895d62a14d29 [0,1,0,0,0,0|3,0,0]=4 406 B11R1.1 N#CCOc1ccc(cc1)Cl 8778ae1e60991761c1a89b37bdae4929 [0,1,0,0,0,0|3,0,0]=4 407 B11R1.1 N#CCOc1ccc(cc1)F ecca40fe5c4bd91fe61102849dbbcff2 [0,1,0,0,0,0|3,0,0]=4 408 B11R1.1 N#CCOc1ccc(cc1)I f0ce4f5c32a6a21ca0e603fc0719ce66 [0,1,0,0,0,0|3,0,0]=4 409 B11R1.1 N#CCOc1ccc(cc1)S f723defc19cd9ff58e26aa13ad60ba6a [0,1,0,0,0,0|3,0,0]=4 410 B11R1.1 N#CNCc1ccc(cc1)Br 993e0e7882cdada4212fab51ab99fd4a [0,1,0,0,0,0|3,0,0]=4 411 B11R1.1 N#CNCc1ccc(cc1)Cl 861b33c898d9d0c01d6886a209a9f6fd [0,1,0,0,0,0|3,0,0]=4 412 B11R1.1 N#CNCc1ccc(cc1)F 35391210e85115eb408aff1e93261827 [0,1,0,0,0,0|3,0,0]=4 413 B11R1.1 N#CNCc1ccc(cc1)I df16ce3684587d85b581fd53fe8f98ff [0,1,0,0,0,0|3,0,0]=4 414 B11R1.1 O=CCNc1ccc(cc1)Br 067d274438faf6d9fcab66fd29258ceb [0,1,0,0,0,0|3,0,0]=4 415 B11R1.1 O=CCNc1ccc(cc1)Cl 41b414055a7467fa4ebaefd379ab1983 [0,1,0,0,0,0|3,0,0]=4 416 B11R1.1 O=CCNc1ccc(cc1)F 9418682bb19d7c85499b950cc4c78703 [0,1,0,0,0,0|3,0,0]=4 417 B11R1.1 O=CCNc1ccc(cc1)I 462a43a2f94fdd33735b683d048a6cd2 [0,1,0,0,0,0|3,0,0]=4 418 B11R1.1 O=CCNc1ccc(cc1)S 41cbf28e78476350d293660db103d06a [0,1,0,0,0,0|3,0,0]=4 419 B11R1.1 O=CCOc1ccc(cc1)Br def7cf0118e06efe61ec327fa54d11e7 [0,1,0,0,0,0|3,0,0]=4 420 B11R1.1 O=CCOc1ccc(cc1)Cl bcb6224d95a5b97cffcadb5c4c5a4052 [0,1,0,0,0,0|3,0,0]=4 421 B11R1.1 O=CCOc1ccc(cc1)F a06e8c0a346f32fa4e5da7005cc6fb47 [0,1,0,0,0,0|3,0,0]=4 422 B11R1.1 O=CCOc1ccc(cc1)I 09bd69e9ed964a5fd067081d62efe043 [0,1,0,0,0,0|3,0,0]=4 423 B11R1.1 O=CCOc1ccc(cc1)S 51195d57e8dd52ea3f1d1dcd968cb246 [0,1,0,0,0,0|3,0,0]=4 424 B11R1.1 O=CNCc1ccc(cc1)Br 7fdb86c6f5b6081ac41b52a92cf2f5e3 [0,1,0,0,0,0|3,0,0]=4 425 B11R1.1 O=CNCc1ccc(cc1)Cl 8ffb7078771c32a3c5bc07dbadbb86a6 [0,1,0,0,0,0|3,0,0]=4 426 B11R1.1 O=CNCc1ccc(cc1)F 3e4ad2d82aa5aa82d165556940f63f30 [0,1,0,0,0,0|3,0,0]=4 427 B11R1.1 O=CNCc1ccc(cc1)I d9e15a2b5847e4b3042d0429177d8bdb [0,1,0,0,0,0|3,0,0]=4 428 B11R1.1 O=CNCc1ccc(cc1)O b53af60aaa3757bc79f5fc548fffc7cb [0,1,0,0,0,0|3,0,0]=4 429 B11R1.1 OCCNc1ccc(cc1)Br 535465584ac9d4ff57889448ec1b0af0 [0,1,0,0,0,0|3,0,0]=4 430 B11R1.1 OCCNc1ccc(cc1)Cl 4d55580a2576d97655667590feb9394c [0,1,0,0,0,0|3,0,0]=4 431 B11R1.1 OCCNc1ccc(cc1)F f0dccf24099a23c54c8c24ea89525ac0 [0,1,0,0,0,0|3,0,0]=4 432 B11R1.1 OCCNc1ccc(cc1)I 9010f3f5111bb57e7ee5fcc7037cafde [0,1,0,0,0,0|3,0,0]=4 433 B11R1.1 OCCNc1ccc(cc1)S 4de960e6b8963c27bc320732a003972b [0,1,0,0,0,0|3,0,0]=4 434 B11R1.1 OCNCc1ccc(cc1)Br 29941d371c032fabf1b94e49679e2b91 [0,1,0,0,0,0|3,0,0]=4 435 B11R1.1 OCNCc1ccc(cc1)Cl 66d7e1612c59e389035460da5f165c29 [0,1,0,0,0,0|3,0,0]=4 436 B11R1.1 OCNCc1ccc(cc1)F e82a245e5fea20cb06713ef60eb282ff [0,1,0,0,0,0|3,0,0]=4 437 B11R1.1 OCNCc1ccc(cc1)I bba7fc5edf7c0932c8de644faad89e3d [0,1,0,0,0,0|3,0,0]=4 438 B11R1.1 SCCNc1ccc(cc1)Br 41e93a2a025b2d31a08348072d46995d [0,1,0,0,0,0|3,0,0]=4 439 B11R1.1 SCCNc1ccc(cc1)Cl ee69b35444ec478b79ac20b53c76c74b [0,1,0,0,0,0|3,0,0]=4 440 B11R1.1 SCCNc1ccc(cc1)I feb446bc7f74f6fc3358374bc85a5fa6 [0,1,0,0,0,0|3,0,0]=4 441 B11R1.1 SCCNc1ccc(cc1)S 2b2c1e7e53c6fe298543f5113fe04de1 [0,1,0,0,0,0|3,0,0]=4 442 B11R1.1 SCCOc1ccc(cc1)Br bec71d6fa1c3471b8eb02dbdf51052b8 [0,1,0,0,0,0|3,0,0]=4 443 B11R1.1 SCCOc1ccc(cc1)Cl 4097eb53f6e8a186542d58da584632ba [0,1,0,0,0,0|3,0,0]=4 444 B11R1.1 SCCOc1ccc(cc1)I d7cb4bc51a02120fb1493ad10574d07c [0,1,0,0,0,0|3,0,0]=4 445 B11R1.1 SCCOc1ccc(cc1)S 82e09f61a6f4576bab72abe9784dd780 [0,1,0,0,0,0|3,0,0]=4 446 B11R1.1 Sc1ccc(cc1)NCCBr 2fd36e3b90e35bd113cc6aa6559ccbb3 [0,1,0,0,0,0|3,0,0]=4 447 B11R1.1 Sc1ccc(cc1)NCCI 3102b13fbfd44fa9c9c245c461b01292 [0,1,0,0,0,0|3,0,0]=4 448 B11R1.16 C#CCN(C)c1ccccc1 3ca89e194431e8e98a41325339f135b2 [0,1,0,0,0,0|2,0,1]=4 449 B11R1.16 C=CCN(C)c1ccccc1 cb57bdb31a063701918aa00f058638bf [0,1,0,0,0,0|2,0,1]=4 450 B11R1.16 CC(NC=O)c1ccccc1 912f825ae8ec09ad8cb929f90e443d73 [0,1,0,0,0,0|3,0,0]=4 451 B11R1.16 CC(OCF)c1ccccc1 a5a4510633c1500ac034b294490d7f65 [0,1,0,0,0,0|3,0,0]=4 452 B11R1.16 CCCN(C)c1ccccc1 5333b12ce18e2a38096b8e486fed114a [0,1,0,0,0,0|2,0,0]=3 453 B11R1.16 CCCN(C)c1ccccn1 8ff1db8620efe8553f2af13d547cf9e1 [0,1,0,0,0,0|3,0,0]=4 454 B11R1.16 CCCN(C)c1cccnc1 28cb54c9c808eaf7ba52852976110e8a [0,1,0,0,0,0|3,0,0]=4 455 B11R1.16 CCCN(C)c1ccncc1 f3869aa81991c685d55848e048247f3e [0,1,0,0,0,0|3,0,0]=4 456 B11R1.16 CCNC(C)c1ccccc1 af03e39d181c5fd668bda5d6f7d06e14 [0,1,0,0,0,0|2,0,0]=3 457 B11R1.16 CCNC(C)c1ccccn1 1349d82fdb3aca31d54d33a892f4429f [0,1,0,0,0,0|3,0,0]=4 458 B11R1.16 CCNC(C)c1cccnc1 c47433cc5cae1ddbdb53f6ca3e6bfaaf [0,1,0,0,0,0|3,0,0]=4 459 B11R1.16 CCNC(C)c1ccncc1 4381b6d20643b9397cf1c3275f14ef7f [0,1,0,0,0,0|3,0,0]=4 460 B11R1.16 CCN[C@@H](C)c1ccccc1 994b5b0b50363ecab1efd5b7f9e6d7cd [0,1,0,0,0,0|2,0,0]=3 461 B11R1.16 CCN[C@@H](C)c1ccccn1 6becaa5dd299afbde8d9e40b8df2b64b [0,1,0,0,0,0|3,0,0]=4 462 B11R1.16 CCN[C@@H](C)c1cccnc1 330151f91eef2953e097f24cd8fe5255 [0,1,0,0,0,0|3,0,0]=4 463 B11R1.16 CCN[C@@H](C)c1ccncc1 00312d91ebda62098fbd65a2d65ba17c [0,1,0,0,0,0|3,0,0]=4 464 B11R1.16 CCN[C@H](C)c1ccccc1 af432512ad94856da6ef9d44592c3502 [0,1,0,0,0,0|2,0,0]=3 465 B11R1.16 CCN[C@H](C)c1ccccn1 de5b9d337b6c15bb985fd6d76426b016 [0,1,0,0,0,0|3,0,0]=4 466 B11R1.16 CCN[C@H](C)c1cccnc1 7cb1b35ff9549b4a705f07ae86659632 [0,1,0,0,0,0|3,0,0]=4 467 B11R1.16 CCN[C@H](C)c1ccncc1 d9dd8baf03e60276588d8bf323f0d599 [0,1,0,0,0,0|3,0,0]=4 468 B11R1.16 CCOC(C)c1ccccc1 37108e833ff536d25c550cb5b37c873d [0,1,0,0,0,0|2,0,0]=3 469 B11R1.16 CCOC(C)c1ccccn1 2349fef21e807c42cd2b612eadfb89fd [0,1,0,0,0,0|3,0,0]=4 470 B11R1.16 CCOC(C)c1cccnc1 9c9e8ee26a948f6734fe8bca4ac259d1 [0,1,0,0,0,0|3,0,0]=4 471 B11R1.16 CCOC(C)c1ccncc1 e4e418e4b9933d9ffab69561c2ee0b8d [0,1,0,0,0,0|3,0,0]=4 472 B11R1.16 CCO[C@@H](C)c1ccccc1 e4f11a13dd3f609e6f25ac3a3b969fe2 [0,1,0,0,0,0|2,0,0]=3 473 B11R1.16 CCO[C@@H](C)c1ccccn1 d31d85c16530817c2b81fb1a03fe7e57 [0,1,0,0,0,0|3,0,0]=4 474 B11R1.16 CCO[C@@H](C)c1cccnc1 4f79e80bc80f924c1d9263e4c7a80e48 [0,1,0,0,0,0|3,0,0]=4 475 B11R1.16 CCO[C@@H](C)c1ccncc1 10c7e45b7f2432aed0d2d85f0e9de43f [0,1,0,0,0,0|3,0,0]=4 476 B11R1.16 CCO[C@H](C)c1ccccc1 54694971b3853f962e687b61e7c698c1 [0,1,0,0,0,0|2,0,0]=3 477 B11R1.16 CCO[C@H](C)c1ccccn1 c768b24f1cd72ff8137851b753ae2d04 [0,1,0,0,0,0|3,0,0]=4 478 B11R1.16 CCO[C@H](C)c1cccnc1 cd637b20fb4bf525c6de41c7953f4069 [0,1,0,0,0,0|3,0,0]=4 479 B11R1.16 CCO[C@H](C)c1ccncc1 be826d73c7c9b4a2a044295b6bfe0a2c [0,1,0,0,0,0|3,0,0]=4 480 B11R1.16 CN(CC#N)c1ccccc1 e4996d8d05652ac5f69757d7a543c8c3 [0,1,0,0,0,0|3,0,0]=4 481 B11R1.16 CN(CC=O)c1ccccc1 669b7315010cb1229c9893a5bac75e38 [0,1,0,0,0,0|3,0,0]=4 482 B11R1.16 CN(CCF)c1ccccc1 10541e2e32dac0db7a85ea44620c0e3e [0,1,0,0,0,0|3,0,0]=4 483 B11R1.16 CN(CCO)c1ccccc1 4b734b8d391d02ddf47f0308fb1d22c8 [0,1,0,0,0,0|3,0,0]=4 484 B11R1.16 COCN(C)c1ccccc1 6231e4bc9ebe3bdb02fd15faeb34634f [0,1,0,0,0,0|1,0,0]=2 485 B11R1.16 COCN(C)c1ccccn1 66cbdeedae67899dab62ab4e4b9abfe2 [0,1,0,0,0,0|2,0,0]=3 486 B11R1.16 COCN(C)c1cccnc1 eee1a900430cbd2ead764847823e4249 [0,1,0,0,0,0|2,0,0]=3 487 B11R1.16 COCN(C)c1cccnn1 755489683a693b6a18f20e0a9ebb9a58 [0,1,0,0,0,0|3,0,0]=4 488 B11R1.16 COCN(C)c1ccncc1 844858b0bf6accc4b68ce8147d0d88ed [0,1,0,0,0,0|2,0,0]=3 489 B11R1.16 COCN(C)c1ccncn1 ea5756f068e225b678955c655513531f [0,1,0,0,0,0|3,0,0]=4 490 B11R1.16 COCN(C)c1ccnnc1 66385b4435ffe50578820ae25466c284 [0,1,0,0,0,0|3,0,0]=4 491 B11R1.16 COCN(C)c1cnccn1 a76b0fd1dcf67b9f677e7bf23a60c424 [0,1,0,0,0,0|3,0,0]=4 492 B11R1.16 COCN(C)c1cncnc1 01d278c0238323e21d04220622ef8fcb [0,1,0,0,0,0|3,0,0]=4 493 B11R1.16 COCN(C)c1ncccn1 891bd6671cd8718e529b1f54cdc81ac8 [0,1,0,0,0,0|3,0,0]=4 494 B11R1.16 CSCN(C)c1ccccc1 6fe637e44a17092ac12098dbdcb5352f [0,1,0,0,0,0|1,1,0]=3 495 B11R1.16 CSCN(C)c1ccccn1 b50faf9300869282fdd09bc9d262195a [0,1,0,0,0,0|2,1,0]=4 496 B11R1.16 CSCN(C)c1cccnc1 85210a97edc62a2031929b5c7394c57b [0,1,0,0,0,0|2,1,0]=4 497 B11R1.16 CSCN(C)c1ccncc1 4f774618b2036be44522889267e87b2f [0,1,0,0,0,0|2,1,0]=4 498 B11R1.16 C[C@@H](NC=O)c1ccccc1 ed3cbc790dab943801487e30e3a37c11 [0,1,0,0,0,0|3,0,0]=4 499 B11R1.16 C[C@@H](OCF)c1ccccc1 f6dc1405e5744871891f84657f997fd4 [0,1,0,0,0,0|3,0,0]=4 500 B11R1.16 C[C@H](NC=O)c1ccccc1 0ca5dec48ba28ecff3cefea41bc874f0 [0,1,0,0,0,0|3,0,0]=4 501 B11R1.16 C[C@H](OCF)c1ccccc1 0bdd092ad3daed19f52c193b52481cfc [0,1,0,0,0,0|3,0,0]=4 502 B11R1.17 C#CCNc1ccccc1Cl 49593183fb9959b3f4cb0298fb5cee58 [0,1,0,0,0,0|2,0,1]=4 503 B11R1.17 C#CCNc1ccccc1F c0d4540207992398f450961e31fa0194 [0,1,0,0,0,0|2,0,1]=4 504 B11R1.17 C#CCNc1ccccc1I 7b51ebd2871bb0e184045a8cdf6d66d9 [0,1,0,0,0,0|2,0,1]=4 505 B11R1.17 C#CCOc1ccccc1Br fe1ac72c77dfb406014d1926ff78c2fd [0,1,0,0,0,0|2,0,1]=4 506 B11R1.17 C#CCOc1ccccc1C 864e1e3c9f9da9eeb19be48cda1d2952 [0,1,0,0,0,0|2,0,1]=4 507 B11R1.17 C#CCOc1ccccc1Cl ac0081f46ae6ca47ec07c387a9aff46c [0,1,0,0,0,0|2,0,1]=4 508 B11R1.17 C#CCOc1ccccc1F 45206938663dc5d59f458a433382d447 [0,1,0,0,0,0|2,0,1]=4 509 B11R1.17 C#CCOc1ccccc1S 926aaf157f925ef16cefb594a23cdb0e [0,1,0,0,0,0|2,0,1]=4 510 B11R1.17 C=CCNc1ccccc1Br 45171f98de3cf055ad8296095abf8a72 [0,1,0,0,0,0|2,0,1]=4 511 B11R1.17 C=CCNc1ccccc1C 227804e9ec39e8a3152168e4771a33a4 [0,1,0,0,0,0|2,0,1]=4 512 B11R1.17 C=CCNc1ccccc1Cl 22feb608c0b85e4420084046341860a2 [0,1,0,0,0,0|2,0,1]=4 513 B11R1.17 C=CCNc1ccccc1F 63452e5c6ec5ab9693bd6664ca8dd13b [0,1,0,0,0,0|2,0,1]=4 514 B11R1.17 C=CCNc1ccccc1I d363c07fc1f12e6cff19384ac05ea9d2 [0,1,0,0,0,0|2,0,1]=4 515 B11R1.17 C=CCNc1ccccc1S 9618c19886e595bcf2b31b8101182f0f [0,1,0,0,0,0|2,0,1]=4 516 B11R1.17 C=CCOc1ccccc1Br 4219c528216a56e11dfd4a15041b71e9 [0,1,0,0,0,0|2,0,1]=4 517 B11R1.17 C=CCOc1ccccc1C 420c56a798f432c55ab7076030ddf302 [0,1,0,0,0,0|2,0,1]=4 518 B11R1.17 C=CCOc1ccccc1Cl 60d7332fdfafa715c60cd99db260ce28 [0,1,0,0,0,0|2,0,1]=4 519 B11R1.17 C=CCOc1ccccc1F cfe0e61e867eaa1bb6bf5b2b171e2161 [0,1,0,0,0,0|2,0,1]=4 520 B11R1.17 C=CCOc1ccccc1I ffdd736d21d64cd3e87dc3be0d6164f1 [0,1,0,0,0,0|2,0,1]=4 521 B11R1.17 C=CCOc1ccccc1S c76936b9ce1c64eb66f6caeb41aad97f [0,1,0,0,0,0|2,0,1]=4 522 B11R1.17 CCCNc1c[nH]ccc1=O 30490874c6a3d6f814f9956a624f9fd7 [0,1,0,0,0,0|3,0,0]=4 523 B11R1.17 CCCNc1c[nH]ccc1=S 5028a294c65f2e90d2d2851d905f870a [0,1,0,0,0,0|3,0,0]=4 524 B11R1.17 CCCNc1ccc[nH]c1=S 95b7466acbed8c0b7f8cbffc47d54420 [0,1,0,0,0,0|3,0,0]=4 525 B11R1.17 CCCNc1cccc[n+]1[O-] 9aa6a23beaed595bd0e08509502f2e88 [0,1,0,0,0,0|3,0,0]=4 526 B11R1.17 CCCNc1ccccc1Cl f06644db92e5a5e5c88ba3d72e76b09c [0,1,0,0,0,0|2,0,0]=3 527 B11R1.17 CCCNc1ccccc1F b26d422a9020f42016e9a773ea4da59b [0,1,0,0,0,0|2,0,0]=3 528 B11R1.17 CCCNc1ccccc1I 9667c1f0fcc826e8e0c3d31e03051206 [0,1,0,0,0,0|2,0,0]=3 529 B11R1.17 CCCNc1cccnc1Br 806ab32b880ec60eaa8de37c8b9a09b3 [0,1,0,0,0,0|3,0,0]=4 530 B11R1.17 CCCNc1cccnc1C 22a2471d4061d7e8b2734dc78b59847f [0,1,0,0,0,0|3,0,0]=4 531 B11R1.17 CCCNc1cccnc1Cl d863e25eb1d7fae0beb4f2a560b9b1a5 [0,1,0,0,0,0|3,0,0]=4 532 B11R1.17 CCCNc1cccnc1F 6429f1513f49f5fa6ff7fe16885b526b [0,1,0,0,0,0|3,0,0]=4 533 B11R1.17 CCCNc1cccnc1I 9bb718503ad944c42a1784cec5f7c8f8 [0,1,0,0,0,0|3,0,0]=4 534 B11R1.17 CCCNc1ccncc1Br 5baccc8ac20f503351c093fe202f5f71 [0,1,0,0,0,0|3,0,0]=4 535 B11R1.17 CCCNc1ccncc1C ed096cc09ac09389a33110eb02659afe [0,1,0,0,0,0|3,0,0]=4 536 B11R1.17 CCCNc1ccncc1Cl caa35332e0171bc74c66981862eeba0a [0,1,0,0,0,0|3,0,0]=4 537 B11R1.17 CCCNc1ccncc1F 4edd1964ca584c942ef3c4bc7c8fe94f [0,1,0,0,0,0|3,0,0]=4 538 B11R1.17 CCCNc1ccncc1I 816ce29e0ba508b65573d6a0f07ce58d [0,1,0,0,0,0|3,0,0]=4 539 B11R1.17 CCCNc1cnccc1Br 007b289babfb84404970e908ef031a59 [0,1,0,0,0,0|3,0,0]=4 540 B11R1.17 CCCNc1cnccc1C dcefa786e0d72c346e2c2a750f3eb355 [0,1,0,0,0,0|3,0,0]=4 541 B11R1.17 CCCNc1cnccc1Cl 2b75a2dd8a9c947a7db5a224583f2e53 [0,1,0,0,0,0|3,0,0]=4 542 B11R1.17 CCCNc1cnccc1F 0c96675d5ae34365508907ee1228ef3a [0,1,0,0,0,0|3,0,0]=4 543 B11R1.17 CCCNc1cnccc1I 39c336e4f6a77f3ce348958797714058 [0,1,0,0,0,0|3,0,0]=4 544 B11R1.17 CCCNc1ncccc1Br afdad602cc18eba6538110beb8225730 [0,1,0,0,0,0|3,0,0]=4 545 B11R1.17 CCCNc1ncccc1C abec0375ee082a7d48f7cf43776cf112 [0,1,0,0,0,0|3,0,0]=4 546 B11R1.17 CCCNc1ncccc1Cl b509a2ca435f1e67a922e5764a1cf9c5 [0,1,0,0,0,0|3,0,0]=4 547 B11R1.17 CCCNc1ncccc1F af3a157f218544df912ffebf16be14cb [0,1,0,0,0,0|3,0,0]=4 548 B11R1.17 CCCNc1ncccc1I c4c7e827ce85817f94824160ced25561 [0,1,0,0,0,0|3,0,0]=4 549 B11R1.17 CCCOc1ccc[nH]c1=S 823c5427471293a6b4877bd1519315ca [0,1,0,0,0,0|3,0,0]=4 550 B11R1.17 CCCOc1cccc[n+]1[O-] 82deb6f6c59813d3c334fbb145a1cf35 [0,1,0,0,0,0|3,0,0]=4 551 B11R1.17 CCCOc1ccccc1C 6c1a4dc1e6028f3da6f849553f219900 [0,1,0,0,0,0|2,0,0]=3 552 B11R1.17 CCCOc1ccccc1Cl 4721246108b2629d9b8b29c6ad627685 [0,1,0,0,0,0|2,0,0]=3 553 B11R1.17 CCCOc1ccccc1F e002653ab86def653a9f4f2e92420612 [0,1,0,0,0,0|2,0,0]=3 554 B11R1.17 CCCOc1ccccc1I 2ec532f87a4a1971649b297302a06402 [0,1,0,0,0,0|2,0,0]=3 555 B11R1.17 CCCOc1ccccc1S a0d26031bd542d5d05da52b2adf5a399 [0,1,0,0,0,0|2,0,0]=3 556 B11R1.17 CCCOc1cccnc1Br 115afbdd34d18eb1d8ab3c1f8d43d3be [0,1,0,0,0,0|3,0,0]=4 557 B11R1.17 CCCOc1cccnc1C 1ed437f8fbe2f5e0b870ba84e31d17c0 [0,1,0,0,0,0|3,0,0]=4 558 B11R1.17 CCCOc1cccnc1Cl edf30018692c32749c24b87a6d0498a1 [0,1,0,0,0,0|3,0,0]=4 559 B11R1.17 CCCOc1cccnc1F 5ee70f4822753bd9da31b99184a90a77 [0,1,0,0,0,0|3,0,0]=4 560 B11R1.17 CCCOc1cccnc1I 3e57bebc485592a1e6ceadbef8f3a8b5 [0,1,0,0,0,0|3,0,0]=4 561 B11R1.17 CCCOc1cccoc1=O 6138b137437ffe69557e48d4e459d7b1 [0,1,0,0,0,0|3,0,0]=4 562 B11R1.17 CCCOc1ccncc1Br d86fdc6f369361e6dd143014c3fcc95b [0,1,0,0,0,0|3,0,0]=4 563 B11R1.17 CCCOc1ccncc1C 3073b76d6073e61bbeb487a8fcbb554b [0,1,0,0,0,0|3,0,0]=4 564 B11R1.17 CCCOc1ccncc1Cl 2e20845339f1a9b7a13d7a11772fe9ba [0,1,0,0,0,0|3,0,0]=4 565 B11R1.17 CCCOc1ccncc1F d068a6fff4820cdae1a2251c79e22937 [0,1,0,0,0,0|3,0,0]=4 566 B11R1.17 CCCOc1cnccc1Br 33eee72d4b7297486d5285207fea74a8 [0,1,0,0,0,0|3,0,0]=4 567 B11R1.17 CCCOc1cnccc1C 45ff092a3d49118757409dc90c0d8b53 [0,1,0,0,0,0|3,0,0]=4 568 B11R1.17 CCCOc1cnccc1Cl 129434639f839466cae39279066d29a9 [0,1,0,0,0,0|3,0,0]=4 569 B11R1.17 CCCOc1cnccc1F 7275b9af8dd5f2cc96d1a4ae1db2b570 [0,1,0,0,0,0|3,0,0]=4 570 B11R1.17 CCCOc1cnccc1I 398d79496d40e0c234bb46c874339373 [0,1,0,0,0,0|3,0,0]=4 571 B11R1.17 CCCOc1coccc1=O b6bf03e1584dff0542ba5ae4918d593d [0,1,0,0,0,0|3,0,0]=4 572 B11R1.17 CCCOc1ncccc1Br 591cb4e29b3d78165b95627fad6003be [0,1,0,0,0,0|3,0,0]=4 573 B11R1.17 CCCOc1ncccc1C 75d7921d560a6b2f851a2acab9f2614a [0,1,0,0,0,0|3,0,0]=4 574 B11R1.17 CCCOc1ncccc1Cl 0a16720fcbf52b5cf544018f35b8eeec [0,1,0,0,0,0|3,0,0]=4 575 B11R1.17 CCCOc1ncccc1F ee3952c45bf36a13ea36600dcc4a174a [0,1,0,0,0,0|3,0,0]=4 576 B11R1.17 CCCOn1ccccc1=N c3e5c6befd39507962097d04a5993bb6 [0,1,0,0,0,0|3,0,0]=4 577 B11R1.17 CCCOn1ccccc1=O 92412e4a3e132ee80b8a961a7007d7f9 [0,1,0,0,0,0|3,0,0]=4 578 B11R1.17 CCCOn1ccccc1=S 7e6c660224fc15a11584e60a50320275 [0,1,0,0,0,0|3,0,0]=4 579 B11R1.17 CCNCc1cccc[n+]1[O-] 4482be04b13bf2a14654c2b7dc44e9ba [0,1,0,0,0,0|3,0,0]=4 580 B11R1.17 CCNCc1ccccc1Br 8f6bd2781373b66afc29396cae666f02 [0,1,0,0,0,0|2,0,0]=3 581 B11R1.17 CCNCc1ccccc1C 284345fa1eb882542c433fcb95919ca4 [0,1,0,0,0,0|2,0,0]=3 582 B11R1.17 CCNCc1ccccc1Cl db65b4e8d8ccf115e617990e552ab4c8 [0,1,0,0,0,0|2,0,0]=3 583 B11R1.17 CCNCc1ccccc1F 9048c9b0864184d75154ea96f3fe50b8 [0,1,0,0,0,0|2,0,0]=3 584 B11R1.17 CCNCc1ccccc1I d0f5abf080424e879ba8e6dfea920ca7 [0,1,0,0,0,0|2,0,0]=3 585 B11R1.17 CCNCc1cccnc1Br 32ff08bdc8b36f4fd72794d17b8094db [0,1,0,0,0,0|3,0,0]=4 586 B11R1.17 CCNCc1cccnc1C 0a1b3485e2e73031e3e3fc0c87c75e22 [0,1,0,0,0,0|3,0,0]=4 587 B11R1.17 CCNCc1cccnc1Cl 9f0320d1cb7ffe46922a86002c904be4 [0,1,0,0,0,0|3,0,0]=4 588 B11R1.17 CCNCc1cccnc1F 2e93965ca7c62978c851e96fc991f385 [0,1,0,0,0,0|3,0,0]=4 589 B11R1.17 CCNCc1ccncc1Br 4146c57719c4214353b9e0a0192ab294 [0,1,0,0,0,0|3,0,0]=4 590 B11R1.17 CCNCc1ccncc1C 959f5887b5695b7da0c1d9119cd1d02d [0,1,0,0,0,0|3,0,0]=4 591 B11R1.17 CCNCc1ccncc1Cl c88983b00bc64b2923854d4c84d9ac44 [0,1,0,0,0,0|3,0,0]=4 592 B11R1.17 CCNCc1ccncc1F b7377fd886bb5422ff2b6a184eefb6a7 [0,1,0,0,0,0|3,0,0]=4 593 B11R1.17 CCNCc1cnccc1C 4bf7654e6c7ab59c2c967e90494ba077 [0,1,0,0,0,0|3,0,0]=4 594 B11R1.17 CCNCc1ncccc1Br 09995fa96814a8c54c9bca09512a1c87 [0,1,0,0,0,0|3,0,0]=4 595 B11R1.17 CCNCc1ncccc1C 87bcb20686c74c1349ceb9aba049bbf8 [0,1,0,0,0,0|3,0,0]=4 596 B11R1.17 CCNCc1ncccc1Cl 3fcb8c6a497a9d9b3a48e230bfe378a1 [0,1,0,0,0,0|3,0,0]=4 597 B11R1.17 CCNCc1ncccc1F dda2cc3453d8ca1ee059e44555253881 [0,1,0,0,0,0|3,0,0]=4 598 B11R1.17 CCOCc1ccc[nH]c1=O 5a855846d572bde3e5fb10b6739b9742 [0,1,0,0,0,0|3,0,0]=4 599 B11R1.17 CCOCc1ccccc1C 939ca93b69bfa487d1d8ecb62c2d84e3 [0,1,0,0,0,0|2,0,0]=3 600 B11R1.17 CCOCc1ccccc1Cl e7556758f6c778f3c386ca652094b5cc [0,1,0,0,0,0|2,0,0]=3 601 B11R1.17 CCOCc1ccccc1F 5a297cb41f57dfedbabc975eceaf6126 [0,1,0,0,0,0|2,0,0]=3 602 B11R1.17 CCOCc1ccccc1I 7a255f979ee626f845777c39e07b9738 [0,1,0,0,0,0|2,0,0]=3 603 B11R1.17 CCOCc1cccnc1Br 84c896bbf791f636167b96d78239b3f5 [0,1,0,0,0,0|3,0,0]=4 604 B11R1.17 CCOCc1cccnc1C 10fe290309f01ddd76b919ada33fcfb8 [0,1,0,0,0,0|3,0,0]=4 605 B11R1.17 CCOCc1cccnc1Cl 0fdb01e029eba9fd77978b05f349ad64 [0,1,0,0,0,0|3,0,0]=4 606 B11R1.17 CCOCc1cccnc1F 26b203b8b1a12b477d6336928b6ab8d4 [0,1,0,0,0,0|3,0,0]=4 607 B11R1.17 CCOCc1ccncc1Br 7fea4acea2c5526a7051925c6a3e6d0b [0,1,0,0,0,0|3,0,0]=4 608 B11R1.17 CCOCc1ccncc1C c2e03a76229a18838878f9a03032e5ea [0,1,0,0,0,0|3,0,0]=4 609 B11R1.17 CCOCc1ccncc1Cl 1c546d21bdf269acd61e737db0aac5c9 [0,1,0,0,0,0|3,0,0]=4 610 B11R1.17 CCOCc1ccncc1F e413c9ff65fce8974f443c480b5d6247 [0,1,0,0,0,0|3,0,0]=4 611 B11R1.17 CCOCc1ccncc1I 8c85472884ce798142cf3dd5a07777d9 [0,1,0,0,0,0|3,0,0]=4 612 B11R1.17 CCOCc1cnccc1Br 750cda4e9bc34f5a91eb935189c60ab8 [0,1,0,0,0,0|3,0,0]=4 613 B11R1.17 CCOCc1cnccc1C c7331a6c4dde5c450ee6a5c1e8ddd68f [0,1,0,0,0,0|3,0,0]=4 614 B11R1.17 CCOCc1cnccc1Cl d0ea2c29bb03569328f3a86c14865fe2 [0,1,0,0,0,0|3,0,0]=4 615 B11R1.17 CCOCc1cnccc1F 35e2ec5af2d1d295476ee94596fb4fa5 [0,1,0,0,0,0|3,0,0]=4 616 B11R1.17 CCOCc1ncccc1Br a900f8070f81c4dcfb6829872fbeb70d [0,1,0,0,0,0|3,0,0]=4 617 B11R1.17 CCOCc1ncccc1C 22c6c25dddf153fd6e4a707af4b8068f [0,1,0,0,0,0|3,0,0]=4 618 B11R1.17 CCOCc1ncccc1Cl 3c0fdcad26845cb45b2978d3ea158930 [0,1,0,0,0,0|3,0,0]=4 619 B11R1.17 CCOCc1ncccc1F 27994f3f8111644da417064253c7144c [0,1,0,0,0,0|3,0,0]=4 620 B11R1.17 COCNc1c[nH]cnc1=O 047160357e905e87033b1ca084ea5a29 [0,1,0,0,0,0|3,0,0]=4 621 B11R1.17 COCNc1ccc[nH]c1=S 6cf1bcc8bb069e829dbd7b97bc04e8d6 [0,1,0,0,0,0|2,0,0]=3 622 B11R1.17 COCNc1cccc[n+]1[O-] 8a4b855df30f4b8bcd976578a1d35adf [0,1,0,0,0,0|2,0,0]=3 623 B11R1.17 COCNc1ccccc1C fb9a5d913c4919343dd03f9e91ff77a7 [0,1,0,0,0,0|1,0,0]=2 624 B11R1.17 COCNc1ccccc1Cl 37814819f7301c2697cb787bf3caaaf8 [0,1,0,0,0,0|1,0,0]=2 625 B11R1.17 COCNc1ccccc1F 012796c2f433b353de6e293cf868c18c [0,1,0,0,0,0|1,0,0]=2 626 B11R1.17 COCNc1ccccc1I 35361f687b9768a5f1a636654e8c5a8e [0,1,0,0,0,0|1,0,0]=2 627 B11R1.17 COCNc1cccnc1Br 78d85c21388c49f0ea0fb3b9f17d1da4 [0,1,0,0,0,0|2,0,0]=3 628 B11R1.17 COCNc1cccnc1C 6b682e80c911fe37c9c071bed81835e1 [0,1,0,0,0,0|2,0,0]=3 629 B11R1.17 COCNc1cccnc1Cl b48b69abfdc2724c4895476e89676b52 [0,1,0,0,0,0|2,0,0]=3 630 B11R1.17 COCNc1cccnc1F 0ee4d79eccc09360ae2aa9bf4ff820cf [0,1,0,0,0,0|2,0,0]=3 631 B11R1.17 COCNc1cccnc1I de8f832ec8f0dce2e4f2a1e70a8ea403 [0,1,0,0,0,0|2,0,0]=3 632 B11R1.17 COCNc1ccn[nH]c1=O bef90ea1833cb39f5bbc9618f30f6100 [0,1,0,0,0,0|3,0,0]=4 633 B11R1.17 COCNc1ccn[nH]c1=S 8672b4984c9921aab9851e162db1a867 [0,1,0,0,0,0|3,0,0]=4 634 B11R1.17 COCNc1ccncc1Br 4ff84260a90e05758a62ba2d2bb79601 [0,1,0,0,0,0|2,0,0]=3 635 B11R1.17 COCNc1ccncc1C 9c3be265a857f8bfbebb531da24465f9 [0,1,0,0,0,0|2,0,0]=3 636 B11R1.17 COCNc1ccncc1Cl 4474d32188ec02fa82aa971abe08a225 [0,1,0,0,0,0|2,0,0]=3 637 B11R1.17 COCNc1ccncc1F 15975d8d337252838ecde5b19c44c083 [0,1,0,0,0,0|2,0,0]=3 638 B11R1.17 COCNc1ccncc1I 3a7d389351bd6a87b78331f329a371fc [0,1,0,0,0,0|2,0,0]=3 639 B11R1.17 COCNc1ccnnc1Br 71eb1f00127189f6cdda319cb383ee0a [0,1,0,0,0,0|3,0,0]=4 640 B11R1.17 COCNc1ccnnc1C 17fe860fb7146413075fb32b8f4db92d [0,1,0,0,0,0|3,0,0]=4 641 B11R1.17 COCNc1ccnnc1Cl 539c944ad8e30d0fbe3477252c16dbb4 [0,1,0,0,0,0|3,0,0]=4 642 B11R1.17 COCNc1cnccc1Br 8ee31ac652b99df374ed258a651fafbf [0,1,0,0,0,0|2,0,0]=3 643 B11R1.17 COCNc1cnccc1C 1f5b2a457c3a6477f45dc6e87a8065d5 [0,1,0,0,0,0|2,0,0]=3 644 B11R1.17 COCNc1cnccc1Cl 0cc8c08952c3f2d82ecc462254152583 [0,1,0,0,0,0|2,0,0]=3 645 B11R1.17 COCNc1cnccc1F 115b693368b33bd5038e4f9f6648afa3 [0,1,0,0,0,0|2,0,0]=3 646 B11R1.17 COCNc1cnccc1I ad491681af6b5c023ee63b1547c77784 [0,1,0,0,0,0|2,0,0]=3 647 B11R1.17 COCNc1cnccc1S 36ed7432a7f77da74374b6b6c3171b0d [0,1,0,0,0,0|2,0,0]=3 648 B11R1.17 COCNc1cncnc1Br 6b50eb3cb4c1ea8069d575013caec1a6 [0,1,0,0,0,0|3,0,0]=4 649 B11R1.17 COCNc1cncnc1C 0ea008dacc6527ce762e34b08305052e [0,1,0,0,0,0|3,0,0]=4 650 B11R1.17 COCNc1cncnc1Cl d1c39263bc897385e7313efb64fc711c [0,1,0,0,0,0|3,0,0]=4 651 B11R1.17 COCNc1cncnc1I 5a34edd07c2499fd5f14687732e8cac6 [0,1,0,0,0,0|3,0,0]=4 652 B11R1.17 COCNc1cnncc1Br 9a1cd756bf6bb0aa43322e1f234d621f [0,1,0,0,0,0|3,0,0]=4 653 B11R1.17 COCNc1cnncc1Cl 2009e9e63c5e895dae650a74e3d0c0c2 [0,1,0,0,0,0|3,0,0]=4 654 B11R1.17 COCNc1ncccc1Br c77a620fbf2cdac3f0f62475c9ecc7a2 [0,1,0,0,0,0|2,0,0]=3 655 B11R1.17 COCNc1ncccc1C 1b0f64ed15da388d9aa93d7b67326b3e [0,1,0,0,0,0|2,0,0]=3 656 B11R1.17 COCNc1ncccc1Cl ca63b8cc36b4035832431c47e5163efd [0,1,0,0,0,0|2,0,0]=3 657 B11R1.17 COCNc1ncccc1F 915a644ab62f3ba464f87c0a95220680 [0,1,0,0,0,0|2,0,0]=3 658 B11R1.17 COCNc1ncccc1I b4a9dc07751ead9c70b17558e3b66036 [0,1,0,0,0,0|2,0,0]=3 659 B11R1.17 COCNc1nccnc1Br 75a6f1b7e6cc056d4a11f892271a51ee [0,1,0,0,0,0|3,0,0]=4 660 B11R1.17 COCNc1nccnc1C f7a21258816bfef448bfb97023f7df6f [0,1,0,0,0,0|3,0,0]=4 661 B11R1.17 COCNc1nccnc1Cl 64c9a33aef6402682d1d9961e677f93d [0,1,0,0,0,0|3,0,0]=4 662 B11R1.17 COCNc1nccnc1I fc5a7e1bf7a79d84f869a225d696a50b [0,1,0,0,0,0|3,0,0]=4 663 B11R1.17 COCNc1ncncc1Br 34979f49c37088e81cfc6979610f7dc2 [0,1,0,0,0,0|3,0,0]=4 664 B11R1.17 COCNc1ncncc1C 38ee36d2ac94543403fda0d164b95f21 [0,1,0,0,0,0|3,0,0]=4 665 B11R1.17 COCNc1ncncc1Cl 5c0e9c3903dd2804e4f86db0e94e461d [0,1,0,0,0,0|3,0,0]=4 666 B11R1.17 COCNc1ncncc1F c5b68638cf7a9bcb3915f32f84542dfe [0,1,0,0,0,0|3,0,0]=4 667 B11R1.17 COCNc1ncncc1I 7929b9e3fdaf8d78171dcd68c92a9678 [0,1,0,0,0,0|3,0,0]=4 668 B11R1.17 COCNc1nnccc1C ff6e17ebd2ee539f7454b459b374e805 [0,1,0,0,0,0|3,0,0]=4 669 B11R1.17 COCOc1c[nH]cnc1=O 61cfdd8af5b6708b4e41833ed23b20a6 [0,1,0,0,0,0|3,0,0]=4 670 B11R1.17 COCOc1ccc[nH]c1=S db68e170bb0aad5dd949f1d694c9f9dd [0,1,0,0,0,0|2,0,0]=3 671 B11R1.17 COCOc1cccc[n+]1[O-] f278db29591ddfe1997376c81cbea609 [0,1,0,0,0,0|2,0,0]=3 672 B11R1.17 COCOc1ccccc1C 716fa0606a50157c01134bcaabfa95bd [0,1,0,0,0,0|1,0,0]=2 673 B11R1.17 COCOc1ccccc1Cl 63c703b93e4b02a8003a5132c238f561 [0,1,0,0,0,0|1,0,0]=2 674 B11R1.17 COCOc1ccccc1F e22b80c6c7e596d1bc182ef8d0d8cb18 [0,1,0,0,0,0|1,0,0]=2 675 B11R1.17 COCOc1cccnc1Br d8c81b7500bc6be8e651ef16c0723bb9 [0,1,0,0,0,0|2,0,0]=3 676 B11R1.17 COCOc1cccnc1C ec22ad41ed163d24a1597dbeb8a4a6ff [0,1,0,0,0,0|2,0,0]=3 677 B11R1.17 COCOc1cccnc1Cl b869a5928f6200fc7e1266fc7fb8bf86 [0,1,0,0,0,0|2,0,0]=3 678 B11R1.17 COCOc1cccnc1F 0bb3ad5019105e7819238e85381bc22f [0,1,0,0,0,0|2,0,0]=3 679 B11R1.17 COCOc1cccnc1I 3984c6855c886cc046744c0418f452b3 [0,1,0,0,0,0|2,0,0]=3 680 B11R1.17 COCOc1cccoc1=O 1079ae5c00fed507763972415feaa54b [0,1,0,0,0,0|2,0,0]=3 681 B11R1.17 COCOc1ccncc1Br b3ac01b49214ffe1164758feb642d521 [0,1,0,0,0,0|2,0,0]=3 682 B11R1.17 COCOc1ccncc1C edee7c0be535f1c77b9bbbf7fe881c62 [0,1,0,0,0,0|2,0,0]=3 683 B11R1.17 COCOc1ccncc1Cl 10d7e19bc091065b7c393a4387a31d6e [0,1,0,0,0,0|2,0,0]=3 684 B11R1.17 COCOc1ccncc1F 80e72a6cabcff76831073dd33726381a [0,1,0,0,0,0|2,0,0]=3 685 B11R1.17 COCOc1ccnnc1Cl 8b3c77ed9ac030e1e223218956258e35 [0,1,0,0,0,0|3,0,0]=4 686 B11R1.17 COCOc1cnccc1Br e4c61dde613818dcfb838c07e559b327 [0,1,0,0,0,0|2,0,0]=3 687 B11R1.17 COCOc1cnccc1C 9d0f1d451a2e173093effe8eb8da3d4c [0,1,0,0,0,0|2,0,0]=3 688 B11R1.17 COCOc1cnccc1Cl b7806976af3a37121965581644e5380b [0,1,0,0,0,0|2,0,0]=3 689 B11R1.17 COCOc1cnccc1F 1633d33c0370b0c7cede611e8a8372a8 [0,1,0,0,0,0|2,0,0]=3 690 B11R1.17 COCOc1cnccc1I 5a6305b3e19c5669441635bccfcbeaec [0,1,0,0,0,0|2,0,0]=3 691 B11R1.17 COCOc1cncnc1C 7e1251670ec58b5ea55039014ad37716 [0,1,0,0,0,0|3,0,0]=4 692 B11R1.17 COCOc1cncnc1I 06da203523164224821c90e282f44d5b [0,1,0,0,0,0|3,0,0]=4 693 B11R1.17 COCOc1cnncc1Br fd4547776c5783a4cf046a22b4cfe73a [0,1,0,0,0,0|3,0,0]=4 694 B11R1.17 COCOc1cnncc1Cl 26ba0d45978bcc74e2a39b66ee3b9986 [0,1,0,0,0,0|3,0,0]=4 695 B11R1.17 COCOc1coccc1=O 336139711ce8b530dfd4325f5e4809de [0,1,0,0,0,0|2,0,0]=3 696 B11R1.17 COCOc1ncccc1Br cb0e062478894323a2bf72bd99943205 [0,1,0,0,0,0|2,0,0]=3 697 B11R1.17 COCOc1ncccc1C 8adf3b28b23a153b7bc424eae3dd8908 [0,1,0,0,0,0|2,0,0]=3 698 B11R1.17 COCOc1ncccc1Cl d19708d7cfcc2a228078cd9342fea1f5 [0,1,0,0,0,0|2,0,0]=3 699 B11R1.17 COCOc1ncccc1F cae1fa733309d8632bcbd4de00bcaf3d [0,1,0,0,0,0|2,0,0]=3 700 B11R1.17 COCOc1nccnc1Br 308b86e7ca77ced8119559161c762dba [0,1,0,0,0,0|3,0,0]=4 701 B11R1.17 COCOc1nccnc1C 36aac378352b0c12566f983bf9b4e4ce [0,1,0,0,0,0|3,0,0]=4 702 B11R1.17 COCOc1ncncc1C d2ebe371d23f1c6249db69ef7122c33a [0,1,0,0,0,0|3,0,0]=4 703 B11R1.17 COCOc1ncncc1Cl deab7447724a4e990f22c7b2cea7ed2a [0,1,0,0,0,0|3,0,0]=4 704 B11R1.17 COCOc1ncncc1F 9544f045558a52b51e2c840cd8370eab [0,1,0,0,0,0|3,0,0]=4 705 B11R1.17 COCOc1ncncc1I 46fb864caa10c9733f4aaee2c9ae571a [0,1,0,0,0,0|3,0,0]=4 706 B11R1.17 COCOc1nnccc1C dd10216e2729c72d360511be2b4167c2 [0,1,0,0,0,0|3,0,0]=4 707 B11R1.17 COCOc1nnccc1Cl 56bb806005f8bbdff49c956d472b6880 [0,1,0,0,0,0|3,0,0]=4 708 B11R1.17 COCOc1nnccc1I e10e7f6d8c7817166f27d57e6bf02f56 [0,1,0,0,0,0|3,0,0]=4 709 B11R1.17 COCOn1ccccc1=N 925208b5db2ca1037c2209e7b86fad47 [0,1,0,0,0,0|2,0,0]=3 710 B11R1.17 COCOn1ccccc1=O 9d0c228f5063f5a88fca6cf7f41a8bd8 [0,1,0,0,0,0|2,0,0]=3 711 B11R1.17 COCOn1ccccc1=S 04e9edb8888ba4f0e6d8582459879b77 [0,1,0,0,0,0|2,0,0]=3 712 B11R1.17 CSCNc1ccc[nH]c1=S 4e22298202bc95a3092bdbc4366e9622 [0,1,0,0,0,0|2,1,0]=4 713 B11R1.17 CSCNc1cccc[n+]1[O-] e5784cfcbd0392348961eb1eafcaa701 [0,1,0,0,0,0|2,1,0]=4 714 B11R1.17 CSCNc1ccccc1F 9b4d3e42ede948c3ffb1bbc9d3fe8d03 [0,1,0,0,0,0|1,1,0]=3 715 B11R1.17 CSCNc1ccccc1I a0076d1329bc09c3003b2ceb79d20cbe [0,1,0,0,0,0|1,1,0]=3 716 B11R1.17 CSCNc1cccnc1Br fbd594185fa8e21032a6a5241aa3bc44 [0,1,0,0,0,0|2,1,0]=4 717 B11R1.17 CSCNc1cccnc1C 9e8a5e2ee57bca09063c67ddfe596b11 [0,1,0,0,0,0|2,1,0]=4 718 B11R1.17 CSCNc1cccnc1Cl 864488e46fef6b0eb7a83890c887e0e2 [0,1,0,0,0,0|2,1,0]=4 719 B11R1.17 CSCNc1cccnc1F 9d594848a9dcbe64681eed4214547349 [0,1,0,0,0,0|2,1,0]=4 720 B11R1.17 CSCNc1cccnc1I d4c81ffe367679279247c278114dbef8 [0,1,0,0,0,0|2,1,0]=4 721 B11R1.17 CSCNc1ccncc1Br 79161de72bb00739fe931d71481023fd [0,1,0,0,0,0|2,1,0]=4 722 B11R1.17 CSCNc1ccncc1C 440bfa8968a49af2b0ad341926c8fb6e [0,1,0,0,0,0|2,1,0]=4 723 B11R1.17 CSCNc1ccncc1Cl b38aa3beee7ffab4f299cd371a544a0d [0,1,0,0,0,0|2,1,0]=4 724 B11R1.17 CSCNc1ccncc1F 76d9788c983058102ae408d13c437b34 [0,1,0,0,0,0|2,1,0]=4 725 B11R1.17 CSCNc1ccncc1I e8a0e04adb7c4a51882649c2adefa394 [0,1,0,0,0,0|2,1,0]=4 726 B11R1.17 CSCNc1cnccc1Br 168533da31e3dc69540995fe490debc8 [0,1,0,0,0,0|2,1,0]=4 727 B11R1.17 CSCNc1cnccc1C 29a64dcbd4861b123e6df60f2f559c3c [0,1,0,0,0,0|2,1,0]=4 728 B11R1.17 CSCNc1cnccc1Cl 9669c5b8d121c941ef1303ebe93e9bae [0,1,0,0,0,0|2,1,0]=4 729 B11R1.17 CSCNc1cnccc1F b3a596e5344a321bb756ff811074c99d [0,1,0,0,0,0|2,1,0]=4 730 B11R1.17 CSCNc1cnccc1I d07c0bee5ff1798b550dfed4677b088f [0,1,0,0,0,0|2,1,0]=4 731 B11R1.17 CSCNc1ncccc1Br 1862e461f2f1c7f043d226598ff4d3c8 [0,1,0,0,0,0|2,1,0]=4 732 B11R1.17 CSCNc1ncccc1C b72b60896e65164c61988cde1d337896 [0,1,0,0,0,0|2,1,0]=4 733 B11R1.17 CSCNc1ncccc1Cl 57e6a7edcf17c53b44383748f9a30c34 [0,1,0,0,0,0|2,1,0]=4 734 B11R1.17 CSCNc1ncccc1F 86e934783769b9abb439eea8f6534bf7 [0,1,0,0,0,0|2,1,0]=4 735 B11R1.17 CSCNc1ncccc1I d97b70a581f4cd1b22aaca5147670749 [0,1,0,0,0,0|2,1,0]=4 736 B11R1.17 CSCOc1ccc[nH]c1=S 03eea15c762eddfec4bf8f5fc460f210 [0,1,0,0,0,0|2,1,0]=4 737 B11R1.17 CSCOc1cccc[n+]1[O-] 74c3b03ad4c1680c25339ca03cd1ca58 [0,1,0,0,0,0|2,1,0]=4 738 B11R1.17 CSCOc1ccccc1C bbddea75066310ddae50c52e1fce5d3e [0,1,0,0,0,0|1,1,0]=3 739 B11R1.17 CSCOc1ccccc1Cl 5d51d1316509893e2db24974b33cf402 [0,1,0,0,0,0|1,1,0]=3 740 B11R1.17 CSCOc1ccccc1F 14f1053691f335280e6f60bd9f75106c [0,1,0,0,0,0|1,1,0]=3 741 B11R1.17 CSCOc1ccccc1I 4e0705c8c2f09f68040c0c612c698d64 [0,1,0,0,0,0|1,1,0]=3 742 B11R1.17 CSCOc1cccnc1Br cb1bf924479b3919b72804f3842ecf27 [0,1,0,0,0,0|2,1,0]=4 743 B11R1.17 CSCOc1cccnc1C 9b870116fa6fbc948ed7ded045701563 [0,1,0,0,0,0|2,1,0]=4 744 B11R1.17 CSCOc1cccnc1Cl becca651734dad829746232c2d449a19 [0,1,0,0,0,0|2,1,0]=4 745 B11R1.17 CSCOc1cccnc1F 68aee1b4c0a5fecf7c615d6c14aa5bf3 [0,1,0,0,0,0|2,1,0]=4 746 B11R1.17 CSCOc1cccnc1I db67a4941b56481c5a1c3a6de0229232 [0,1,0,0,0,0|2,1,0]=4 747 B11R1.17 CSCOc1cccoc1=O 47b5ec0f63347f2e1a22f7118c7695a2 [0,1,0,0,0,0|2,1,0]=4 748 B11R1.17 CSCOc1ccncc1Br c56fd4f99bb97a6d86b59cb9d7c6f200 [0,1,0,0,0,0|2,1,0]=4 749 B11R1.17 CSCOc1ccncc1C 6afb070825d2887239ed470e1079d59f [0,1,0,0,0,0|2,1,0]=4 750 B11R1.17 CSCOc1ccncc1Cl b07edfbbb04fea8ec54dffea90cb8235 [0,1,0,0,0,0|2,1,0]=4 751 B11R1.17 CSCOc1ccncc1F dd2e2578cb7cdb7bd47124b62b945538 [0,1,0,0,0,0|2,1,0]=4 752 B11R1.17 CSCOc1cnccc1Br ecee4618e3c907bbad667b19dc0969db [0,1,0,0,0,0|2,1,0]=4 753 B11R1.17 CSCOc1cnccc1C b03c85770ce443035fd8b74e9f6c26e0 [0,1,0,0,0,0|2,1,0]=4 754 B11R1.17 CSCOc1cnccc1Cl 821534b1462c046d352d814cd1ea7917 [0,1,0,0,0,0|2,1,0]=4 755 B11R1.17 CSCOc1cnccc1F 157afe10b55f7053b5a59a04688244c0 [0,1,0,0,0,0|2,1,0]=4 756 B11R1.17 CSCOc1cnccc1I a6d1229459ae33fda8c0c32ca5a21097 [0,1,0,0,0,0|2,1,0]=4 757 B11R1.17 CSCOc1coccc1=O d63a7d3dafbef49b30edae6ece9b5474 [0,1,0,0,0,0|2,1,0]=4 758 B11R1.17 CSCOc1ncccc1Br 6e080946e25fd51558294e406949104d [0,1,0,0,0,0|2,1,0]=4 759 B11R1.17 CSCOc1ncccc1C 865f2360dda339fdcf06b9b04930b805 [0,1,0,0,0,0|2,1,0]=4 760 B11R1.17 CSCOc1ncccc1Cl 2ea519f27eb8d8468c81a1b05ef6f35a [0,1,0,0,0,0|2,1,0]=4 761 B11R1.17 CSCOc1ncccc1F 40793fdcf7e70c51c7dd0f6c028803ea [0,1,0,0,0,0|2,1,0]=4 762 B11R1.17 CSCOn1ccccc1=N aadc3b1646c124ec13d13438a4397a1b [0,1,0,0,0,0|2,1,0]=4 763 B11R1.17 CSCOn1ccccc1=O efe06aae01107ed5716eee5a98ac2ebd [0,1,0,0,0,0|2,1,0]=4 764 B11R1.17 CSCOn1ccccc1=S e2b211586b4fe1a1e8ac8321362c26c7 [0,1,0,0,0,0|2,1,0]=4 765 B11R1.17 Cc1ccccc1CNC#N 7d6a9c5d41e74b80e4ae41ce8842d9ae [0,1,0,0,0,0|3,0,0]=4 766 B11R1.17 Cc1ccccc1CNC=O a0b11915ba3bdfe6d1bbea580cf346f5 [0,1,0,0,0,0|3,0,0]=4 767 B11R1.17 Cc1ccccc1CNCF 15e4bda543c50e3e0f080863eb75d61e [0,1,0,0,0,0|3,0,0]=4 768 B11R1.17 Cc1ccccc1CNCO f33352c0e02ea4b4ea9a0720598f200e [0,1,0,0,0,0|3,0,0]=4 769 B11R1.17 Cc1ccccc1COCF 26a9ff4e1acee4455bed5578adee3d1b [0,1,0,0,0,0|3,0,0]=4 770 B11R1.17 Cc1ccccc1NCC=O 3978b3e144b493b059eb1f48959067dc [0,1,0,0,0,0|3,0,0]=4 771 B11R1.17 Cc1ccccc1NCCBr 1a7be6e12078aed98559b61c844bde43 [0,1,0,0,0,0|3,0,0]=4 772 B11R1.17 Cc1ccccc1NCCF 0e5d4c97f9157c508297bd93ae8f5371 [0,1,0,0,0,0|3,0,0]=4 773 B11R1.17 Cc1ccccc1NCCO 5035e646db6f3a444835335ac8083c14 [0,1,0,0,0,0|3,0,0]=4 774 B11R1.17 Cc1ccccc1NCCS 2a25a74370bfe5d7316ba8388c7b4945 [0,1,0,0,0,0|3,0,0]=4 775 B11R1.17 Cc1ccccc1OCC#N e555abb312817205bf95bee8927212e8 [0,1,0,0,0,0|3,0,0]=4 776 B11R1.17 Cc1ccccc1OCC=O e0558a57ba2ba7c3e857a3e3bd611b2b [0,1,0,0,0,0|3,0,0]=4 777 B11R1.17 Cc1ccccc1OCCF f6d7b302f46f820a9e73f4fb8f637bde [0,1,0,0,0,0|3,0,0]=4 778 B11R1.17 Cc1ccccc1OCCS b005873ca988c2b5b3e2488fe6505c14 [0,1,0,0,0,0|3,0,0]=4 779 B11R1.17 FCCNc1ccccc1Cl f556874146c6a72f9a84f0bd26070247 [0,1,0,0,0,0|3,0,0]=4 780 B11R1.17 FCCNc1ccccc1F e2cbe2a439b6bba8166d18f4a8de4742 [0,1,0,0,0,0|3,0,0]=4 781 B11R1.17 FCCNc1ccccc1I 3c8616ee89755bf6f05caef3c69371bd [0,1,0,0,0,0|3,0,0]=4 782 B11R1.17 FCCOc1ccccc1Cl 01c3ab339b3cc97f239d998f0df99ac6 [0,1,0,0,0,0|3,0,0]=4 783 B11R1.17 FCCOc1ccccc1F 89d9f7646bebd63d142c637ad96d7af6 [0,1,0,0,0,0|3,0,0]=4 784 B11R1.17 FCCOc1ccccc1I e68149bbe7bd740697745ed331d108ad [0,1,0,0,0,0|3,0,0]=4 785 B11R1.17 FCNCc1ccccc1Br dc60c3e5196679a6ad7a9fd07289336a [0,1,0,0,0,0|3,0,0]=4 786 B11R1.17 FCNCc1ccccc1Cl b2a7e5b738ab7ee1b7f97a02c137519e [0,1,0,0,0,0|3,0,0]=4 787 B11R1.17 FCNCc1ccccc1F c6a27c7f8e1ab840ee4f8b21e6ebec91 [0,1,0,0,0,0|3,0,0]=4 788 B11R1.17 FCNCc1ccccc1I 072ca4290b9a717a2a3ef28ccf6dc79f [0,1,0,0,0,0|3,0,0]=4 789 B11R1.17 FCOCc1ccccc1Br 1e405168174e3e5a39762fd8efcb0e02 [0,1,0,0,0,0|3,0,0]=4 790 B11R1.17 FCOCc1ccccc1Cl 1bf9ea1561018dfe59c2c98ef1a6a3e2 [0,1,0,0,0,0|3,0,0]=4 791 B11R1.17 FCOCc1ccccc1F 3daad749644938528762801a7655c80c [0,1,0,0,0,0|3,0,0]=4 792 B11R1.17 FCOCc1ccccc1I 31f2d72b4794f19953f85fef60c6eb00 [0,1,0,0,0,0|3,0,0]=4 793 B11R1.17 FCOCc1ccccc1S ccd959bb9897533e9284e6c6e657b910 [0,1,0,0,0,0|3,0,0]=4 794 B11R1.17 Fc1ccccc1NCCS 4e9be5faedc4f5d0920a07998748916a [0,1,0,0,0,0|3,0,0]=4 795 B11R1.17 Fc1ccccc1OCCS b5b3c652dc21fd01fc4857235680bf44 [0,1,0,0,0,0|3,0,0]=4 796 B11R1.17 N#CCNc1ccccc1Cl 8c58ef70191a09e0beed9f9bd5ba896c [0,1,0,0,0,0|3,0,0]=4 797 B11R1.17 N#CCNc1ccccc1F 55ba964e12978ad67307cb0b9173fffb [0,1,0,0,0,0|3,0,0]=4 798 B11R1.17 N#CCNc1ccccc1I 3c5ff16a685c43bcbff5d2d70928c791 [0,1,0,0,0,0|3,0,0]=4 799 B11R1.17 N#CCOc1ccccc1Cl 0a4ecd7776fbba0e5aee068fa9c20c9c [0,1,0,0,0,0|3,0,0]=4 800 B11R1.17 N#CCOc1ccccc1F cf61a539ee74b00733e6f53d332a24df [0,1,0,0,0,0|3,0,0]=4 801 B11R1.17 N#CCOc1ccccc1I 11356de832a6f92ab08c97d231648943 [0,1,0,0,0,0|3,0,0]=4 802 B11R1.17 N#CCOc1ccccc1S bc1ef25b77081ed3161febf8e3d481f8 [0,1,0,0,0,0|3,0,0]=4 803 B11R1.17 N#CNCc1ccccc1Br 9586b8358695530ab1a8b16bca763c94 [0,1,0,0,0,0|3,0,0]=4 804 B11R1.17 N#CNCc1ccccc1Cl ca6a7d4fb906418e57086ce29c3af989 [0,1,0,0,0,0|3,0,0]=4 805 B11R1.17 N#CNCc1ccccc1F 3ab5c1d3e43aa31ffa497e310ad8d782 [0,1,0,0,0,0|3,0,0]=4 806 B11R1.17 N#CNCc1ccccc1I bc9e2b7a404940936a1217ee9648d628 [0,1,0,0,0,0|3,0,0]=4 807 B11R1.17 O=CCNc1ccccc1Br 17c102ad471262e91e3d5140073e2cb8 [0,1,0,0,0,0|3,0,0]=4 808 B11R1.17 O=CCNc1ccccc1Cl ad4fbdb5bba0bd8df193da9558b34740 [0,1,0,0,0,0|3,0,0]=4 809 B11R1.17 O=CCNc1ccccc1F 0d8cd3634a56254e10b990d3291e4c30 [0,1,0,0,0,0|3,0,0]=4 810 B11R1.17 O=CCNc1ccccc1I 19ad5d15abec758c4689b61ba4062aef [0,1,0,0,0,0|3,0,0]=4 811 B11R1.17 O=CCNc1ccccc1S df1bb6fdb2c19d05ddd1b9eec1a99a33 [0,1,0,0,0,0|3,0,0]=4 812 B11R1.17 O=CCOc1ccccc1Br c271982bb471c946ef6060f466a03ff3 [0,1,0,0,0,0|3,0,0]=4 813 B11R1.17 O=CCOc1ccccc1Cl 0a4ca1abc1ce1098826b11dc047b94a7 [0,1,0,0,0,0|3,0,0]=4 814 B11R1.17 O=CCOc1ccccc1F 81d5ad2b00433ccb21bf81200d488a9c [0,1,0,0,0,0|3,0,0]=4 815 B11R1.17 O=CCOc1ccccc1I 078d6b8dfcc021466792e4a1e44e77ac [0,1,0,0,0,0|3,0,0]=4 816 B11R1.17 O=CCOc1ccccc1S 31acf3e44e89170f855a1763ebbc6cea [0,1,0,0,0,0|3,0,0]=4 817 B11R1.17 O=CNCc1ccccc1Br 58e03ef5e72544e0b081657f9f5b4838 [0,1,0,0,0,0|3,0,0]=4 818 B11R1.17 O=CNCc1ccccc1Cl b418b86897393ad70bf26f88a77ebf6f [0,1,0,0,0,0|3,0,0]=4 819 B11R1.17 O=CNCc1ccccc1F 6cd79aefd318241a028748c181ad0758 [0,1,0,0,0,0|3,0,0]=4 820 B11R1.17 O=CNCc1ccccc1I 893983c2cac8ee59f1addbe45883c265 [0,1,0,0,0,0|3,0,0]=4 821 B11R1.17 O=CNCc1ccccc1O df0afa8c91afdac1d44912107063bd10 [0,1,0,0,0,0|3,0,0]=4 822 B11R1.17 OCCNc1ccccc1Cl 7e00c321a95d99f226af9355a5b8fd97 [0,1,0,0,0,0|3,0,0]=4 823 B11R1.17 OCCNc1ccccc1F 4c6208b79575fb1b4efb9bc595ec7419 [0,1,0,0,0,0|3,0,0]=4 824 B11R1.17 OCCNc1ccccc1I 7422a69e1fe9722f423454637884bff2 [0,1,0,0,0,0|3,0,0]=4 825 B11R1.17 OCCNc1ccccc1S 987e6c2de89f4ccfc6bc2df488fb2f56 [0,1,0,0,0,0|3,0,0]=4 826 B11R1.17 OCNCc1ccccc1Br 0209dca586483b54ccb56f7ccd9012ce [0,1,0,0,0,0|3,0,0]=4 827 B11R1.17 OCNCc1ccccc1Cl 5475d2d62064a77dd3e8f040ca795a73 [0,1,0,0,0,0|3,0,0]=4 828 B11R1.17 OCNCc1ccccc1F a78f02dd794e5b9637da439e4010cc0a [0,1,0,0,0,0|3,0,0]=4 829 B11R1.17 OCNCc1ccccc1I 6ad26aea5b9fc20136e87fd70971bc76 [0,1,0,0,0,0|3,0,0]=4 830 B11R1.17 SCCNc1ccccc1Cl 8eb275d5fd7aa75f04843d2c9b15e888 [0,1,0,0,0,0|3,0,0]=4 831 B11R1.17 SCCNc1ccccc1I 7aa64189a44cf315624ec283017501ec [0,1,0,0,0,0|3,0,0]=4 832 B11R1.17 SCCNc1ccccc1S 7f3f9d44512381b1f5e117db6c186831 [0,1,0,0,0,0|3,0,0]=4 833 B11R1.17 SCCOc1ccccc1Br 2c9be4111e88e1cef97e0afbaa43f88c [0,1,0,0,0,0|3,0,0]=4 834 B11R1.17 SCCOc1ccccc1Cl 3c48aa6ff52eb58ee2e3c87740c748bd [0,1,0,0,0,0|3,0,0]=4 835 B11R1.17 SCCOc1ccccc1I 5f761222ba044a2385a944adcc40619f [0,1,0,0,0,0|3,0,0]=4 836 B11R1.17 SCCOc1ccccc1S 761c20209c9eb8a0b566991b5c1ab081 [0,1,0,0,0,0|3,0,0]=4 837 B11R1.24 C#CCNc1cccc(c1)Br d2a4670ce250ffbfd688bbc982a880ef [0,1,0,0,0,0|2,0,1]=4 838 B11R1.24 C#CCNc1cccc(c1)C e7027c400981d7bbfab2d045fc37e9b5 [0,1,0,0,0,0|2,0,1]=4 839 B11R1.24 C#CCNc1cccc(c1)Cl e7263d15270025454d133c91c3cd5f0f [0,1,0,0,0,0|2,0,1]=4 840 B11R1.24 C#CCNc1cccc(c1)F 2742d7fbd0835bf46ab9f4069963f89e [0,1,0,0,0,0|2,0,1]=4 841 B11R1.24 C#CCNc1cccc(c1)I 920d0df8863c0fa3244e218a75d260d1 [0,1,0,0,0,0|2,0,1]=4 842 B11R1.24 C#CCNc1cccc(c1)S c764683455bc65c5163ff65df5cc1fd7 [0,1,0,0,0,0|2,0,1]=4 843 B11R1.24 C#CCOc1cccc(c1)Br ca9b009a729c2d0dd0c971888cf53a1b [0,1,0,0,0,0|2,0,1]=4 844 B11R1.24 C#CCOc1cccc(c1)C cfe81545eea8bc92d2ee3eba48341718 [0,1,0,0,0,0|2,0,1]=4 845 B11R1.24 C#CCOc1cccc(c1)Cl f73027e9f1c367cb0115375202f8314f [0,1,0,0,0,0|2,0,1]=4 846 B11R1.24 C#CCOc1cccc(c1)F 959a46f7a97b7964e19e67a487891766 [0,1,0,0,0,0|2,0,1]=4 847 B11R1.24 C#CCOc1cccc(c1)I 96b8d71693eaf0d1470ed291cc67d6a3 [0,1,0,0,0,0|2,0,1]=4 848 B11R1.24 C#CCOc1cccc(c1)S 65e8fcaa6d65048376ab1a333e595d4c [0,1,0,0,0,0|2,0,1]=4 849 B11R1.24 C=CCNc1cccc(c1)Br e88457b009a20ef59a7a587614381b8a [0,1,0,0,0,0|2,0,1]=4 850 B11R1.24 C=CCNc1cccc(c1)C 173e403cf0963a6de904610bdd677509 [0,1,0,0,0,0|2,0,1]=4 851 B11R1.24 C=CCNc1cccc(c1)Cl 478faf611e1d401d4739789e412edbef [0,1,0,0,0,0|2,0,1]=4 852 B11R1.24 C=CCNc1cccc(c1)F 09b1dd8b29d882dc694ee0480dbe08d4 [0,1,0,0,0,0|2,0,1]=4 853 B11R1.24 C=CCNc1cccc(c1)I f9c2d517897ff770f0829daa3bac406b [0,1,0,0,0,0|2,0,1]=4 854 B11R1.24 C=CCNc1cccc(c1)S 0c5293e57a4ff3f1cf6663eb1f579c54 [0,1,0,0,0,0|2,0,1]=4 855 B11R1.24 C=CCOc1cccc(c1)Br 61bb7467f5678fb4d22531fde2b7bac2 [0,1,0,0,0,0|2,0,1]=4 856 B11R1.24 C=CCOc1cccc(c1)C e1142b28e80a4fc87fd34559eb6a5af1 [0,1,0,0,0,0|2,0,1]=4 857 B11R1.24 C=CCOc1cccc(c1)Cl 20a8ac3721d688aec32b1c0cd20791a2 [0,1,0,0,0,0|2,0,1]=4 858 B11R1.24 C=CCOc1cccc(c1)F feac3cecfe64810be06d5c97110e678e [0,1,0,0,0,0|2,0,1]=4 859 B11R1.24 C=CCOc1cccc(c1)I 1fa859eee5f94d20126ffa324117096f [0,1,0,0,0,0|2,0,1]=4 860 B11R1.24 C=CCOc1cccc(c1)S 223b3d93daa0fc6e2932a71f68fac7ff [0,1,0,0,0,0|2,0,1]=4 861 B11R1.24 CCCNc1cc(ccn1)Br f1c13a780ea072a97f4918a3ae5fe793 [0,1,0,0,0,0|3,0,0]=4 862 B11R1.24 CCCNc1cc(ccn1)C 9dd4b3ccbbc29296234e9ff62794f94d [0,1,0,0,0,0|3,0,0]=4 863 B11R1.24 CCCNc1cc(ccn1)Cl e2748ea47500b5c43ad80436ec365351 [0,1,0,0,0,0|3,0,0]=4 864 B11R1.24 CCCNc1cc(ccn1)F 19627d65edc699fb72ffad9630193c09 [0,1,0,0,0,0|3,0,0]=4 865 B11R1.24 CCCNc1cc(ccn1)I 84f5d93869eede5ea29829b3c07bd844 [0,1,0,0,0,0|3,0,0]=4 866 B11R1.24 CCCNc1cc[nH]c(=S)c1 360300b5400595cc8e7a69cc96fcab9d [0,1,0,0,0,0|3,0,0]=4 867 B11R1.24 CCCNc1cccc(c1)Br acb1f2bb5e7b1b5520f3f6cb5aa22aaf [0,1,0,0,0,0|2,0,0]=3 868 B11R1.24 CCCNc1cccc(c1)C e421761759f1c746a8f404b8a3a2f9e1 [0,1,0,0,0,0|2,0,0]=3 869 B11R1.24 CCCNc1cccc(c1)Cl 5f3ddf9c366c2329c81257ae31beedbd [0,1,0,0,0,0|2,0,0]=3 870 B11R1.24 CCCNc1cccc(c1)F ea1b244e71e5a96c27eaf1a47c4045c2 [0,1,0,0,0,0|2,0,0]=3 871 B11R1.24 CCCNc1cccc(c1)I 25b73dbb892b7f389897d5a43a220453 [0,1,0,0,0,0|2,0,0]=3 872 B11R1.24 CCCNc1cccc(c1)S 225c14a2af7bde79a1ce2cf37e4d273b [0,1,0,0,0,0|2,0,0]=3 873 B11R1.24 CCCNc1cccc(n1)Br 922806381eb036239ce652ef71179a3c [0,1,0,0,0,0|3,0,0]=4 874 B11R1.24 CCCNc1cccc(n1)C ac360e9e258569f548399e28fa3180d8 [0,1,0,0,0,0|3,0,0]=4 875 B11R1.24 CCCNc1cccc(n1)Cl dce45d6f17ac605453290d833800c971 [0,1,0,0,0,0|3,0,0]=4 876 B11R1.24 CCCNc1cccc(n1)F 6c39e109efcbcaf4d3a5d07f4418f5de [0,1,0,0,0,0|3,0,0]=4 877 B11R1.24 CCCNc1cccc(n1)I 257cf609e45e5409e5f7885d77dcd130 [0,1,0,0,0,0|3,0,0]=4 878 B11R1.24 CCCNc1ccnc(c1)Br b90db3b5c651f3912bd587d5844c555e [0,1,0,0,0,0|3,0,0]=4 879 B11R1.24 CCCNc1ccnc(c1)C b66f498b52f5cbd7e72f509e0a6f41be [0,1,0,0,0,0|3,0,0]=4 880 B11R1.24 CCCNc1ccnc(c1)Cl 72efba47fe28dc78535cf0d2b78b85d7 [0,1,0,0,0,0|3,0,0]=4 881 B11R1.24 CCCNc1ccnc(c1)F e126bb77c767f16e4a7cb3dc41a6ccca [0,1,0,0,0,0|3,0,0]=4 882 B11R1.24 CCCNc1ccnc(c1)I 9604ffc88e9cb615da6af887aba38dd5 [0,1,0,0,0,0|3,0,0]=4 883 B11R1.24 CCCNc1cncc(c1)Br df91207309bb098127db46b0c6c28373 [0,1,0,0,0,0|3,0,0]=4 884 B11R1.24 CCCNc1cncc(c1)C 17cc7df963debf4f8ee3c67f6dbccd63 [0,1,0,0,0,0|3,0,0]=4 885 B11R1.24 CCCNc1cncc(c1)Cl 0c2e6062e8edca14a7c30617675a1f46 [0,1,0,0,0,0|3,0,0]=4 886 B11R1.24 CCCNc1cncc(c1)F ee0c8e82c86888a5308b2d5ae8e4dc3e [0,1,0,0,0,0|3,0,0]=4 887 B11R1.24 CCCNc1cncc(c1)I 6d9481f5c9f1d1a015a6a7e6ac1b7f83 [0,1,0,0,0,0|3,0,0]=4 888 B11R1.24 CCCOc1cc(ccn1)Br 733fbc0062452a6d408b5de5a71ee204 [0,1,0,0,0,0|3,0,0]=4 889 B11R1.24 CCCOc1cc(ccn1)C e0a5b7a4ceaf137253b09aaa74d8a523 [0,1,0,0,0,0|3,0,0]=4 890 B11R1.24 CCCOc1cc(ccn1)Cl 9bec7845ed0cc2ec4528299e79a75327 [0,1,0,0,0,0|3,0,0]=4 891 B11R1.24 CCCOc1cc(ccn1)F 0dc309ef3e091b80292d2495314d3e88 [0,1,0,0,0,0|3,0,0]=4 892 B11R1.24 CCCOc1ccc[n+](c1)[O-] 68ae6157371b1d08945de942e24dbfcb [0,1,0,0,0,0|3,0,0]=4 893 B11R1.24 CCCOc1cccc(=O)[nH]1 5737faf370dd02b121376f36c61aae8a [0,1,0,0,0,0|3,0,0]=4 894 B11R1.24 CCCOc1cccc(c1)Br a13e2d3b97569660f2094ead5808f8a1 [0,1,0,0,0,0|2,0,0]=3 895 B11R1.24 CCCOc1cccc(c1)C d7061e70aaece534ca2df7008d458f1f [0,1,0,0,0,0|2,0,0]=3 896 B11R1.24 CCCOc1cccc(c1)Cl dd576836e51eec77f1708e34dc442061 [0,1,0,0,0,0|2,0,0]=3 897 B11R1.24 CCCOc1cccc(c1)F cef2c69d3852855819ee350cb218d7bc [0,1,0,0,0,0|2,0,0]=3 898 B11R1.24 CCCOc1cccc(c1)I 5e7b3431fe9595b36463e1f6c0c6091a [0,1,0,0,0,0|2,0,0]=3 899 B11R1.24 CCCOc1cccc(c1)S 9cc4d5ce9f1a372f0235b118438f64df [0,1,0,0,0,0|2,0,0]=3 900 B11R1.24 CCCOc1cccc(n1)Br a9055c800f7a8bea8f5823944b85de73 [0,1,0,0,0,0|3,0,0]=4 901 B11R1.24 CCCOc1cccc(n1)C 39c146d9d455282915fb415280d9321f [0,1,0,0,0,0|3,0,0]=4 902 B11R1.24 CCCOc1cccc(n1)F 64f38a887ca7a2ad9537d774a3104a70 [0,1,0,0,0,0|3,0,0]=4 903 B11R1.24 CCCOc1ccnc(c1)Br 08e99557792cbfff2d46d9cecbba3e9e [0,1,0,0,0,0|3,0,0]=4 904 B11R1.24 CCCOc1ccnc(c1)C fb2ea1b15a9dd2b3d4e9dfb65ec1523f [0,1,0,0,0,0|3,0,0]=4 905 B11R1.24 CCCOc1ccnc(c1)Cl 52dcc4688b93657011ed58be18dc1a12 [0,1,0,0,0,0|3,0,0]=4 906 B11R1.24 CCCOc1ccnc(c1)F 35f6013f4437d8100afe1dae43133855 [0,1,0,0,0,0|3,0,0]=4 907 B11R1.24 CCCOc1cncc(c1)Br 6b4e60f933e3d32ce41374eabb594281 [0,1,0,0,0,0|3,0,0]=4 908 B11R1.24 CCCOc1cncc(c1)C d5edc0e29a183d0a30f574eab2102c23 [0,1,0,0,0,0|3,0,0]=4 909 B11R1.24 CCCOc1cncc(c1)Cl adace2f1506c9567632091a7287ad895 [0,1,0,0,0,0|3,0,0]=4 910 B11R1.24 CCCOc1cncc(c1)F 304c595ae441bc7dd304adfb8c15aedf [0,1,0,0,0,0|3,0,0]=4 911 B11R1.24 CCCOc1cncc(c1)I 4ab44cea02f047116b93f5e680e20338 [0,1,0,0,0,0|3,0,0]=4 912 B11R1.24 CCNCc1cc(ccn1)Br e896276c8fa14cddbcb38ebcdac27e5d [0,1,0,0,0,0|3,0,0]=4 913 B11R1.24 CCNCc1cc(ccn1)C 774f66d8e453a57270dc32842d55134b [0,1,0,0,0,0|3,0,0]=4 914 B11R1.24 CCNCc1cc(ccn1)Cl 5028728b9ac7ebc1c9518284f0807fbd [0,1,0,0,0,0|3,0,0]=4 915 B11R1.24 CCNCc1cc[nH]c(=O)c1 822b19063e584d1569bd185314da610c [0,1,0,0,0,0|3,0,0]=4 916 B11R1.24 CCNCc1ccc[n+](c1)[O-] cecacd94085945062f1860b53e5dce46 [0,1,0,0,0,0|3,0,0]=4 917 B11R1.24 CCNCc1cccc(c1)Br 7cc097aea1efe8376684166a5d7a74a3 [0,1,0,0,0,0|2,0,0]=3 918 B11R1.24 CCNCc1cccc(c1)C 8711965bd65b9b9cae0b5574aaf9df19 [0,1,0,0,0,0|2,0,0]=3 919 B11R1.24 CCNCc1cccc(c1)Cl 35f4a4fcd3415e84e248be1142a75e6e [0,1,0,0,0,0|2,0,0]=3 920 B11R1.24 CCNCc1cccc(c1)F a045945dd7664750cd4517426a30ddec [0,1,0,0,0,0|2,0,0]=3 921 B11R1.24 CCNCc1cccc(c1)I a0250fe998532bc25a8c10c3d959951b [0,1,0,0,0,0|2,0,0]=3 922 B11R1.24 CCNCc1cccc(n1)Br c978bb899b1e5a401c33708277506b25 [0,1,0,0,0,0|3,0,0]=4 923 B11R1.24 CCNCc1cccc(n1)C 152e97bb6eb9a6a331f50dff3115da53 [0,1,0,0,0,0|3,0,0]=4 924 B11R1.24 CCNCc1cccc(n1)Cl 1bd8ce8886953bed1784a34d49705dec [0,1,0,0,0,0|3,0,0]=4 925 B11R1.24 CCNCc1cccc(n1)F 6624bbae6e7a27ced67aeeba1b15f696 [0,1,0,0,0,0|3,0,0]=4 926 B11R1.24 CCNCc1ccnc(c1)Br dcddfd2d86118276109741fc7cde9cb6 [0,1,0,0,0,0|3,0,0]=4 927 B11R1.24 CCNCc1ccnc(c1)C 7d2184712237385ae4b34f01a3fd0b0c [0,1,0,0,0,0|3,0,0]=4 928 B11R1.24 CCNCc1ccnc(c1)Cl 45b9b38e5dbeec1d363a87b7cf99e249 [0,1,0,0,0,0|3,0,0]=4 929 B11R1.24 CCNCc1ccnc(c1)F 52858d7d1efd604efa0a0172f4639a18 [0,1,0,0,0,0|3,0,0]=4 930 B11R1.24 CCNCc1cncc(c1)Br 53d212050b12d7981e083ad8ce2cf307 [0,1,0,0,0,0|3,0,0]=4 931 B11R1.24 CCNCc1cncc(c1)C a8be4d48927f0aa569ae65469d8564f6 [0,1,0,0,0,0|3,0,0]=4 932 B11R1.24 CCNCc1cncc(c1)Cl c844100d4e6cc69aa1cd866fcfd7b483 [0,1,0,0,0,0|3,0,0]=4 933 B11R1.24 CCNCc1cncc(c1)F c98b0bf2a9946ab8a72db48c349e2252 [0,1,0,0,0,0|3,0,0]=4 934 B11R1.24 CCOCc1cc(ccn1)Br 0726b8a141caded4ec904623fca2ab22 [0,1,0,0,0,0|3,0,0]=4 935 B11R1.24 CCOCc1cc(ccn1)C 2d5b6d2e2d714975e85774b9da739956 [0,1,0,0,0,0|3,0,0]=4 936 B11R1.24 CCOCc1cc(ccn1)Cl 158638af681bb2c0924168dfb0c4809a [0,1,0,0,0,0|3,0,0]=4 937 B11R1.24 CCOCc1cc(ccn1)F a0a517bf4ebe3f482da9efb1f014fd4e [0,1,0,0,0,0|3,0,0]=4 938 B11R1.24 CCOCc1cc(ccn1)I 52a26a3ba97e706ba155b551bf3cce2f [0,1,0,0,0,0|3,0,0]=4 939 B11R1.24 CCOCc1cc[nH]c(=O)c1 6c337d7db6361773b01fc7c16459aa70 [0,1,0,0,0,0|3,0,0]=4 940 B11R1.24 CCOCc1ccc[n+](c1)[O-] a8e2d16f1a35335eb42973ab1ece394f [0,1,0,0,0,0|3,0,0]=4 941 B11R1.24 CCOCc1cccc(c1)Br 68ab38873ddd37fd78370dbba526e703 [0,1,0,0,0,0|2,0,0]=3 942 B11R1.24 CCOCc1cccc(c1)C a074366dc5260a76a26e1b3a17ce68f7 [0,1,0,0,0,0|2,0,0]=3 943 B11R1.24 CCOCc1cccc(c1)Cl 8933445146c771b808a03b867c201e1e [0,1,0,0,0,0|2,0,0]=3 944 B11R1.24 CCOCc1cccc(c1)F 01b8eda252200f38637020bb494cc211 [0,1,0,0,0,0|2,0,0]=3 945 B11R1.24 CCOCc1cccc(c1)I ee21a715b45c835bc7170e7ff62f202c [0,1,0,0,0,0|2,0,0]=3 946 B11R1.24 CCOCc1cccc(n1)Br 90a68360acfece20f90108990bcd1149 [0,1,0,0,0,0|3,0,0]=4 947 B11R1.24 CCOCc1cccc(n1)C 28a36ef1d20cbd44690d599ab87bdc5f [0,1,0,0,0,0|3,0,0]=4 948 B11R1.24 CCOCc1cccc(n1)Cl 82ebf630bd981fc4893dc75cb0bef897 [0,1,0,0,0,0|3,0,0]=4 949 B11R1.24 CCOCc1cccc(n1)F 2089888f25135651426c37a52be6c99b [0,1,0,0,0,0|3,0,0]=4 950 B11R1.24 CCOCc1cccc(n1)I fe037eb715fee04a280f82d502bd179d [0,1,0,0,0,0|3,0,0]=4 951 B11R1.24 CCOCc1ccnc(c1)Br 522343afd8b5d1bc5fe8f5b5480e00d3 [0,1,0,0,0,0|3,0,0]=4 952 B11R1.24 CCOCc1ccnc(c1)C d26a680f89e28ac8a7fa03bb8fe9903c [0,1,0,0,0,0|3,0,0]=4 953 B11R1.24 CCOCc1ccnc(c1)Cl e39e3a3a4987b51bf255ed0ef5aa72f6 [0,1,0,0,0,0|3,0,0]=4 954 B11R1.24 CCOCc1ccnc(c1)F b98f40a0d3b636a9028eda0ac3b5ab69 [0,1,0,0,0,0|3,0,0]=4 955 B11R1.24 CCOCc1cncc(c1)C 121fa46d697e1516e023ead6822cc1d1 [0,1,0,0,0,0|3,0,0]=4 956 B11R1.24 CCOCc1cncc(c1)Cl 1e91e3fbb4e3d0c3d9fd920c89ee7a2b [0,1,0,0,0,0|3,0,0]=4 957 B11R1.24 CCOCc1cncc(c1)F eb720cd1e153d372dc09203bc199f583 [0,1,0,0,0,0|3,0,0]=4 958 B11R1.24 CCOCc1cncc(c1)I c0a034a0c75135b9cb15b78e0a4a7802 [0,1,0,0,0,0|3,0,0]=4 959 B11R1.24 COCNc1cc(ccn1)Br 98124c9b7bff257ad47a46b3246dfe42 [0,1,0,0,0,0|2,0,0]=3 960 B11R1.24 COCNc1cc(ccn1)C adae85d67d0345e0f68e69a369f5bba4 [0,1,0,0,0,0|2,0,0]=3 961 B11R1.24 COCNc1cc(ccn1)Cl 82fa414f6c17c6b5480baeedfa72f146 [0,1,0,0,0,0|2,0,0]=3 962 B11R1.24 COCNc1cc(ccn1)F 256b1379eda8d20685ae9c276ff903a0 [0,1,0,0,0,0|2,0,0]=3 963 B11R1.24 COCNc1cc(ccn1)I 2f12763df2ecd64e0527c361f56684ff [0,1,0,0,0,0|2,0,0]=3 964 B11R1.24 COCNc1cc(cnn1)Br 1fdc4239fcc9b3b12c43e887d17f086c [0,1,0,0,0,0|3,0,0]=4 965 B11R1.24 COCNc1cc(cnn1)C e591724fc9f7ddb92b7d785a2c527b34 [0,1,0,0,0,0|3,0,0]=4 966 B11R1.24 COCNc1cc(cnn1)Cl dd3cafbd07f75c557ff6656c824d0705 [0,1,0,0,0,0|3,0,0]=4 967 B11R1.24 COCNc1cc(ncn1)Br b146e18fae14fbf2c32f97f53379c718 [0,1,0,0,0,0|3,0,0]=4 968 B11R1.24 COCNc1cc(ncn1)C 6d318f84b920bdb6372df23391036da4 [0,1,0,0,0,0|3,0,0]=4 969 B11R1.24 COCNc1cc(ncn1)Cl b57ce653d43e325d6719e6e7b88ed6cc [0,1,0,0,0,0|3,0,0]=4 970 B11R1.24 COCNc1cc(ncn1)F 1f42b935a8e4a78e1e99b8d8776c25e6 [0,1,0,0,0,0|3,0,0]=4 971 B11R1.24 COCNc1cc(ncn1)I 68bb14a269685669b404fe7dfa76d2da [0,1,0,0,0,0|3,0,0]=4 972 B11R1.24 COCNc1cc[nH]c(=O)n1 35849b97b1e5d8d7754b8a04e9efc9aa [0,1,0,0,0,0|3,0,0]=4 973 B11R1.24 COCNc1cc[nH]c(=S)c1 322f09345ac65f2a19caeb85f20a24d2 [0,1,0,0,0,0|2,0,0]=3 974 B11R1.24 COCNc1cccc(c1)Br 54ab518230cb656eb7b0f706a3b2523d [0,1,0,0,0,0|1,0,0]=2 975 B11R1.24 COCNc1cccc(c1)C e40cafddbc69f7d986c84fd2fd7b2e65 [0,1,0,0,0,0|1,0,0]=2 976 B11R1.24 COCNc1cccc(c1)Cl 5fec63d5af13dc5d09181347c67375b7 [0,1,0,0,0,0|1,0,0]=2 977 B11R1.24 COCNc1cccc(c1)F a32f433ac1e292f556ca8a506f48aba3 [0,1,0,0,0,0|1,0,0]=2 978 B11R1.24 COCNc1cccc(c1)I 5e0a4810bcf60771391fa32e6e53c7f0 [0,1,0,0,0,0|1,0,0]=2 979 B11R1.24 COCNc1cccc(c1)S 7a5e42ef93f395ab2ea451d763121924 [0,1,0,0,0,0|1,0,0]=2 980 B11R1.24 COCNc1cccc(n1)Br 52ad474fe6f88660af61388b9000376a [0,1,0,0,0,0|2,0,0]=3 981 B11R1.24 COCNc1cccc(n1)C be3044ceb0ac6b2a92548da526a4558a [0,1,0,0,0,0|2,0,0]=3 982 B11R1.24 COCNc1cccc(n1)Cl 2edcbb65f7f23111b499cf9e20f392c8 [0,1,0,0,0,0|2,0,0]=3 983 B11R1.24 COCNc1cccc(n1)F 807cd93285de966b23daa3eb4fcf3128 [0,1,0,0,0,0|2,0,0]=3 984 B11R1.24 COCNc1cccc(n1)I 1f3d9167c3012aa39de560063ed29a2f [0,1,0,0,0,0|2,0,0]=3 985 B11R1.24 COCNc1ccnc(c1)Br 2b5349b5cafb25e0b054aefab4dcf823 [0,1,0,0,0,0|2,0,0]=3 986 B11R1.24 COCNc1ccnc(c1)C 1811146363430dd89ec6b80f6a37da8c [0,1,0,0,0,0|2,0,0]=3 987 B11R1.24 COCNc1ccnc(c1)Cl fcf3435cc4c03d88a22c85668c71f12f [0,1,0,0,0,0|2,0,0]=3 988 B11R1.24 COCNc1ccnc(c1)F 81aac55f9d51ab7ecc94e299344cd0dd [0,1,0,0,0,0|2,0,0]=3 989 B11R1.24 COCNc1ccnc(c1)I a3ba1b0225c25c8258471518dac91f7d [0,1,0,0,0,0|2,0,0]=3 990 B11R1.24 COCNc1ccnc(n1)Br ade708b34a4735ffa744ab1d6f7e3de4 [0,1,0,0,0,0|3,0,0]=4 991 B11R1.24 COCNc1ccnc(n1)C 845dfe85ae41d7a2853cb269cf8cd45e [0,1,0,0,0,0|3,0,0]=4 992 B11R1.24 COCNc1ccnc(n1)Cl 9ccdc3308b8b069b939f022f3d1fa7d6 [0,1,0,0,0,0|3,0,0]=4 993 B11R1.24 COCNc1ccnc(n1)F 482595b767f6184727b55545b02d2662 [0,1,0,0,0,0|3,0,0]=4 994 B11R1.24 COCNc1ccnc(n1)S 1a72c178b165d5cf7e5009344a4317a0 [0,1,0,0,0,0|3,0,0]=4 995 B11R1.24 COCNc1cn[nH]c(=O)c1 990dfee74169f78e4fe9422773297cb6 [0,1,0,0,0,0|3,0,0]=4 996 B11R1.24 COCNc1cncc(c1)Br 54067889abe55ac362f441ff207eb808 [0,1,0,0,0,0|2,0,0]=3 997 B11R1.24 COCNc1cncc(c1)C 448c9afc1407b2ec8b74487bb811d395 [0,1,0,0,0,0|2,0,0]=3 998 B11R1.24 COCNc1cncc(c1)Cl 5cd91e133031f053d648164410aaea8b [0,1,0,0,0,0|2,0,0]=3 999 B11R1.24 COCNc1cncc(c1)F 3abf0c20a4253f7ef3f418cef9d08897 [0,1,0,0,0,0|2,0,0]=3 1000 B11R1.24 COCNc1cncc(c1)I 502e915a1bbd1090e89a51113e78234b [0,1,0,0,0,0|2,0,0]=3 1001 B11R1.24 COCNc1cncc(n1)Br 6291786e945ff82dcb9d5f69be5c17ca [0,1,0,0,0,0|3,0,0]=4 1002 B11R1.24 COCNc1cncc(n1)C 2b6ec934ce08c5d786355e60e1b75b15 [0,1,0,0,0,0|3,0,0]=4 1003 B11R1.24 COCNc1cncc(n1)Cl 33f5fcccca32b1d1dbb534d3025bc64f [0,1,0,0,0,0|3,0,0]=4 1004 B11R1.24 COCNc1cncc(n1)F 1ec4ee6769e740c4e0d5102cdb38a25f [0,1,0,0,0,0|3,0,0]=4 1005 B11R1.24 COCNc1cnnc(c1)Cl 01dfb1b96149378678a5233962e42080 [0,1,0,0,0,0|3,0,0]=4 1006 B11R1.24 COCNc1cnnc(c1)F 6d9cd25a8704eb9be1b2ba1bf0f1bd08 [0,1,0,0,0,0|3,0,0]=4 1007 B11R1.24 COCNc1nccc(=O)[nH]1 5ba020d7b9f5816107426b5c41c3bbae [0,1,0,0,0,0|3,0,0]=4 1008 B11R1.24 COCNc1nccc(n1)Br 55e9cdcbf8e9231d253d92f948c05c71 [0,1,0,0,0,0|3,0,0]=4 1009 B11R1.24 COCNc1nccc(n1)C bd57a8e8fb6aef7b61999c53ab7da126 [0,1,0,0,0,0|3,0,0]=4 1010 B11R1.24 COCNc1nccc(n1)Cl e11d0b58882951e293cdd34c28575696 [0,1,0,0,0,0|3,0,0]=4 1011 B11R1.24 COCNc1nccc(n1)F 28bd64f015d7f8ddb67c64771501ff8d [0,1,0,0,0,0|3,0,0]=4 1012 B11R1.24 COCNc1nccc(n1)I 8cac35fb8201a9f1a25296bde9bc79b3 [0,1,0,0,0,0|3,0,0]=4 1013 B11R1.24 COCNc1nccc(n1)S 7b4aef2448b21cbee7de379e3c3a2057 [0,1,0,0,0,0|3,0,0]=4 1014 B11R1.24 COCOc1cc(ccn1)Br 65aed7a96671b122067c519313de7f92 [0,1,0,0,0,0|2,0,0]=3 1015 B11R1.24 COCOc1cc(ccn1)C 4e8a06007f28535df1d88671528d0566 [0,1,0,0,0,0|2,0,0]=3 1016 B11R1.24 COCOc1cc(ccn1)Cl dccc69d15f2c2d7e9438856402bd9972 [0,1,0,0,0,0|2,0,0]=3 1017 B11R1.24 COCOc1cc(ccn1)F 7b986b3d89c50d5fb9d05859547f4d63 [0,1,0,0,0,0|2,0,0]=3 1018 B11R1.24 COCOc1cc(ncn1)Br c391ce5c3ff15f2d0e0f81c0669d1f67 [0,1,0,0,0,0|3,0,0]=4 1019 B11R1.24 COCOc1cc(ncn1)C 17f2756091c952f5c526bea2f69cbd53 [0,1,0,0,0,0|3,0,0]=4 1020 B11R1.24 COCOc1cc(ncn1)Cl d97fc01aae854e38d63add2a63f5ccd2 [0,1,0,0,0,0|3,0,0]=4 1021 B11R1.24 COCOc1ccc[n+](c1)[O-] 105b7ed84e201406d6112f3dd7df9324 [0,1,0,0,0,0|2,0,0]=3 1022 B11R1.24 COCOc1cccc(=O)[nH]1 4e7c45c2fcd4d41ad584fbbd03f06ea5 [0,1,0,0,0,0|2,0,0]=3 1023 B11R1.24 COCOc1cccc(c1)Br 2a6abf33039da8d6a127bf06afc59684 [0,1,0,0,0,0|1,0,0]=2 1024 B11R1.24 COCOc1cccc(c1)C 7f6034c6ce7e0cf435553f03c34eb3b4 [0,1,0,0,0,0|1,0,0]=2 1025 B11R1.24 COCOc1cccc(c1)Cl 48ebca3e91d1b94d31eb01f0ebd1d5f5 [0,1,0,0,0,0|1,0,0]=2 1026 B11R1.24 COCOc1cccc(c1)F 57852b600c5c4949aa6afcf99594de8a [0,1,0,0,0,0|1,0,0]=2 1027 B11R1.24 COCOc1cccc(c1)I dc0a1558ee1d114659f7cd3e8038db45 [0,1,0,0,0,0|1,0,0]=2 1028 B11R1.24 COCOc1cccc(c1)S 41f2d43a0582d926af82f7cd52bdead1 [0,1,0,0,0,0|1,0,0]=2 1029 B11R1.24 COCOc1cccc(n1)Br cfccfad20d5c8551624ee27c2bf8d66b [0,1,0,0,0,0|2,0,0]=3 1030 B11R1.24 COCOc1cccc(n1)C fdff37993ec0f9f87123e33942d46a32 [0,1,0,0,0,0|2,0,0]=3 1031 B11R1.24 COCOc1cccc(n1)F 7295bdfeb7d8f2b4178f51c12a1cade1 [0,1,0,0,0,0|2,0,0]=3 1032 B11R1.24 COCOc1ccnc(c1)Br 4469fc7d7b920257e34260d67fb249eb [0,1,0,0,0,0|2,0,0]=3 1033 B11R1.24 COCOc1ccnc(c1)C d896b3ff0683e270a34b09cd84bf786f [0,1,0,0,0,0|2,0,0]=3 1034 B11R1.24 COCOc1ccnc(c1)Cl 8d70282210da51a09890be43c8d2655e [0,1,0,0,0,0|2,0,0]=3 1035 B11R1.24 COCOc1ccnc(c1)F 97c2e5cb4737dbe54c2a051b447d0d8f [0,1,0,0,0,0|2,0,0]=3 1036 B11R1.24 COCOc1ccnc(n1)C fe4444303d1c57660c8ffd6866ec67cb [0,1,0,0,0,0|3,0,0]=4 1037 B11R1.24 COCOc1ccnc(n1)Cl 2dd26efe996b2bf1378f3bb7d14a42ea [0,1,0,0,0,0|3,0,0]=4 1038 B11R1.24 COCOc1cncc(c1)C 1568f27dd177de11bec25831df7d9697 [0,1,0,0,0,0|2,0,0]=3 1039 B11R1.24 COCOc1cncc(c1)Cl 367afd4f2cb0bd0ffebfbb48f815a8fe [0,1,0,0,0,0|2,0,0]=3 1040 B11R1.24 COCOc1cncc(c1)F 9e274587bbc5dfd0e16ce26806680338 [0,1,0,0,0,0|2,0,0]=3 1041 B11R1.24 COCOc1cncc(c1)I b752a6bdadb6a34ee79777741a75da1a [0,1,0,0,0,0|2,0,0]=3 1042 B11R1.24 COCOc1cncc(n1)Br 500eac92c7ace03eb7f00541dd3eb004 [0,1,0,0,0,0|3,0,0]=4 1043 B11R1.24 COCOc1cncc(n1)C e6cdc25d0a82d3aa5af1bc8661582846 [0,1,0,0,0,0|3,0,0]=4 1044 B11R1.24 COCOc1cncc(n1)Cl fd556a26541e43f7c5930d91958d854e [0,1,0,0,0,0|3,0,0]=4 1045 B11R1.24 COCOc1cnnc(c1)Cl b016bcb10a831aadf506dbd231a8b7fe [0,1,0,0,0,0|3,0,0]=4 1046 B11R1.24 COCOc1nccc(n1)Cl 0764cd72eb68607d3aced06483b6da83 [0,1,0,0,0,0|3,0,0]=4 1047 B11R1.24 COCOc1nccc(n1)S 0d74af096dbd4fde08b88090ef21837a [0,1,0,0,0,0|3,0,0]=4 1048 B11R1.24 CSCNc1cc(ccn1)Br 821e028b972ec93033f2f36cb1d10b53 [0,1,0,0,0,0|2,1,0]=4 1049 B11R1.24 CSCNc1cc(ccn1)C f59f3b34a1d6d5b58a9c3715147bb192 [0,1,0,0,0,0|2,1,0]=4 1050 B11R1.24 CSCNc1cc(ccn1)F b8725dd6b56860d09663dcb16ae3d185 [0,1,0,0,0,0|2,1,0]=4 1051 B11R1.24 CSCNc1cc(ccn1)I 8326232776928c130715f4052f8244a6 [0,1,0,0,0,0|2,1,0]=4 1052 B11R1.24 CSCNc1cc[nH]c(=S)c1 33a623c7290e227eb4eef8e6e21914ca [0,1,0,0,0,0|2,1,0]=4 1053 B11R1.24 CSCNc1cccc(c1)Br 29a70d1c57b2a6862900b92143c88670 [0,1,0,0,0,0|1,1,0]=3 1054 B11R1.24 CSCNc1cccc(c1)C c0825a11246fc57479dbaf679e542a1e [0,1,0,0,0,0|1,1,0]=3 1055 B11R1.24 CSCNc1cccc(c1)Cl f4c5ef06861d0e83dfcececc5dd6c4c5 [0,1,0,0,0,0|1,1,0]=3 1056 B11R1.24 CSCNc1cccc(c1)F 5fd25ec6b3de63445bbe39f47d6bd6b1 [0,1,0,0,0,0|1,1,0]=3 1057 B11R1.24 CSCNc1cccc(c1)I 6760b1b4a0cbda7b058b59cca3341fc5 [0,1,0,0,0,0|1,1,0]=3 1058 B11R1.24 CSCNc1cccc(c1)S 82af3cc22613e1ec78dab2837f1b662e [0,1,0,0,0,0|1,1,0]=3 1059 B11R1.24 CSCNc1cccc(n1)Br 2c83887440e46bac8434e5134018863d [0,1,0,0,0,0|2,1,0]=4 1060 B11R1.24 CSCNc1cccc(n1)C 75461631c24f8880a127b1a36251a2bb [0,1,0,0,0,0|2,1,0]=4 1061 B11R1.24 CSCNc1cccc(n1)F 843bd2ecc7e55bd6274d61364e4e1e97 [0,1,0,0,0,0|2,1,0]=4 1062 B11R1.24 CSCNc1cccc(n1)I fa81b640f7e964620d7adf874a9ca42c [0,1,0,0,0,0|2,1,0]=4 1063 B11R1.24 CSCNc1ccnc(c1)Br f4699c0ac3f2c664539e774cba512632 [0,1,0,0,0,0|2,1,0]=4 1064 B11R1.24 CSCNc1ccnc(c1)C c7b0e8d7d1b3944365c00cd26ebbe6fa [0,1,0,0,0,0|2,1,0]=4 1065 B11R1.24 CSCNc1ccnc(c1)Cl fd4810bb7cfddd000c5ef54e28ed0d05 [0,1,0,0,0,0|2,1,0]=4 1066 B11R1.24 CSCNc1ccnc(c1)F a18b9f124d05ed39d2810f35e7c521fd [0,1,0,0,0,0|2,1,0]=4 1067 B11R1.24 CSCNc1ccnc(c1)I 5ba9d7539c2617e40033d71121becefb [0,1,0,0,0,0|2,1,0]=4 1068 B11R1.24 CSCNc1cncc(c1)Br 7998d75fd36161780c42e7f3539f3b5e [0,1,0,0,0,0|2,1,0]=4 1069 B11R1.24 CSCNc1cncc(c1)C f2456ea0d53ab604d34e6572cd403616 [0,1,0,0,0,0|2,1,0]=4 1070 B11R1.24 CSCNc1cncc(c1)Cl 2a3dfb5b9cf4706ee6adbe2e29e18025 [0,1,0,0,0,0|2,1,0]=4 1071 B11R1.24 CSCNc1cncc(c1)F 5445f87a9b91b2eb988adb62825e57d8 [0,1,0,0,0,0|2,1,0]=4 1072 B11R1.24 CSCNc1cncc(c1)I 6edfb3997097c7f8d6a64a5cb2dfaf0c [0,1,0,0,0,0|2,1,0]=4 1073 B11R1.24 CSCOc1cc(ccn1)Br 76e65c49389513f6fda25e13117f39a6 [0,1,0,0,0,0|2,1,0]=4 1074 B11R1.24 CSCOc1cc(ccn1)C 2faa44f135e08f68fd43d0cae3d26b0f [0,1,0,0,0,0|2,1,0]=4 1075 B11R1.24 CSCOc1cc(ccn1)Cl 9b042639528d2292c33f123ecf5f0ebb [0,1,0,0,0,0|2,1,0]=4 1076 B11R1.24 CSCOc1cc(ccn1)F bbc7633afade6181454c5eb55d8f15ef [0,1,0,0,0,0|2,1,0]=4 1077 B11R1.24 CSCOc1ccc[n+](c1)[O-] ba8e90722a31ebf09951850a69b2ba67 [0,1,0,0,0,0|2,1,0]=4 1078 B11R1.24 CSCOc1cccc(=O)[nH]1 84f798d9c43065583c63e5013a069ffc [0,1,0,0,0,0|2,1,0]=4 1079 B11R1.24 CSCOc1cccc(c1)Br 2fc2decfaeed8e2637e59ef79e480e2e [0,1,0,0,0,0|1,1,0]=3 1080 B11R1.24 CSCOc1cccc(c1)C 3bbece07bfd11b6c7fccb7bd794595e6 [0,1,0,0,0,0|1,1,0]=3 1081 B11R1.24 CSCOc1cccc(c1)Cl d969539c0fc634f8b06467139de899ee [0,1,0,0,0,0|1,1,0]=3 1082 B11R1.24 CSCOc1cccc(c1)F 9962e38297c29e8aa2aa2e5b5084ce29 [0,1,0,0,0,0|1,1,0]=3 1083 B11R1.24 CSCOc1cccc(c1)I f67cf1bee76b71349f1961d39d8971e2 [0,1,0,0,0,0|1,1,0]=3 1084 B11R1.24 CSCOc1cccc(c1)S 3789f145b0fcf7ff307990a1edfd11fc [0,1,0,0,0,0|1,1,0]=3 1085 B11R1.24 CSCOc1cccc(n1)Br adf643fe9b877dfeed3d0b1ba4335256 [0,1,0,0,0,0|2,1,0]=4 1086 B11R1.24 CSCOc1cccc(n1)C 0e5e219e6e56059f9820074336b83010 [0,1,0,0,0,0|2,1,0]=4 1087 B11R1.24 CSCOc1cccc(n1)F 42143d365a182477003511c6587dfea5 [0,1,0,0,0,0|2,1,0]=4 1088 B11R1.24 CSCOc1ccnc(c1)Br f7bb32b619d2a25ae3d12efd90805774 [0,1,0,0,0,0|2,1,0]=4 1089 B11R1.24 CSCOc1ccnc(c1)C a3e4d842d5e2076ede81ff72719014b5 [0,1,0,0,0,0|2,1,0]=4 1090 B11R1.24 CSCOc1ccnc(c1)Cl c444686bce4202fef14e96fa9a4221f5 [0,1,0,0,0,0|2,1,0]=4 1091 B11R1.24 CSCOc1ccnc(c1)F 32720fbd4eace1c7a04b2ac05f2c8ef3 [0,1,0,0,0,0|2,1,0]=4 1092 B11R1.24 CSCOc1cncc(c1)C 2f6163fe1b5e7e262e2de6456ce6a266 [0,1,0,0,0,0|2,1,0]=4 1093 B11R1.24 CSCOc1cncc(c1)Cl 2099a6911d67580fbe9ac57f4accd2c4 [0,1,0,0,0,0|2,1,0]=4 1094 B11R1.24 CSCOc1cncc(c1)F 108fbba935e3b81dad9f7af1754682fa [0,1,0,0,0,0|2,1,0]=4 1095 B11R1.24 CSCOc1cncc(c1)I 82005955d772372db6213f308abf9343 [0,1,0,0,0,0|2,1,0]=4 1096 B11R1.24 Cc1cccc(c1)CNC#N afb8590a54656766c7fa3e8613412263 [0,1,0,0,0,0|3,0,0]=4 1097 B11R1.24 Cc1cccc(c1)CNC=O f999de901cc8b568a96ef98318b0e85f [0,1,0,0,0,0|3,0,0]=4 1098 B11R1.24 Cc1cccc(c1)CNCF 26331ce248fc61a15345fc123ac841ae [0,1,0,0,0,0|3,0,0]=4 1099 B11R1.24 Cc1cccc(c1)CNCO d0a6ec7f4afcd99e7d28be3d4dacede0 [0,1,0,0,0,0|3,0,0]=4 1100 B11R1.24 Cc1cccc(c1)COCF 11267dea5d808124a105735821eaa460 [0,1,0,0,0,0|3,0,0]=4 1101 B11R1.24 Cc1cccc(c1)NCC#N 3cba4168a46541a82af34519ff46a560 [0,1,0,0,0,0|3,0,0]=4 1102 B11R1.24 Cc1cccc(c1)NCC=O 02b27afd26a0d485177136f96a1c2349 [0,1,0,0,0,0|3,0,0]=4 1103 B11R1.24 Cc1cccc(c1)NCCBr b97f20affb757b68290bd66ce1b22b5b [0,1,0,0,0,0|3,0,0]=4 1104 B11R1.24 Cc1cccc(c1)NCCF f4aa25c81ffda72c7e085e967a29bd7e [0,1,0,0,0,0|3,0,0]=4 1105 B11R1.24 Cc1cccc(c1)NCCI 1dd161cd96cff309cd4fab79d94b8f2a [0,1,0,0,0,0|3,0,0]=4 1106 B11R1.24 Cc1cccc(c1)NCCO 788520a7b5122ba23efd60ec7af11b62 [0,1,0,0,0,0|3,0,0]=4 1107 B11R1.24 Cc1cccc(c1)NCCS 7b98a9c950cebe1dd8819c5a884e6fc9 [0,1,0,0,0,0|3,0,0]=4 1108 B11R1.24 Cc1cccc(c1)OCC#N 6702af89f3265bb500dd2882d0af8734 [0,1,0,0,0,0|3,0,0]=4 1109 B11R1.24 Cc1cccc(c1)OCC=O d45d2710eb10d050ca7ae3507eaed4d8 [0,1,0,0,0,0|3,0,0]=4 1110 B11R1.24 Cc1cccc(c1)OCCF a1c1a8f8d1b8dd943777980aef0cd973 [0,1,0,0,0,0|3,0,0]=4 1111 B11R1.24 Cc1cccc(c1)OCCS c6d124754d0867f0c038fb362a7e43c1 [0,1,0,0,0,0|3,0,0]=4 1112 B11R1.24 FCCNc1cccc(c1)Br a0d0349e1b2d40b05cc1bfe14bd197ca [0,1,0,0,0,0|3,0,0]=4 1113 B11R1.24 FCCNc1cccc(c1)Cl 9349b62cb412641ee884eb579a3f9bdb [0,1,0,0,0,0|3,0,0]=4 1114 B11R1.24 FCCNc1cccc(c1)F c96c058abaf24744205bd606ad9daa10 [0,1,0,0,0,0|3,0,0]=4 1115 B11R1.24 FCCNc1cccc(c1)I 504a4adcecca797bc0ba40fa19488c7d [0,1,0,0,0,0|3,0,0]=4 1116 B11R1.24 FCCNc1cccc(c1)S aece59adaa14c81c1f80f1dd56827823 [0,1,0,0,0,0|3,0,0]=4 1117 B11R1.24 FCCOc1cccc(c1)Br dc7f08a58233cf92115127accf5a3b35 [0,1,0,0,0,0|3,0,0]=4 1118 B11R1.24 FCCOc1cccc(c1)Cl c66ffbbe922aa739c018d5aa4816af47 [0,1,0,0,0,0|3,0,0]=4 1119 B11R1.24 FCCOc1cccc(c1)F ce9f0d6a6eed787c7ba2b20b9d6cd5cc [0,1,0,0,0,0|3,0,0]=4 1120 B11R1.24 FCCOc1cccc(c1)I 96f9406b79ce29e6a0cb635643af7fc7 [0,1,0,0,0,0|3,0,0]=4 1121 B11R1.24 FCCOc1cccc(c1)S 5e27e494d241022e1e68313fade9dc4b [0,1,0,0,0,0|3,0,0]=4 1122 B11R1.24 FCNCc1cccc(c1)Br 7d04e2339b42e8f2d0122b4fdbb3009d [0,1,0,0,0,0|3,0,0]=4 1123 B11R1.24 FCNCc1cccc(c1)Cl e145b682fefd1d3baa7ebff04addc07b [0,1,0,0,0,0|3,0,0]=4 1124 B11R1.24 FCNCc1cccc(c1)F 6e9400ce8cf9ff79d0c0062ec100268a [0,1,0,0,0,0|3,0,0]=4 1125 B11R1.24 FCNCc1cccc(c1)I 3974009fe99bec9ffdffbaebd85438b2 [0,1,0,0,0,0|3,0,0]=4 1126 B11R1.24 FCOCc1cccc(c1)Br 06fd5492a825faa19dd2b0a6ce53ff70 [0,1,0,0,0,0|3,0,0]=4 1127 B11R1.24 FCOCc1cccc(c1)Cl bc6f623318574bc18fb6d005c3b19654 [0,1,0,0,0,0|3,0,0]=4 1128 B11R1.24 FCOCc1cccc(c1)F 54b20c54954574867369722c4db6da9a [0,1,0,0,0,0|3,0,0]=4 1129 B11R1.24 FCOCc1cccc(c1)I 20971ddf8a9eb4748299b05e02229bbd [0,1,0,0,0,0|3,0,0]=4 1130 B11R1.24 Fc1cccc(c1)NCCI 8a6f044d8ed2ec996c87b3f7662b5d9e [0,1,0,0,0,0|3,0,0]=4 1131 B11R1.24 Fc1cccc(c1)NCCS 111e99f9a18e94deed9c071f45698da5 [0,1,0,0,0,0|3,0,0]=4 1132 B11R1.24 Fc1cccc(c1)OCCS 6a888b3fc77bfaa56db9101dd1183ce5 [0,1,0,0,0,0|3,0,0]=4 1133 B11R1.24 N#CCNc1cccc(c1)Br 348259becb6b70b29b12033843006068 [0,1,0,0,0,0|3,0,0]=4 1134 B11R1.24 N#CCNc1cccc(c1)Cl 7d80c428edb313059949a7052d2869e3 [0,1,0,0,0,0|3,0,0]=4 1135 B11R1.24 N#CCNc1cccc(c1)F 70e470b735915172a7cb5bc6acf01c66 [0,1,0,0,0,0|3,0,0]=4 1136 B11R1.24 N#CCNc1cccc(c1)I e7ffac9f83565862a1ea9c67a48f76b9 [0,1,0,0,0,0|3,0,0]=4 1137 B11R1.24 N#CCNc1cccc(c1)S 06bf484f2d9a22e28b22fbf407c194f3 [0,1,0,0,0,0|3,0,0]=4 1138 B11R1.24 N#CCOc1cccc(c1)Br ce61b6196ec759074c54d0e9647e72f5 [0,1,0,0,0,0|3,0,0]=4 1139 B11R1.24 N#CCOc1cccc(c1)Cl e2375187209f6bc8f8694d190b5227df [0,1,0,0,0,0|3,0,0]=4 1140 B11R1.24 N#CCOc1cccc(c1)F 81e071522f4734d7ce713bf2f89b8cd7 [0,1,0,0,0,0|3,0,0]=4 1141 B11R1.24 N#CCOc1cccc(c1)I dcc082d99e6fa9fa7ba7a9dcee94534f [0,1,0,0,0,0|3,0,0]=4 1142 B11R1.24 N#CCOc1cccc(c1)S f65db35aa1287bc7c82976e5220a9d88 [0,1,0,0,0,0|3,0,0]=4 1143 B11R1.24 N#CNCc1cccc(c1)Br 40947e3a7b47e2be9d0f96d385ea1cab [0,1,0,0,0,0|3,0,0]=4 1144 B11R1.24 N#CNCc1cccc(c1)Cl 999e9fb7fa6a6663d2a527e282871e10 [0,1,0,0,0,0|3,0,0]=4 1145 B11R1.24 N#CNCc1cccc(c1)F 62d3238376d897dcb10c1c919ec65fde [0,1,0,0,0,0|3,0,0]=4 1146 B11R1.24 N#CNCc1cccc(c1)I 602c3d6d94c8e2962c7676d14076aa55 [0,1,0,0,0,0|3,0,0]=4 1147 B11R1.24 O=CCNc1cccc(c1)Br 58f3b4009c79f8260654c2f82a7f1a3d [0,1,0,0,0,0|3,0,0]=4 1148 B11R1.24 O=CCNc1cccc(c1)Cl 145c9e2238e5a2eb6727bb5fb70c46c7 [0,1,0,0,0,0|3,0,0]=4 1149 B11R1.24 O=CCNc1cccc(c1)F 0b3b77aa23b4986f0408df0f726301d4 [0,1,0,0,0,0|3,0,0]=4 1150 B11R1.24 O=CCNc1cccc(c1)I 60c53eb71c9911d5ebb2128f0fd07f21 [0,1,0,0,0,0|3,0,0]=4 1151 B11R1.24 O=CCNc1cccc(c1)S d40d643635af2cd3f7207d81f532ddbc [0,1,0,0,0,0|3,0,0]=4 1152 B11R1.24 O=CCOc1cccc(c1)Br eaec2e608b2f57f0aae7fb33a6d921c5 [0,1,0,0,0,0|3,0,0]=4 1153 B11R1.24 O=CCOc1cccc(c1)Cl 09a2ec3cff5ec5fde89682fb08cc0f7b [0,1,0,0,0,0|3,0,0]=4 1154 B11R1.24 O=CCOc1cccc(c1)F 63ba6481d3258093a9a164e021cf554a [0,1,0,0,0,0|3,0,0]=4 1155 B11R1.24 O=CCOc1cccc(c1)I 33223811f432c000dfcff405ac1ea782 [0,1,0,0,0,0|3,0,0]=4 1156 B11R1.24 O=CCOc1cccc(c1)S 8914a299f171d96ef4b0ade9c428be82 [0,1,0,0,0,0|3,0,0]=4 1157 B11R1.24 O=CNCc1cccc(c1)Br 81a6d67e7c0081d831790a4f60fdd665 [0,1,0,0,0,0|3,0,0]=4 1158 B11R1.24 O=CNCc1cccc(c1)Cl 65b698943b3a92d1bd4a0e6dffd59e66 [0,1,0,0,0,0|3,0,0]=4 1159 B11R1.24 O=CNCc1cccc(c1)F 27dcacf4bc23db553cf8adde50a08a8b [0,1,0,0,0,0|3,0,0]=4 1160 B11R1.24 O=CNCc1cccc(c1)I ac2116931a566ab6ed04886c2660a5c2 [0,1,0,0,0,0|3,0,0]=4 1161 B11R1.24 O=CNCc1cccc(c1)O 5064b7b78a71b73f549eda5bd0de9ccc [0,1,0,0,0,0|3,0,0]=4 1162 B11R1.24 OCCNc1cccc(c1)Br 72567362870bfac93c93e7b10c66dbef [0,1,0,0,0,0|3,0,0]=4 1163 B11R1.24 OCCNc1cccc(c1)Cl e17e7e92e4c4d52ba070bc2481182aec [0,1,0,0,0,0|3,0,0]=4 1164 B11R1.24 OCCNc1cccc(c1)F efdd551ee0f00745ebb911089af2cb0e [0,1,0,0,0,0|3,0,0]=4 1165 B11R1.24 OCCNc1cccc(c1)I f3c298b6e86d76fb00282800b71da201 [0,1,0,0,0,0|3,0,0]=4 1166 B11R1.24 OCCNc1cccc(c1)S bc3a43ad2a55514906329a47347a3147 [0,1,0,0,0,0|3,0,0]=4 1167 B11R1.24 OCNCc1cccc(c1)Br 9ae94d6fc4c7aac28899119fef51b5ec [0,1,0,0,0,0|3,0,0]=4 1168 B11R1.24 OCNCc1cccc(c1)Cl 713c7b0184423731a15a73fa223201b6 [0,1,0,0,0,0|3,0,0]=4 1169 B11R1.24 OCNCc1cccc(c1)F a12edc0401d7c1be2d7abc20d4ca38fc [0,1,0,0,0,0|3,0,0]=4 1170 B11R1.24 OCNCc1cccc(c1)I f7370a634a3488ab18a27f63d6247824 [0,1,0,0,0,0|3,0,0]=4 1171 B11R1.24 Oc1cccc(c1)NCCS 90fb0bece5f4ef3440fd1c51e48f120a [0,1,0,0,0,0|3,0,0]=4 1172 B11R1.24 SCCNc1cccc(c1)Br cbcc30b1e277f7e40eb9e326ae777bb5 [0,1,0,0,0,0|3,0,0]=4 1173 B11R1.24 SCCNc1cccc(c1)Cl 2f57001a83ec8d5ce3c44dce9353a13f [0,1,0,0,0,0|3,0,0]=4 1174 B11R1.24 SCCNc1cccc(c1)I f5616d4701847e6288fc4af92fec75a5 [0,1,0,0,0,0|3,0,0]=4 1175 B11R1.24 SCCNc1cccc(c1)S 0e0fd34954253302d73110367a83e4a4 [0,1,0,0,0,0|3,0,0]=4 1176 B11R1.24 SCCOc1cccc(c1)Br e29f1287cdedf4ced05629d8ec3308ee [0,1,0,0,0,0|3,0,0]=4 1177 B11R1.24 SCCOc1cccc(c1)Cl c6106fdfdfada56aa5873825021fa0eb [0,1,0,0,0,0|3,0,0]=4 1178 B11R1.24 SCCOc1cccc(c1)I fe2c18f3e6909e773b949d048cdd6619 [0,1,0,0,0,0|3,0,0]=4 1179 B11R1.24 SCCOc1cccc(c1)S 9191721e00952c64cadf2154be9938a1 [0,1,0,0,0,0|3,0,0]=4 1180 B11R1.28 BrCCNCc1ccccc1 ac057fc43e8d6ea85181427003cd8239 [0,1,0,0,0,0|2,0,0]=3 1181 B11R1.28 BrCCNCc1ccccn1 90bb93ff46fc49bde9265b45b65f9d87 [0,1,0,0,0,0|3,0,0]=4 1182 B11R1.28 BrCCNCc1cccnc1 a9888ba9b6c914af5c547c17a572df8f [0,1,0,0,0,0|3,0,0]=4 1183 B11R1.28 C#CCCNc1ccccc1 a50e6468b9593b4ac45e12d5e3b3638a [0,1,0,0,0,0|1,0,1]=3 1184 B11R1.28 C#CCCNc1ccccn1 f7a1e5b263bb577848e2c7d42a3f97ae [0,1,0,0,0,0|2,0,1]=4 1185 B11R1.28 C#CCCNc1cccnc1 d032e547e1f10b86035879ba8cd846a5 [0,1,0,0,0,0|2,0,1]=4 1186 B11R1.28 C#CCCNc1ccncc1 4b8e3279164a38893047d431a4cd8632 [0,1,0,0,0,0|2,0,1]=4 1187 B11R1.28 C#CCCOc1ccccn1 e508d62db929222e2eb37d5403bac035 [0,1,0,0,0,0|2,0,1]=4 1188 B11R1.28 C#CCCOc1cccnc1 4e28053c00ae475249fd9364081f9ff0 [0,1,0,0,0,0|2,0,1]=4 1189 B11R1.28 C#CCCOc1ccncc1 976260e0c9042d6fec7d7012d4067985 [0,1,0,0,0,0|2,0,1]=4 1190 B11R1.28 C#CCNCc1ccccc1 5ab7d08152aaaf12430a9163e509ecd1 [0,1,0,0,0,0|1,0,1]=3 1191 B11R1.28 C#CCNCc1ccccn1 a9c6f935a920670fb547218475a4aafd [0,1,0,0,0,0|2,0,1]=4 1192 B11R1.28 C#CCNCc1cccnc1 711cdba6849e2f009fb36a9139d4703a [0,1,0,0,0,0|2,0,1]=4 1193 B11R1.28 C#CCNCc1ccncc1 e1276392d81c6c5c56f4accf16fc09eb [0,1,0,0,0,0|2,0,1]=4 1194 B11R1.28 C#CCOCc1ccccc1 4aff10236737b564a9b29132113db7f4 [0,1,0,0,0,0|1,0,1]=3 1195 B11R1.28 C#CCOCc1ccccn1 2e4da7abeb61c83d6f30a0e249bff80d [0,1,0,0,0,0|2,0,1]=4 1196 B11R1.28 C#CCOCc1cccnc1 f598f008a419576408c9aa89b9e6160a [0,1,0,0,0,0|2,0,1]=4 1197 B11R1.28 C#CCOCc1ccncc1 e80ec245d7321372e2a66f7f3130a349 [0,1,0,0,0,0|2,0,1]=4 1198 B11R1.28 C/C=C/CNc1ccccc1 e02cbeaffef0ff2c4795b558e93457ed [0,1,0,0,0,0|1,0,1]=3 1199 B11R1.28 C/C=C/CNc1ccccn1 5a61b9aee47fe046ef4ac884866e0a57 [0,1,0,0,0,0|2,0,1]=4 1200 B11R1.28 C/C=C/CNc1cccnc1 016f8674f0de62bc0968120f36183bbf [0,1,0,0,0,0|2,0,1]=4 1201 B11R1.28 C/C=C/CNc1ccncc1 fa31f47fa5bc1ec1ccb1bf7f45f30dc4 [0,1,0,0,0,0|2,0,1]=4 1202 B11R1.28 C/C=C/COc1ccccn1 ed755d9f4a3a906e4d287cc92f6a9256 [0,1,0,0,0,0|2,0,1]=4 1203 B11R1.28 C/C=C/COc1cccnc1 182aabd1e115f20a2221ff63f4609b70 [0,1,0,0,0,0|2,0,1]=4 1204 B11R1.28 C/C=C/COc1ccncc1 626a36d815056b548624718762e7a1fe [0,1,0,0,0,0|2,0,1]=4 1205 B11R1.28 C/C=C\CNc1ccccc1 f25f4c9ee5d52b5a340bd4a7fd720817 [0,1,0,0,0,0|1,0,1]=3 1206 B11R1.28 C/C=C\CNc1ccccn1 c173af20e99f83d9a5c456a592ef1e15 [0,1,0,0,0,0|2,0,1]=4 1207 B11R1.28 C/C=C\CNc1cccnc1 be373d2993e9bf82390bd09b9626574e [0,1,0,0,0,0|2,0,1]=4 1208 B11R1.28 C/C=C\CNc1ccncc1 a87b6e6c7832e2cb33ea74aa8e2c65c1 [0,1,0,0,0,0|2,0,1]=4 1209 B11R1.28 C/C=C\COc1ccccn1 69073974b597ab405a0094b540a97f81 [0,1,0,0,0,0|2,0,1]=4 1210 B11R1.28 C/C=C\COc1cccnc1 d486f9f7e5b795e5a8aedabfa7f6ce63 [0,1,0,0,0,0|2,0,1]=4 1211 B11R1.28 C/C=C\COc1ccncc1 111e76a9a567d470a95d2cac0ae301d3 [0,1,0,0,0,0|2,0,1]=4 1212 B11R1.28 C=CCCNc1ccccc1 41e5ae44107c117783190eb282a3dc50 [0,1,0,0,0,0|1,0,1]=3 1213 B11R1.28 C=CCCNc1ccccn1 e92a5093fa2898ea30d4fe7927707a16 [0,1,0,0,0,0|2,0,1]=4 1214 B11R1.28 C=CCCNc1cccnc1 037ab6e30e93fe1574bf3e5b2653f3ce [0,1,0,0,0,0|2,0,1]=4 1215 B11R1.28 C=CCCNc1ccncc1 b2379308cfd1e30f71b1926532910f97 [0,1,0,0,0,0|2,0,1]=4 1216 B11R1.28 C=CCCOc1ccccn1 0ab523476c40cca7ddeb1371fcb5c049 [0,1,0,0,0,0|2,0,1]=4 1217 B11R1.28 C=CCCOc1cccnc1 7769faf927b2f71c466a04dbb21eb775 [0,1,0,0,0,0|2,0,1]=4 1218 B11R1.28 C=CCCOc1ccncc1 b78d3fbba4952f494971bea602c8b13f [0,1,0,0,0,0|2,0,1]=4 1219 B11R1.28 C=CCNCc1ccccc1 c3088ea78b0f7fe35bdb5a0a79f4eb2a [0,1,0,0,0,0|1,0,1]=3 1220 B11R1.28 C=CCNCc1ccccn1 e7bb58472b2cfc748af211be177c817f [0,1,0,0,0,0|2,0,1]=4 1221 B11R1.28 C=CCNCc1cccnc1 be26afa279edaf46ac71e1a8a3eef3c3 [0,1,0,0,0,0|2,0,1]=4 1222 B11R1.28 C=CCNCc1ccncc1 ad520e95b5ba55b21ba42b353a30e560 [0,1,0,0,0,0|2,0,1]=4 1223 B11R1.28 C=CCOCc1ccccc1 38f1b42f9627b73302287ed7d9c08f3f [0,1,0,0,0,0|1,0,1]=3 1224 B11R1.28 C=CCOCc1ccccn1 11821b5ce58a574dd3347fc8c16e0da7 [0,1,0,0,0,0|2,0,1]=4 1225 B11R1.28 C=CCOCc1cccnc1 92e03930f4ecbaf48abeac351fe5f708 [0,1,0,0,0,0|2,0,1]=4 1226 B11R1.28 C=CCOCc1ccncc1 9f235ca44ff01c70c75a5c467d3c2edc [0,1,0,0,0,0|2,0,1]=4 1227 B11R1.28 CC=CCNc1ccccc1 c43b41b8b675349badfe26c48e3f7c5f [0,1,0,0,0,0|1,0,1]=3 1228 B11R1.28 CC=CCNc1ccccn1 dff63d253924f7dd0d25e5ccec37e70c [0,1,0,0,0,0|2,0,1]=4 1229 B11R1.28 CC=CCNc1cccnc1 712a10215e7a39b6e923461fbfb9f854 [0,1,0,0,0,0|2,0,1]=4 1230 B11R1.28 CC=CCNc1ccncc1 0b02037bf9ae4c647d4431b3d00b040e [0,1,0,0,0,0|2,0,1]=4 1231 B11R1.28 CCCCNc1ccccc1 178647391839dfbe95aed182d7dc43ba [0,1,0,0,0,0|1,0,0]=2 1232 B11R1.28 CCCCNc1ccccn1 91c5e93b79177d6bf2e79f08485f5335 [0,1,0,0,0,0|2,0,0]=3 1233 B11R1.28 CCCCNc1cccnc1 b72453a6fd2f6ec63a951a849bd6d4ab [0,1,0,0,0,0|2,0,0]=3 1234 B11R1.28 CCCCNc1cccnn1 3dfd51777ba04f9375640c74ab9fa2e6 [0,1,0,0,0,0|3,0,0]=4 1235 B11R1.28 CCCCNc1ccncc1 24fb8abdae77c89030f13cd0949f55ff [0,1,0,0,0,0|2,0,0]=3 1236 B11R1.28 CCCCNc1ccncn1 285343aee96e8f045fe913fc70b195a9 [0,1,0,0,0,0|3,0,0]=4 1237 B11R1.28 CCCCNc1ccnnc1 ff8398fcae5d1b92f9ec3bc78a562cec [0,1,0,0,0,0|3,0,0]=4 1238 B11R1.28 CCCCNc1cnccn1 94ad2094a4d853e068f8fa7ebd18c7ff [0,1,0,0,0,0|3,0,0]=4 1239 B11R1.28 CCCCNc1cncnc1 5898f2b85902d6f8660c7182ee3b2170 [0,1,0,0,0,0|3,0,0]=4 1240 B11R1.28 CCCCNc1ncccn1 1c9a1ed7a4872dfade79e48decc1fc1d [0,1,0,0,0,0|3,0,0]=4 1241 B11R1.28 CCCCOc1ccccn1 6484ab4f70c598bfd74c056129d64bfe [0,1,0,0,0,0|2,0,0]=3 1242 B11R1.28 CCCCOc1cccnc1 5afbbe8f7376fe71bb9dd4caf03cbd91 [0,1,0,0,0,0|2,0,0]=3 1243 B11R1.28 CCCCOc1ccncc1 fc01d35869db11789e0b4af0f1677b1b [0,1,0,0,0,0|2,0,0]=3 1244 B11R1.28 CCCCOc1ccnnc1 667207acd2d82bae5786ac94d3b108de [0,1,0,0,0,0|3,0,0]=4 1245 B11R1.28 CCCCOc1cnccn1 74c5e85aaa9b94ec4e088971edd3244b [0,1,0,0,0,0|3,0,0]=4 1246 B11R1.28 CCCCOc1cncnc1 d754e073f477d30ef4fb9949b36048b9 [0,1,0,0,0,0|3,0,0]=4 1247 B11R1.28 CCCCOc1ncccn1 cea963446efaea4e45d8684cc469bd67 [0,1,0,0,0,0|3,0,0]=4 1248 B11R1.28 CCCNCc1ccccc1 6e74fa6187fccbc3617e9cc264b3e7aa [0,1,0,0,0,0|1,0,0]=2 1249 B11R1.28 CCCNCc1ccccn1 80119cb7f5f54b354b4e2a1110975477 [0,1,0,0,0,0|2,0,0]=3 1250 B11R1.28 CCCNCc1cccnc1 bc1eb1c5ec13776685acded27d44c636 [0,1,0,0,0,0|2,0,0]=3 1251 B11R1.28 CCCNCc1cccnn1 f9771734910ebcad90f8cb14178ca09d [0,1,0,0,0,0|3,0,0]=4 1252 B11R1.28 CCCNCc1ccncc1 a4e33f26d038f90cea08a211a6327f1b [0,1,0,0,0,0|2,0,0]=3 1253 B11R1.28 CCCNCc1ccncn1 4c6d605a0ccf50e124c7a439ea71cca1 [0,1,0,0,0,0|3,0,0]=4 1254 B11R1.28 CCCNCc1ccnnc1 f0dc052fccb98d09ed6a02caf7ad77f6 [0,1,0,0,0,0|3,0,0]=4 1255 B11R1.28 CCCNCc1cnccn1 c9890f6f5a4e09bed341b3daf3b2c549 [0,1,0,0,0,0|3,0,0]=4 1256 B11R1.28 CCCNCc1cncnc1 b63f5b77d0d35d3228827f3601ca0c32 [0,1,0,0,0,0|3,0,0]=4 1257 B11R1.28 CCCNCc1ncccn1 9d6cc7b3819df7e77a589192f2bf91c0 [0,1,0,0,0,0|3,0,0]=4 1258 B11R1.28 CCCOCc1ccccc1 112c1e14e862b8fbffa225764759b8ec [0,1,0,0,0,0|1,0,0]=2 1259 B11R1.28 CCCOCc1ccccn1 a2de9c7a7551b2ca6641b10a888e1203 [0,1,0,0,0,0|2,0,0]=3 1260 B11R1.28 CCCOCc1cccnc1 02843d33c5a54d2140670eb60a4dfb7b [0,1,0,0,0,0|2,0,0]=3 1261 B11R1.28 CCCOCc1cccnn1 b324e54ae74b0a57b2f9b766e3c0e490 [0,1,0,0,0,0|3,0,0]=4 1262 B11R1.28 CCCOCc1ccncc1 56ee45f2e5ce25d41ded46b7cfbb89b5 [0,1,0,0,0,0|2,0,0]=3 1263 B11R1.28 CCCOCc1ccncn1 c21e413653b185c946f470cd3c989a49 [0,1,0,0,0,0|3,0,0]=4 1264 B11R1.28 CCCOCc1ccnnc1 835d98ea225e99027be93ac65a9ecaeb [0,1,0,0,0,0|3,0,0]=4 1265 B11R1.28 CCCOCc1cnccn1 2f92d9f2b0d873450f90961d7406570a [0,1,0,0,0,0|3,0,0]=4 1266 B11R1.28 CCCOCc1cncnc1 62dd4b6cbce5110705e084fd1f6898a2 [0,1,0,0,0,0|3,0,0]=4 1267 B11R1.28 CCCOCc1ncccn1 aded070bc849868bd77e139f41cc86fb [0,1,0,0,0,0|3,0,0]=4 1268 B11R1.28 CCNCCc1ccccc1 a4bcdd097e726e04ab2794cdb42f5f71 [0,1,0,0,0,0|1,0,0]=2 1269 B11R1.28 CCNCCc1ccccn1 08ffb64a8c703d8e611cb4b81d73ea48 [0,1,0,0,0,0|2,0,0]=3 1270 B11R1.28 CCNCCc1cccnc1 4a3a0c73e4e732e57ab84a312bb6bfb2 [0,1,0,0,0,0|2,0,0]=3 1271 B11R1.28 CCNCCc1ccncc1 8e4e115f84a67e767e5e9ff1560cacbe [0,1,0,0,0,0|2,0,0]=3 1272 B11R1.28 CCNCCc1ccncn1 dba79812e975c4d64e5e25d258f9e6a6 [0,1,0,0,0,0|3,0,0]=4 1273 B11R1.28 CCNCCc1cnccn1 2497cab3d04dd1dac7aa9e87fb020630 [0,1,0,0,0,0|3,0,0]=4 1274 B11R1.28 CCNCCc1ncccn1 8878621879d60c35f5e690c8ce15ae29 [0,1,0,0,0,0|3,0,0]=4 1275 B11R1.28 CCOCCc1ccccc1 4c8fc52cc53157c0b0cd10959d18f86a [0,1,0,0,0,0|0,0,0]=1 1276 B11R1.28 CCOCCc1ccccn1 0d3553a98e2eb283c6e354f56bb7c09d [0,1,0,0,0,0|1,0,0]=2 1277 B11R1.28 CCOCCc1cccnc1 fde9743ce24696d5aa5aa82dfaaaf4a7 [0,1,0,0,0,0|1,0,0]=2 1278 B11R1.28 CCOCCc1ccncc1 630579b198392670c66e884689fb17ef [0,1,0,0,0,0|1,0,0]=2 1279 B11R1.28 CCOCCc1ccncn1 bedc028f31c05778aab48e9543338256 [0,1,0,0,0,0|2,0,0]=3 1280 B11R1.28 CCOCCc1cnccn1 df7cb588e7f62873ee34f1155b413714 [0,1,0,0,0,0|2,0,0]=3 1281 B11R1.28 CCOCCc1cncnc1 58c96cb82c933f213a2e027db9cf3e79 [0,1,0,0,0,0|2,0,0]=3 1282 B11R1.28 CCOCCc1ncccn1 3fe5ff61de16184188b5260ddcb372ea [0,1,0,0,0,0|2,0,0]=3 1283 B11R1.28 CCOCNc1ccccc1 00b4118c5fbc36d206f093517b5cafbb [0,1,0,0,0,0|1,0,0]=2 1284 B11R1.28 CCOCNc1ccccn1 ac3729b96ca810b5bc3bde9ed19bf9fa [0,1,0,0,0,0|2,0,0]=3 1285 B11R1.28 CCOCNc1cccnc1 d3b3fa022b30954b0290fed1cdafa77a [0,1,0,0,0,0|2,0,0]=3 1286 B11R1.28 CCOCNc1cccnn1 e45400654c951e5da57247b84fef5d3a [0,1,0,0,0,0|3,0,0]=4 1287 B11R1.28 CCOCNc1ccncc1 7b541819d70b7814c284336c668c77e2 [0,1,0,0,0,0|2,0,0]=3 1288 B11R1.28 CCOCNc1ccncn1 ac025a168367c6a81f61efd458de89aa [0,1,0,0,0,0|3,0,0]=4 1289 B11R1.28 CCOCNc1ccnnc1 77eca28557b85421ec2e4032cd9845cf [0,1,0,0,0,0|3,0,0]=4 1290 B11R1.28 CCOCNc1cnccn1 b10f54b02233d2aa203f7b5134c91fdb [0,1,0,0,0,0|3,0,0]=4 1291 B11R1.28 CCOCNc1ncccn1 fcb38bd4c27d2ec9bea1e232fffc4a03 [0,1,0,0,0,0|3,0,0]=4 1292 B11R1.28 CCOCOc1ccccn1 54f1e3cb35931cbfff15b357666888af [0,1,0,0,0,0|2,0,0]=3 1293 B11R1.28 CCOCOc1cccnc1 ead2fcc768ce8c5c30053e5139f1a3f8 [0,1,0,0,0,0|2,0,0]=3 1294 B11R1.28 CCOCOc1ccncc1 432375e2a4c080d14e68465c24c6befc [0,1,0,0,0,0|2,0,0]=3 1295 B11R1.28 CCOCOc1ccnnc1 9c3b42dea3291937c7dd6ed05d20c4eb [0,1,0,0,0,0|3,0,0]=4 1296 B11R1.28 CCOCOc1cnccn1 bec42aacd144c9dd6c28b79c769a9705 [0,1,0,0,0,0|3,0,0]=4 1297 B11R1.28 CCOCOc1ncccn1 6f3d977a126a9911e9141c2a752b2884 [0,1,0,0,0,0|3,0,0]=4 1298 B11R1.28 COCCNc1ccccc1 5ef0d3255ad59be77d905fd9c0e71e6d [0,1,0,0,0,0|0,0,0]=1 1299 B11R1.28 COCCNc1ccccn1 89ce959fbd9c09f77faba6fd797cd6ad [0,1,0,0,0,0|1,0,0]=2 1300 B11R1.28 COCCNc1cccnc1 3616fb0bfda365de01dc790c24f19ca2 [0,1,0,0,0,0|1,0,0]=2 1301 B11R1.28 COCCNc1cccnn1 8733c04e0a44ea8a7038e5961b1befad [0,1,0,0,0,0|2,0,0]=3 1302 B11R1.28 COCCNc1ccncc1 e86302258d425dce02b6a807adbdf19d [0,1,0,0,0,0|1,0,0]=2 1303 B11R1.28 COCCNc1ccncn1 c6d474a468adffcb122226924683c6d3 [0,1,0,0,0,0|2,0,0]=3 1304 B11R1.28 COCCNc1ccnnc1 1bbf538b4d0732b2c120fe5274cd6aef [0,1,0,0,0,0|2,0,0]=3 1305 B11R1.28 COCCNc1cnccn1 89a57d49972f4332836b38e03ec7c28e [0,1,0,0,0,0|2,0,0]=3 1306 B11R1.28 COCCNc1cncnc1 66c6015f6e476a413df88786e8354dd1 [0,1,0,0,0,0|2,0,0]=3 1307 B11R1.28 COCCNc1cncnn1 c62ae06f2077abe7018bf40c5b1f79b5 [0,1,0,0,0,0|3,0,0]=4 1308 B11R1.28 COCCNc1cnncn1 8bed46e58ba55a169732af2571e75622 [0,1,0,0,0,0|3,0,0]=4 1309 B11R1.28 COCCNc1ncccn1 7e1e5eb4cfa8afc12d90009e638d22ba [0,1,0,0,0,0|2,0,0]=3 1310 B11R1.28 COCCNc1nccnn1 e6e1e0e57193871e0c93f078772356d3 [0,1,0,0,0,0|3,0,0]=4 1311 B11R1.28 COCCNc1ncncn1 1be8f8af0900a208365cd0c489ff5002 [0,1,0,0,0,0|3,0,0]=4 1312 B11R1.28 COCCOc1ccccn1 c15a0f2a35a14a6120db222de8e43d40 [0,1,0,0,0,0|1,0,0]=2 1313 B11R1.28 COCCOc1cccnc1 7d9dde4ce0ac45ab046b208edae409a9 [0,1,0,0,0,0|1,0,0]=2 1314 B11R1.28 COCCOc1ccncc1 13c01b88dd4fec82579627c21ba6ed06 [0,1,0,0,0,0|1,0,0]=2 1315 B11R1.28 COCCOc1ccnnc1 46b9eeb7c8b1d34f63e2466ef172aac6 [0,1,0,0,0,0|2,0,0]=3 1316 B11R1.28 COCCOc1cnccn1 3195bf44c40b4cfe23cd964d6107e835 [0,1,0,0,0,0|2,0,0]=3 1317 B11R1.28 COCCOc1cncnc1 ae786cec5577f7bf04de6eb667a04ccd [0,1,0,0,0,0|2,0,0]=3 1318 B11R1.28 COCCOc1cncnn1 dac8db74ace88b84001640c23c976840 [0,1,0,0,0,0|3,0,0]=4 1319 B11R1.28 COCCOc1ncccn1 ecaf6dd7fa3225dcb21592e471186427 [0,1,0,0,0,0|2,0,0]=3 1320 B11R1.28 COCNCc1ccccc1 658bb4bb78d053244c07843f6f02f062 [0,1,0,0,0,0|0,0,0]=1 1321 B11R1.28 COCNCc1ccccn1 cb969ddff5a45a0c4df4b7717e547f81 [0,1,0,0,0,0|1,0,0]=2 1322 B11R1.28 COCNCc1cccnc1 35b8b6083a32f9db8795c63f618b2f12 [0,1,0,0,0,0|1,0,0]=2 1323 B11R1.28 COCNCc1cccnn1 9aaebdac9b44cb036a6c4efec8b145a8 [0,1,0,0,0,0|2,0,0]=3 1324 B11R1.28 COCNCc1ccncc1 3fb6af955e4c1e6a3044742c559cc5ae [0,1,0,0,0,0|1,0,0]=2 1325 B11R1.28 COCNCc1ccncn1 d1470f86349a91c3077428a64eeb245d [0,1,0,0,0,0|2,0,0]=3 1326 B11R1.28 COCNCc1ccnnc1 91ec9d828765b6f8e6a58cf0ac261f9e [0,1,0,0,0,0|2,0,0]=3 1327 B11R1.28 COCNCc1cnccn1 e7da00a079ae82f27242b20b43289b5a [0,1,0,0,0,0|2,0,0]=3 1328 B11R1.28 COCNCc1cncnc1 2058c0eb2ce28060d15b1139995c356c [0,1,0,0,0,0|2,0,0]=3 1329 B11R1.28 COCNCc1ncccn1 910dc37e487213f00ebe28f7f96b3dad [0,1,0,0,0,0|2,0,0]=3 1330 B11R1.28 COCOCc1ccccc1 33758b3ae4df68a136cb96076fbeb2ee [0,1,0,0,0,0|0,0,0]=1 1331 B11R1.28 COCOCc1ccccn1 c7e2d466f64f2796a0fb099c19cb65e2 [0,1,0,0,0,0|1,0,0]=2 1332 B11R1.28 COCOCc1cccnc1 f4d73442b3dd40c1495fadfe4fccda61 [0,1,0,0,0,0|1,0,0]=2 1333 B11R1.28 COCOCc1cccnn1 6a346636ce31dd66677c2c2e6f45b6aa [0,1,0,0,0,0|2,0,0]=3 1334 B11R1.28 COCOCc1ccncc1 99c1a2805ee24504fc8830c71e80abe6 [0,1,0,0,0,0|1,0,0]=2 1335 B11R1.28 COCOCc1ccncn1 5977780fcd5de8ad874d004f7b7d968c [0,1,0,0,0,0|2,0,0]=3 1336 B11R1.28 COCOCc1ccnnc1 77d76f507816c22b30a45f128ecf1e7f [0,1,0,0,0,0|2,0,0]=3 1337 B11R1.28 COCOCc1cnccn1 6fe649a8173b64bf80af621a9eaae369 [0,1,0,0,0,0|2,0,0]=3 1338 B11R1.28 COCOCc1cncnc1 046adf1d7971f7c3d0883ef4620b9160 [0,1,0,0,0,0|2,0,0]=3 1339 B11R1.28 COCOCc1ncccn1 0812a457fd84b7c7be763e51ebbce2d3 [0,1,0,0,0,0|2,0,0]=3 1340 B11R1.28 CSCCNc1ccccc1 f8eb965b60d0615781c928cdcd30bc15 [0,1,0,0,0,0|0,1,0]=2 1341 B11R1.28 CSCCNc1ccccn1 1ebdb7d56171ddc5a7c67867cc88039f [0,1,0,0,0,0|1,1,0]=3 1342 B11R1.28 CSCCNc1cccnc1 5c27e85010b1a349b69a05e89d2c3c43 [0,1,0,0,0,0|1,1,0]=3 1343 B11R1.28 CSCCNc1cccnn1 22d4fb47f31c865b2abde66f85f7bf43 [0,1,0,0,0,0|2,1,0]=4 1344 B11R1.28 CSCCNc1ccncc1 54710d8ef290046b70669623e9f1800b [0,1,0,0,0,0|1,1,0]=3 1345 B11R1.28 CSCCNc1ccncn1 f8b2e77946b95e128c5a8a125ef8b57b [0,1,0,0,0,0|2,1,0]=4 1346 B11R1.28 CSCCNc1ccnnc1 25be9993274eb444b38a4a39c5c1b9fe [0,1,0,0,0,0|2,1,0]=4 1347 B11R1.28 CSCCNc1cnccn1 9eb52a287cd8fa8fe36dcf6953bf6294 [0,1,0,0,0,0|2,1,0]=4 1348 B11R1.28 CSCCNc1cncnc1 79d61f01aea578b0b1eedf6355957cc9 [0,1,0,0,0,0|2,1,0]=4 1349 B11R1.28 CSCCNc1ncccn1 303e31e122c6b1f3f92f1d57b831f4b6 [0,1,0,0,0,0|2,1,0]=4 1350 B11R1.28 CSCCOc1ccccn1 8b8b6f4f12e2bd5052045e36f5e8d7b9 [0,1,0,0,0,0|1,1,0]=3 1351 B11R1.28 CSCCOc1cccnc1 035ac2b2fc138dfaa1d6bea025347e4a [0,1,0,0,0,0|1,1,0]=3 1352 B11R1.28 CSCCOc1ccncc1 bc39eaa4e5a78fcb3ef7ff94e955c20b [0,1,0,0,0,0|1,1,0]=3 1353 B11R1.28 CSCCOc1ccnnc1 9af9d7255a7d4e42ca44a6044e965862 [0,1,0,0,0,0|2,1,0]=4 1354 B11R1.28 CSCCOc1cnccn1 eddb2cab03b974e07a130b3afd541113 [0,1,0,0,0,0|2,1,0]=4 1355 B11R1.28 CSCCOc1cncnc1 9071e0a8edb3a1640e9121442e4e9518 [0,1,0,0,0,0|2,1,0]=4 1356 B11R1.28 CSCCOc1ncccn1 969e2fe1dd37951a51db8df424d75b02 [0,1,0,0,0,0|2,1,0]=4 1357 B11R1.28 CSCNCc1ccccc1 5b3aef5f0ecdedc4b2903ec980e5dc72 [0,1,0,0,0,0|0,1,0]=2 1358 B11R1.28 CSCNCc1ccccn1 2c467e079eb5903cc68e04796a70abe6 [0,1,0,0,0,0|1,1,0]=3 1359 B11R1.28 CSCNCc1cccnc1 3f297bb785f90b40b12fe1a85e9c71ce [0,1,0,0,0,0|1,1,0]=3 1360 B11R1.28 CSCNCc1cccnn1 38a48aae0f10e8a8a408eb551a279969 [0,1,0,0,0,0|2,1,0]=4 1361 B11R1.28 CSCNCc1ccncc1 f9e31be92d2ea3f9692e6bd87f906a5c [0,1,0,0,0,0|1,1,0]=3 1362 B11R1.28 CSCNCc1ccncn1 36701466f9b2ee3aeda97d3f152942e1 [0,1,0,0,0,0|2,1,0]=4 1363 B11R1.28 CSCNCc1ccnnc1 8d2b04cf6eb63860beabeb2b9faffca0 [0,1,0,0,0,0|2,1,0]=4 1364 B11R1.28 CSCNCc1cnccn1 b6d98476646f609643b9e079c1ea699d [0,1,0,0,0,0|2,1,0]=4 1365 B11R1.28 CSCNCc1cncnc1 f50e982b38f9ef3566ed2036e5763e44 [0,1,0,0,0,0|2,1,0]=4 1366 B11R1.28 CSCNCc1ncccn1 f3cad45c6ccc4f1897c8a82d57c8d736 [0,1,0,0,0,0|2,1,0]=4 1367 B11R1.28 CSCOCc1ccccc1 5941de554d8996d7d45b8f8eee2daf73 [0,1,0,0,0,0|0,1,0]=2 1368 B11R1.28 CSCOCc1ccccn1 15e9634e2b7543dc2be21ac6d26f304b [0,1,0,0,0,0|1,1,0]=3 1369 B11R1.28 CSCOCc1cccnc1 43f679691f8dba66a7e0f36103db118e [0,1,0,0,0,0|1,1,0]=3 1370 B11R1.28 CSCOCc1cccnn1 3db940d669fdd690980d19050429109a [0,1,0,0,0,0|2,1,0]=4 1371 B11R1.28 CSCOCc1ccncc1 11cf6b0bd99fe96e04f2abe6d07a06aa [0,1,0,0,0,0|1,1,0]=3 1372 B11R1.28 CSCOCc1ccncn1 bf53b930b7d63ac46198d267087bd835 [0,1,0,0,0,0|2,1,0]=4 1373 B11R1.28 CSCOCc1ccnnc1 1731e4372488d58cb4a78bf95efde4a0 [0,1,0,0,0,0|2,1,0]=4 1374 B11R1.28 CSCOCc1cnccn1 06296d91c838cce0a2774d80459318b9 [0,1,0,0,0,0|2,1,0]=4 1375 B11R1.28 CSCOCc1cncnc1 91764509fe31562f6d26f0b3d8f99221 [0,1,0,0,0,0|2,1,0]=4 1376 B11R1.28 CSCOCc1ncccn1 93cf7df7d12e72075e9aeff8278ad111 [0,1,0,0,0,0|2,1,0]=4 1377 B11R1.28 Cl/C=C/CNc1ccccc1 2c44d12ba68cdacdd9e9917c4f75a2d7 [0,1,0,0,0,0|2,0,1]=4 1378 B11R1.28 Cl/C=C\CNc1ccccc1 99831c517c8f2e8a372e55388ab37fa9 [0,1,0,0,0,0|2,0,1]=4 1379 B11R1.28 ClCCCNc1ccccc1 b7f587f82b83ca90917a5139ff536b22 [0,1,0,0,0,0|2,0,0]=3 1380 B11R1.28 ClCCCNc1ccccn1 8bdf4144e9a2a7a9c2cc08aafaf861f1 [0,1,0,0,0,0|3,0,0]=4 1381 B11R1.28 ClCCCNc1cccnc1 46d49c887f9c8f9ac001059b66aa76f9 [0,1,0,0,0,0|3,0,0]=4 1382 B11R1.28 ClCCCNc1ccncc1 970fb2252914a50a867c4051715341da [0,1,0,0,0,0|3,0,0]=4 1383 B11R1.28 FCCCNc1ccccc1 b3f41abfb84c10f658d04a58ad820f46 [0,1,0,0,0,0|2,0,0]=3 1384 B11R1.28 FCCCNc1ccccn1 565f4368802921f33e165ca06a4e0884 [0,1,0,0,0,0|3,0,0]=4 1385 B11R1.28 FCCCNc1cccnc1 bf0c678c727f753f2416107c8fb7c2aa [0,1,0,0,0,0|3,0,0]=4 1386 B11R1.28 FCCCNc1ccncc1 6a3cdf6587efe4480e7c908186350ce5 [0,1,0,0,0,0|3,0,0]=4 1387 B11R1.28 FCCCOc1ccccn1 cbed731556df3029ce519d57f9054d0b [0,1,0,0,0,0|3,0,0]=4 1388 B11R1.28 FCCCOc1cccnc1 c358cc6076a85c51e04e470481f11a56 [0,1,0,0,0,0|3,0,0]=4 1389 B11R1.28 FCCCOc1ccncc1 df30532896d176c22270c75c82382b5e [0,1,0,0,0,0|3,0,0]=4 1390 B11R1.28 FCCNCc1ccccc1 562ef8707f4288c2162274968d966312 [0,1,0,0,0,0|2,0,0]=3 1391 B11R1.28 FCCNCc1ccccn1 4b02ff9e4d9d7623f6691b060ab82228 [0,1,0,0,0,0|3,0,0]=4 1392 B11R1.28 FCCNCc1cccnc1 baa596bf0364075f3290f4a60a205b9b [0,1,0,0,0,0|3,0,0]=4 1393 B11R1.28 FCCNCc1ccncc1 50b686a8fc08fd5effeaeb333b2ed93d [0,1,0,0,0,0|3,0,0]=4 1394 B11R1.28 FCCOCc1ccccc1 d9b83bdc5263ec616987dc5988d5ee5b [0,1,0,0,0,0|2,0,0]=3 1395 B11R1.28 FCCOCc1ccccn1 eeb2239e9027d0ce3a24146b5979566a [0,1,0,0,0,0|3,0,0]=4 1396 B11R1.28 FCCOCc1cccnc1 e02a816ea65f063a58402293132849f2 [0,1,0,0,0,0|3,0,0]=4 1397 B11R1.28 FCCOCc1ccncc1 14445d664118b43034c3d85510da7389 [0,1,0,0,0,0|3,0,0]=4 1398 B11R1.28 FCNCCc1ccccc1 0081f6dcce701ffe77378524f92f490b [0,1,0,0,0,0|1,0,0]=2 1399 B11R1.28 FCNCCc1ccccn1 e15d9eaa28b96f67f0199ee7ab918bb8 [0,1,0,0,0,0|2,0,0]=3 1400 B11R1.28 FCNCCc1cccnc1 ca44ff0aa2770a7476d8fe29ab7de27f [0,1,0,0,0,0|2,0,0]=3 1401 B11R1.28 FCNCCc1ccncc1 534789a7dc9aa58bac25bdd251ebaa53 [0,1,0,0,0,0|2,0,0]=3 1402 B11R1.28 FCNCCc1ccncn1 71d87b99838316558ab41f74e7a6ad39 [0,1,0,0,0,0|3,0,0]=4 1403 B11R1.28 FCNCCc1cnccn1 a6fff95115e37691aedec5697188885d [0,1,0,0,0,0|3,0,0]=4 1404 B11R1.28 FCNCCc1ncccn1 d4c74a64550de3aecd897af5dda17e37 [0,1,0,0,0,0|3,0,0]=4 1405 B11R1.28 FCOCCc1ccccc1 f68582be9a805c98452f747e5a13d902 [0,1,0,0,0,0|0,0,0]=1 1406 B11R1.28 FCOCCc1ccccn1 a87eac3bbe6c96cceb2ad793702bad9f [0,1,0,0,0,0|1,0,0]=2 1407 B11R1.28 FCOCCc1cccnc1 95fb7ccc93ac5365251261a770f3e438 [0,1,0,0,0,0|1,0,0]=2 1408 B11R1.28 FCOCCc1ccncc1 6e5a2cb5c96fa3a2dd4f846c43af9a9a [0,1,0,0,0,0|1,0,0]=2 1409 B11R1.28 FCOCCc1ccncn1 42f65ea3fce13080ce28dc59f0361160 [0,1,0,0,0,0|2,0,0]=3 1410 B11R1.28 FCOCCc1cnccn1 b992c651bab7313204deb41b6e2eb885 [0,1,0,0,0,0|2,0,0]=3 1411 B11R1.28 FCOCCc1cncnc1 2fe7d2e827bd728741093e1440e71b30 [0,1,0,0,0,0|2,0,0]=3 1412 B11R1.28 FCOCCc1ncccn1 b64c0291aeb618931da15052e46cee6a [0,1,0,0,0,0|2,0,0]=3 1413 B11R1.28 ICCNCc1ccccc1 697ca1617b546014ae02b06ad2981d8a [0,1,0,0,0,0|2,0,0]=3 1414 B11R1.28 ICCNCc1ccccn1 33a419599dd52be8486dfb89562c6ffa [0,1,0,0,0,0|3,0,0]=4 1415 B11R1.28 ICCNCc1cccnc1 7ed4e3e46a4c12f8a4c531489f3ab39c [0,1,0,0,0,0|3,0,0]=4 1416 B11R1.28 N#CCCNc1ccccc1 11cc2433e70294ae10477f88fd0e31d0 [0,1,0,0,0,0|2,0,0]=3 1417 B11R1.28 N#CCCNc1ccccn1 9e13b9df3de22e2203631765bbe95860 [0,1,0,0,0,0|3,0,0]=4 1418 B11R1.28 N#CCCNc1cccnc1 1e4f0247aa286b4881fa8010d02a431f [0,1,0,0,0,0|3,0,0]=4 1419 B11R1.28 N#CCCNc1ccncc1 c61c3df5760677889da84225dea3f0ff [0,1,0,0,0,0|3,0,0]=4 1420 B11R1.28 N#CCCOc1ccccn1 bd7f580d381a306ac6216b8462276232 [0,1,0,0,0,0|3,0,0]=4 1421 B11R1.28 N#CCCOc1cccnc1 1dc0c0c73c96168d9f4eeed5e2274bb9 [0,1,0,0,0,0|3,0,0]=4 1422 B11R1.28 N#CCCOc1ccncc1 dc8687d62c15bde06adfae60d1f7c483 [0,1,0,0,0,0|3,0,0]=4 1423 B11R1.28 N#CCNCc1ccccc1 f23a3b4a1088925db39a0117b8e4d4c1 [0,1,0,0,0,0|2,0,0]=3 1424 B11R1.28 N#CCNCc1ccccn1 b05b586b32bb564b4dc4c2b5f1c2deb2 [0,1,0,0,0,0|3,0,0]=4 1425 B11R1.28 N#CCNCc1cccnc1 7a0aea235690da4baa75cb6725d4f197 [0,1,0,0,0,0|3,0,0]=4 1426 B11R1.28 N#CCNCc1ccncc1 79b0820e89e9a95eb99e7b7525dfd122 [0,1,0,0,0,0|3,0,0]=4 1427 B11R1.28 N#CCOCc1ccccc1 c6fb0c0fa9f97c70e5fbc997cccd1b4f [0,1,0,0,0,0|2,0,0]=3 1428 B11R1.28 N#CCOCc1ccccn1 a0088b244471bb1db944b031bb167833 [0,1,0,0,0,0|3,0,0]=4 1429 B11R1.28 N#CCOCc1cccnc1 b3dbf4398f9363b93659a5906cdd8669 [0,1,0,0,0,0|3,0,0]=4 1430 B11R1.28 N#CCOCc1ccncc1 de49fef888edd4915bd094d8ae7d06aa [0,1,0,0,0,0|3,0,0]=4 1431 B11R1.28 N#CNCCc1ccccc1 cc0f6fa18b1c1eb0550ef90401294e13 [0,1,0,0,0,0|1,0,1]=3 1432 B11R1.28 N#CNCCc1ccccn1 6a52f53dd6b8c94fd37432a5813238ef [0,1,0,0,0,0|2,0,1]=4 1433 B11R1.28 N#CNCCc1cccnc1 f0c5d03a6f657080b74ba5a11f7b4a9a [0,1,0,0,0,0|2,0,1]=4 1434 B11R1.28 N#CNCCc1ccncc1 45214e3075259d9d556e019a6c6cd68b [0,1,0,0,0,0|2,0,1]=4 1435 B11R1.28 NOCCNc1ccccc1 6c5b7062e9d75a57daf03317347aff96 [0,1,0,0,0,0|1,0,0]=2 1436 B11R1.28 NOCCNc1ccccn1 e682b49988380a8ee2db570ecbf6f017 [0,1,0,0,0,0|2,0,0]=3 1437 B11R1.28 NOCCNc1cccnc1 5721f45685d149370a94b93edd914a85 [0,1,0,0,0,0|2,0,0]=3 1438 B11R1.28 NOCCNc1cccnn1 bf9d9972d6e75e9141266ca2d4358a63 [0,1,0,0,0,0|3,0,0]=4 1439 B11R1.28 NOCCNc1ccncc1 dbc7f0b0ff4b2266b3814bdc52c6fe58 [0,1,0,0,0,0|2,0,0]=3 1440 B11R1.28 NOCCNc1ccncn1 150a0aeb6f4a3b1f9ad7ed40ae2fddea [0,1,0,0,0,0|3,0,0]=4 1441 B11R1.28 NOCCNc1ccnnc1 12d79462c3db44e63ae64f7a6aa377ef [0,1,0,0,0,0|3,0,0]=4 1442 B11R1.28 NOCCNc1cnccn1 bb456b35dd039c8fd0aa232b7f0c9c37 [0,1,0,0,0,0|3,0,0]=4 1443 B11R1.28 NOCCNc1ncccn1 848cae5d0065999fbbfea31d92521fb0 [0,1,0,0,0,0|3,0,0]=4 1444 B11R1.28 O/C=C\CNc1ccccc1 8e43d75b756e053c042884ec195cf7a7 [0,1,0,0,0,0|2,0,1]=4 1445 B11R1.28 O=CCCNc1ccccc1 5adfd28b693cf17e4441c0e8b873a1f0 [0,1,0,0,0,0|2,0,0]=3 1446 B11R1.28 O=CCCNc1ccccn1 a0dc64366680f7288fe7bdf7cc671acd [0,1,0,0,0,0|3,0,0]=4 1447 B11R1.28 O=CCCNc1cccnc1 a3473d91dffc2b66146c1b6c0418e707 [0,1,0,0,0,0|3,0,0]=4 1448 B11R1.28 O=CCCNc1ccncc1 4706f2b70c0aff88cc0791a4ee67b10e [0,1,0,0,0,0|3,0,0]=4 1449 B11R1.28 O=CCCOc1ccccn1 a44954cc28e77e68c48d11a6e381d2ee [0,1,0,0,0,0|3,0,0]=4 1450 B11R1.28 O=CCCOc1cccnc1 64cc5400112f41984e6db154e0d162bd [0,1,0,0,0,0|3,0,0]=4 1451 B11R1.28 O=CCCOc1ccncc1 200185df0538b49d2032c68006d26175 [0,1,0,0,0,0|3,0,0]=4 1452 B11R1.28 O=CCNCc1ccccc1 2b4b8121ff6ad050b40b87d13d8f5a1a [0,1,0,0,0,0|2,0,0]=3 1453 B11R1.28 O=CCNCc1ccccn1 e205fc2dfe1b7f5a0d5f0647f95b66cb [0,1,0,0,0,0|3,0,0]=4 1454 B11R1.28 O=CCNCc1cccnc1 71156a498cf22bdb96a0af181206c6a0 [0,1,0,0,0,0|3,0,0]=4 1455 B11R1.28 O=CCNCc1ccncc1 9810920521153204a9758a4f25736f12 [0,1,0,0,0,0|3,0,0]=4 1456 B11R1.28 O=CCOCc1ccccc1 7bd4c1ac5902422e7c3cafad9115c4f2 [0,1,0,0,0,0|2,0,0]=3 1457 B11R1.28 O=CCOCc1ccccn1 a6f535e6c372012997e3b2297923fbfc [0,1,0,0,0,0|3,0,0]=4 1458 B11R1.28 O=CCOCc1cccnc1 1483cff9cc1509b24b62f7b70d468a72 [0,1,0,0,0,0|3,0,0]=4 1459 B11R1.28 O=CCOCc1ccncc1 c2ef5d9ef1d6347a7cd0814cdf9f79a1 [0,1,0,0,0,0|3,0,0]=4 1460 B11R1.28 O=CNCCc1ccccc1 d1fab3f35b45ae0bc45cf7bf9f19384c [0,1,0,0,0,0|1,0,1]=3 1461 B11R1.28 O=CNCCc1ccccn1 36fb465b4a699ed2860619296ed044a4 [0,1,0,0,0,0|2,0,1]=4 1462 B11R1.28 O=CNCCc1cccnc1 5111296cce1960f11ad77b3eaf87d913 [0,1,0,0,0,0|2,0,1]=4 1463 B11R1.28 O=CNCCc1ccncc1 5e83eff0a4bbf0070c01463bdeac3941 [0,1,0,0,0,0|2,0,1]=4 1464 B11R1.28 OCCCNc1ccccc1 6f65c15387fc952c20110ea29ef53956 [0,1,0,0,0,0|2,0,0]=3 1465 B11R1.28 OCCCNc1ccccn1 587693fe3960ae4ed00c51618661aeab [0,1,0,0,0,0|3,0,0]=4 1466 B11R1.28 OCCCNc1cccnc1 90b07b63ba2da4339e6031d93f7df208 [0,1,0,0,0,0|3,0,0]=4 1467 B11R1.28 OCCCNc1ccncc1 7676a46d9ab85382fda372d12f0ec436 [0,1,0,0,0,0|3,0,0]=4 1468 B11R1.28 OCCNCc1ccccc1 6075728aab81556d5096d2980e4afa2d [0,1,0,0,0,0|2,0,0]=3 1469 B11R1.28 OCCNCc1ccccn1 aee8d8851b64ae441b47dd7c19255c9b [0,1,0,0,0,0|3,0,0]=4 1470 B11R1.28 OCCNCc1cccnc1 882a81680203d781920d7144e525a6cd [0,1,0,0,0,0|3,0,0]=4 1471 B11R1.28 OCCNCc1ccncc1 9ecc8a72acff6784c82756ff768b065d [0,1,0,0,0,0|3,0,0]=4 1472 B11R1.28 OCNCCc1ccccc1 dba1af705064b03a49f56a10af922b9a [0,1,0,0,0,0|1,0,0]=2 1473 B11R1.28 OCNCCc1ccccn1 870a6b93d6f817d2b7b76ee4a753e49e [0,1,0,0,0,0|2,0,0]=3 1474 B11R1.28 OCNCCc1cccnc1 5a238842d821729331c809bafe95118a [0,1,0,0,0,0|2,0,0]=3 1475 B11R1.28 OCNCCc1ccncc1 d4fdef2a16a1c89c93b39a7d349558eb [0,1,0,0,0,0|2,0,0]=3 1476 B11R1.28 OCNCCc1ccncn1 6744261abdd24d42c96fea72d14f993a [0,1,0,0,0,0|3,0,0]=4 1477 B11R1.28 OCNCCc1cnccn1 f4950c420442047f83981ab203d27aa5 [0,1,0,0,0,0|3,0,0]=4 1478 B11R1.28 OCNCCc1ncccn1 ef945efe9c2fffc4c52fc2c7c7ec1101 [0,1,0,0,0,0|3,0,0]=4 1479 B11R1.28 SCCCNc1ccccc1 0ed9842b503e3cd70fca4624b001f5d8 [0,1,0,0,0,0|2,0,0]=3 1480 B11R1.28 SCCCNc1ccccn1 6e9255137fb1e7130c483b51e209e603 [0,1,0,0,0,0|3,0,0]=4 1481 B11R1.28 SCCCNc1cccnc1 9d7b88e69ec7c6b34ca7771b6e0b91e4 [0,1,0,0,0,0|3,0,0]=4 1482 B11R1.28 SCCCNc1ccncc1 ca21b760b7ec316b64d15f3538d2549c [0,1,0,0,0,0|3,0,0]=4 1483 B11R1.28 SCCCOc1ccccn1 a6c411fcae0c9e021a422469b3fdfe87 [0,1,0,0,0,0|3,0,0]=4 1484 B11R1.28 SCCCOc1cccnc1 134743f8f7a869616fe16d61afd2d0e6 [0,1,0,0,0,0|3,0,0]=4 1485 B11R1.28 SCCCOc1ccncc1 e86746acf63686675a8e18fe26221a62 [0,1,0,0,0,0|3,0,0]=4 1486 B11R1.28 SCCNCc1ccccc1 842b711568e585283783756ca8279842 [0,1,0,0,0,0|2,0,0]=3 1487 B11R1.28 SCCNCc1ccccn1 ace948b27200a431fbd41a7ba53deb87 [0,1,0,0,0,0|3,0,0]=4 1488 B11R1.28 SCCNCc1cccnc1 8ab6cc5726329dc3b917c71b0e8e3a12 [0,1,0,0,0,0|3,0,0]=4 1489 B11R1.28 SCCNCc1ccncc1 3b6ef2e293d7e6f2b9cd175d9cbecd46 [0,1,0,0,0,0|3,0,0]=4 1490 B11R1.28 SCCOCc1ccccc1 ef1d3bfcf77b316513e3e84b7d85c143 [0,1,0,0,0,0|2,0,0]=3 1491 B11R1.28 SCCOCc1ccccn1 922bd68bb819886f081031e9f73951e2 [0,1,0,0,0,0|3,0,0]=4 1492 B11R1.28 SCCOCc1cccnc1 c1c52e309e8814a28fb8d713bda79484 [0,1,0,0,0,0|3,0,0]=4 1493 B11R1.28 SCCOCc1ccncc1 5a71ae8d634b1ad8f983b65a8abfb1e3 [0,1,0,0,0,0|3,0,0]=4 1494 B11R1.40 C=CC(C)Nc1ccccc1 11c4f91eafeb8b3d7c22c97a0ea92d57 [0,1,0,0,0,0|2,0,1]=4 1495 B11R1.40 CC(C=O)Nc1ccccc1 0d04ec44ee6fe8b8d4f3d71cd15333ba [0,1,0,0,0,0|3,0,0]=4 1496 B11R1.40 CC(CO)Nc1ccccc1 28944821b2a2502f940043c73e5bee97 [0,1,0,0,0,0|3,0,0]=4 1497 B11R1.40 CCC(C)Nc1ccccc1 0d73dedeab1dd8f5149c3124f0b802dc [0,1,0,0,0,0|2,0,0]=3 1498 B11R1.40 CCC(C)Nc1ccccn1 bb895d27f1d9ed94ab4cd5f93b01f0bd [0,1,0,0,0,0|3,0,0]=4 1499 B11R1.40 CCC(C)Nc1cccnc1 a0e745f4d44915557790daf72381f523 [0,1,0,0,0,0|3,0,0]=4 1500 B11R1.40 CCC(C)Nc1ccncc1 8150e11adca204128a3ae62428597250 [0,1,0,0,0,0|3,0,0]=4 1501 B11R1.40 CCC(C)Oc1ccccn1 b8b4a806c6af90298cf0d1454fda0647 [0,1,0,0,0,0|3,0,0]=4 1502 B11R1.40 CCC(C)Oc1cccnc1 ea8ea3a935f9f1da0dc64162c872e010 [0,1,0,0,0,0|3,0,0]=4 1503 B11R1.40 CCC(C)Oc1ccncc1 0e7c13edf9ed6b6addf466a3a8481e15 [0,1,0,0,0,0|3,0,0]=4 1504 B11R1.40 CCN(C)Cc1ccccc1 c214a7b7c23665abe56278baaf98348b [0,1,0,0,0,0|2,0,0]=3 1505 B11R1.40 CCN(C)Cc1ccccn1 e347cf6623c9ce49a1c94570b5d3844c [0,1,0,0,0,0|3,0,0]=4 1506 B11R1.40 CCN(C)Cc1cccnc1 69e9bc72fe902e2c097b1bc797c43254 [0,1,0,0,0,0|3,0,0]=4 1507 B11R1.40 CCN(C)Cc1ccncc1 ebfb44d53a95f23536771c3c1b41adfd [0,1,0,0,0,0|3,0,0]=4 1508 B11R1.40 CC[C@@H](C)Nc1ccccc1 405a065880ecff40d5c3aba49f23a60f [0,1,0,0,0,0|2,0,0]=3 1509 B11R1.40 CC[C@@H](C)Nc1cccnc1 d5c354fec9aa4824593a6aa370b31f97 [0,1,0,0,0,0|3,0,0]=4 1510 B11R1.40 CC[C@H](C)Nc1ccccc1 bdf0fca4eb541010d4b75cf2b0618571 [0,1,0,0,0,0|2,0,0]=3 1511 B11R1.40 CC[C@H](C)Nc1cccnc1 a188aeb369243191dc243d4fb98ce075 [0,1,0,0,0,0|3,0,0]=4 1512 B11R1.40 CN(C=O)Cc1ccccc1 701ed8237afa851586621908f176512f [0,1,0,0,0,0|3,0,0]=4 1513 B11R1.40 CN(CF)Cc1ccccc1 5e57d186c6f316353ffa6c809cb61d75 [0,1,0,0,0,0|3,0,0]=4 1514 B11R1.40 CN(CO)Cc1ccccc1 c1d08d2d2c7de731954ebcb428d333e2 [0,1,0,0,0,0|3,0,0]=4 1515 B11R1.40 C[C@@H](CO)Nc1ccccc1 d1a979ebd31c8c47073ae387eaa9c5f8 [0,1,0,0,0,0|3,0,0]=4 1516 B11R1.40 C[C@H](C=O)Nc1ccccc1 10a4433daba67da13987d6e7cd5b7f0f [0,1,0,0,0,0|3,0,0]=4 1517 B11R1.40 C[C@H](CO)Nc1ccccc1 b7592eed2c2b10dda06f47547223c567 [0,1,0,0,0,0|3,0,0]=4 1518 B11R1.91 C=C(Br)CNc1ccccc1 93ec6105ca168468e9c8838717ff6b1e [0,1,0,0,0,0|2,0,1]=4 1519 B11R1.91 C=C(C)CNc1ccccc1 9ff030153dc2dcaf07d1da3f9e6a073f [0,1,0,0,0,0|2,0,0]=3 1520 B11R1.91 C=C(C)CNc1ccccn1 296f6d3c9e71203263ef4c60889651d0 [0,1,0,0,0,0|3,0,0]=4 1521 B11R1.91 C=C(C)CNc1cccnc1 8810dec0d1b93ae6f2f50fc532118fa0 [0,1,0,0,0,0|3,0,0]=4 1522 B11R1.91 C=C(C)CNc1ccncc1 7fd564b3611fb48098820a623411bd04 [0,1,0,0,0,0|3,0,0]=4 1523 B11R1.91 C=C(C)COc1ccccn1 53d55f6223fd317f454a145f4adf39b2 [0,1,0,0,0,0|3,0,0]=4 1524 B11R1.91 C=C(C)COc1cccnc1 3cac933caa917577843fc86e5c520fd6 [0,1,0,0,0,0|3,0,0]=4 1525 B11R1.91 C=C(C)COc1ccncc1 5c56bc0d616e9eba4b34abaa7d463cec [0,1,0,0,0,0|3,0,0]=4 1526 B11R1.91 C=C(Cl)CNc1ccccc1 e3c53739f614fbc554b5ed591e111126 [0,1,0,0,0,0|2,0,1]=4 1527 B11R1.91 C=C(F)CNc1ccccc1 aea10c9376159512fe2427e907c2a329 [0,1,0,0,0,0|2,0,1]=4 1528 B11R1.91 CC(=O)CNc1ccccc1 71a2fb3da6b0e889c13cfd81e73bd182 [0,1,0,0,0,0|2,0,0]=3 1529 B11R1.91 CC(=O)CNc1ccccn1 9ef5867d6e28a360f3e560522ae4c545 [0,1,0,0,0,0|3,0,0]=4 1530 B11R1.91 CC(=O)CNc1cccnc1 35a6037a85b015cc869f557087769b5d [0,1,0,0,0,0|3,0,0]=4 1531 B11R1.91 CC(=O)CNc1ccncc1 e7e1df2bfec9194a79bb5918ba94764c [0,1,0,0,0,0|3,0,0]=4 1532 B11R1.91 CC(=O)NCc1ccccc1 29a87354e4243d3817f046f8152f971d [0,1,0,0,0,0|2,0,0]=3 1533 B11R1.91 CC(=O)NCc1ccccn1 4a5e0ad0f6fb64ba7eb4726872bef1d0 [0,1,0,0,0,0|3,0,0]=4 1534 B11R1.91 CC(=O)NCc1cccnc1 7b71a51c058bd0c2c3114d8b61c7e1f0 [0,1,0,0,0,0|3,0,0]=4 1535 B11R1.91 CC(=O)NCc1ccncc1 9156811b92bf0707f7382e576ceea554 [0,1,0,0,0,0|3,0,0]=4 1536 B11R1.91 CC(C)CNc1ccccc1 408d8a64ab70f9eca096d81d546b6049 [0,1,0,0,0,0|2,0,0]=3 1537 B11R1.91 CC(C)CNc1ccccn1 7b009ca04377ecc13f70ec3cf4ebfeda [0,1,0,0,0,0|3,0,0]=4 1538 B11R1.91 CC(C)CNc1cccnc1 872c17275baf8dfc3e3fcfc1c6e8b0aa [0,1,0,0,0,0|3,0,0]=4 1539 B11R1.91 CC(C)CNc1ccncc1 25b00c7dc1cdd402497940b3c77292de [0,1,0,0,0,0|3,0,0]=4 1540 B11R1.91 CC(C)COc1ccccn1 7b0823f232ca75667ab72b773cf2055c [0,1,0,0,0,0|3,0,0]=4 1541 B11R1.91 CC(C)COc1cccnc1 639764ab0bac28311f80a0c1092bb51e [0,1,0,0,0,0|3,0,0]=4 1542 B11R1.91 CC(C)COc1ccncc1 f219312091f37b23472c98e305cf03a6 [0,1,0,0,0,0|3,0,0]=4 1543 B11R1.91 CC(C)NCc1ccccc1 60272e3c9303882f29d21331dcab1491 [0,1,0,0,0,0|2,0,0]=3 1544 B11R1.91 CC(C)NCc1ccccn1 856545f5d02de0038284fed0716bf52b [0,1,0,0,0,0|3,0,0]=4 1545 B11R1.91 CC(C)NCc1cccnc1 f83c1668bc1a0795e6062eecd9dab4fd [0,1,0,0,0,0|3,0,0]=4 1546 B11R1.91 CC(C)NCc1ccncc1 6f1dfa66543bb67ac78a3a333bf46a66 [0,1,0,0,0,0|3,0,0]=4 1547 B11R1.91 CC(C)OCc1ccccc1 7aa508df1117d05227b589ad5630d192 [0,1,0,0,0,0|2,0,0]=3 1548 B11R1.91 CC(C)OCc1ccccn1 0763eb944dcd10bf40a6049a3281f0fa [0,1,0,0,0,0|3,0,0]=4 1549 B11R1.91 CC(C)OCc1cccnc1 15bee2bbdfea4851383d51503cc56958 [0,1,0,0,0,0|3,0,0]=4 1550 B11R1.91 CC(C)OCc1ccncc1 6b799cfffcfa8445d7523666b8d1a250 [0,1,0,0,0,0|3,0,0]=4 1551 B11R1.91 CC(O)CNc1ccccc1 bad1b8ce4c3d0d43f36328d30e7f1e89 [0,1,0,0,0,0|2,0,0]=3 1552 B11R1.91 CC(O)CNc1ccccn1 0b02a9fc805d3fdc80aa58b252d76fac [0,1,0,0,0,0|3,0,0]=4 1553 B11R1.91 CC(O)CNc1cccnc1 be948b4ea22210c06fa11f5ff0c44d9b [0,1,0,0,0,0|3,0,0]=4 1554 B11R1.91 CC(O)CNc1ccncc1 58a36af31ee3d9178a47f4e2f681d20e [0,1,0,0,0,0|3,0,0]=4 1555 B11R1.91 CN(C)CNc1ccccc1 6ea2b21a530eb73fceed274bf1825a42 [0,1,0,0,0,0|2,0,0]=3 1556 B11R1.91 CN(C)CNc1ccccn1 7dd3487cd8d87b9dce82d3b1e66d4dfe [0,1,0,0,0,0|3,0,0]=4 1557 B11R1.91 CN(C)CNc1cccnc1 06dc729fa11ea9023ada541fc670b33d [0,1,0,0,0,0|3,0,0]=4 1558 B11R1.91 CN(C)CNc1ccncc1 06f2faf99e2f9062dfe4af47bfbbee1d [0,1,0,0,0,0|3,0,0]=4 1559 B11R1.91 CN(C)COc1ccccn1 0d00edbce2a52e0b3d43150d9124361f [0,1,0,0,0,0|3,0,0]=4 1560 B11R1.91 CN(C)COc1cccnc1 ba3cfa03500b005052d6345515b92103 [0,1,0,0,0,0|3,0,0]=4 1561 B11R1.91 CN(C)COc1ccncc1 24dcd02da3008257944139a724552f1d [0,1,0,0,0,0|3,0,0]=4 1562 B11R1.91 C[C@@H](O)CNc1ccccc1 3364bd989574177eabc4c47575206f02 [0,1,0,0,0,0|2,0,0]=3 1563 B11R1.91 C[C@@H](O)CNc1ccccn1 2f50c5c35f8b03d00f3a417683f2e1c8 [0,1,0,0,0,0|3,0,0]=4 1564 B11R1.91 C[C@@H](O)CNc1cccnc1 0269da8e8da5f2bc75323d1a7b31953c [0,1,0,0,0,0|3,0,0]=4 1565 B11R1.91 C[C@@H](O)CNc1ccncc1 a759ad58b644a21887782ccec01db51a [0,1,0,0,0,0|3,0,0]=4 1566 B11R1.91 C[C@H](O)CNc1ccccc1 72a253baaf381f6699a10e01b0f0ab34 [0,1,0,0,0,0|2,0,0]=3 1567 B11R1.91 C[C@H](O)CNc1ccccn1 b5e1e178b39afd2578578a870577034a [0,1,0,0,0,0|3,0,0]=4 1568 B11R1.91 C[C@H](O)CNc1cccnc1 13f963f21a32ff7cb405ad7d76f40567 [0,1,0,0,0,0|3,0,0]=4 1569 B11R1.91 C[C@H](O)CNc1ccncc1 40e1cfcf68d3fb31f8ea23f4fe31cf2f [0,1,0,0,0,0|3,0,0]=4 1570 B11R1.91 FC(F)CNc1ccccc1 84c83ea792636e350c2a00840c340dda [0,1,0,0,0,0|3,0,0]=4 1571 B11R1.91 NC(=O)CNc1ccccc1 cb8f4e233e85228cf5430aee72130ae8 [0,1,0,0,0,0|3,0,0]=4 1572 B11R1.91 O=C(O)CNc1ccccc1 aa02152e084051d6acb84b2b7ca3be40 [0,1,0,0,0,0|3,0,0]=4 1573 B11R1.91 O=[N+]([O-])CNc1ccccc1 ee2373fe0eba3d741763c77ec19667e3 [0,1,0,0,0,0|3,0,0]=4 1574 B9R0.18 C=C/C=C/C(=O)NCCC cdb1993c899e293034914219ee12d2cc [0,0,1,0,0,0|3,0,0]=4 1575 B9R0.18 C=C/C=C\C(=O)NCCC c0156ffebe98b66f4e26bb3d1670da8c [0,0,1,0,0,0|3,0,0]=4 1576 B9R0.18 C=CC=CC(=O)NCCC 4ac7d936250849aaf88bec9640f41d33 [0,0,1,0,0,0|3,0,0]=4 1577 B9R0.40 C=CCC(C=C)OCOC 10f5f90384381b9bd3e9bb94c7fa7d32 [0,0,1,0,0,0|1,0,2]=4 1578 B9R0.45 C/C=C/C=C/COCOC 5c2dc9c79dbd8663009901e5c7a8b64e [0,0,1,0,0,0|1,0,2]=4 1579 B9R0.45 C=C/C=C/CCNCOC 4ad5ef978d058dd489935fa5cd5121e5 [0,0,1,0,0,0|1,0,2]=4 1580 B9R0.45 CC=CC=CCOCOC 2596b7da8bf6acd45fbe82fe6390dd54 [0,0,1,0,0,0|1,0,2]=4 1581 B9R0.45 COCCOC/C=C/C=O 967f18e0ff39d9ac3e3f1923f75f6062 [0,0,1,0,0,0|2,0,1]=4 1582 B11R2.238 c1cc(ccn1)NC2CC2 5ad70d53c8f8554348b48da331d79b17 [0,0,0,1,0,0|3,0,0]=4 1583 B11R2.238 c1ccc(cc1)NC2CC2 0cca6617983212a2989086e88698db73 [0,0,0,1,0,0|2,0,0]=3 1584 B11R2.238 c1ccc(nc1)OC2CC2 05f70841461656fba19d4e6cae35b4c4 [0,0,0,1,0,0|3,0,0]=4 1585 B11R2.238 c1cncc(c1)NC2CC2 faca6d2d50c0b4a3e50cda13d58850cf [0,0,0,1,0,0|3,0,0]=4 1586 B11R2.238 c1cncc(c1)OC2CC2 e02f03b072be3d2fd90f9a4a8c487a8f [0,0,0,1,0,0|3,0,0]=4 1587 B9R1.12 CCCNc1cccs1 dddbeb0cebfad93e2ee450a927f1f846 [0,0,0,0,1,0|3,0,0]=4 1588 B9R1.12 CCCNc1ccoc1 cc4f6f51569c182aca4da58e5f019c78 [0,0,0,0,1,0|3,0,0]=4 1589 B9R1.12 CCCNc1ccsc1 a70237f11ed81d43b5ff787e5b6c83f9 [0,0,0,0,1,0|3,0,0]=4 1590 B9R1.12 CCCOc1ccco1 892ad9a1c4eda1b2e579e57ab16386c6 [0,0,0,0,1,0|3,0,0]=4 1591 B9R1.12 CCCOc1cccs1 08634ab81341ae1b1178430949f9ac0f [0,0,0,0,1,0|3,0,0]=4 1592 B9R1.12 CCCOc1ccsc1 09284982954b71ce4e3ef57411744ecc [0,0,0,0,1,0|3,0,0]=4 1593 B9R1.12 CCNCc1cc[nH]c1 5f34bb16d580f8126d210a7f1c922122 [0,0,0,0,1,0|3,0,0]=4 1594 B9R1.12 CCNCc1ccc[nH]1 d148947c496d04ba3fda3d28b4738aad [0,0,0,0,1,0|3,0,0]=4 1595 B9R1.12 CCNCc1ccco1 4817cc97570de733e3d59f88500c3b37 [0,0,0,0,1,0|3,0,0]=4 1596 B9R1.12 CCNCc1cccs1 4bb993aa1ef7b62c5d2b7781bf586f7d [0,0,0,0,1,0|3,0,0]=4 1597 B9R1.12 CCNCc1ccoc1 790b339bd93664fda272fb5f895d2be9 [0,0,0,0,1,0|3,0,0]=4 1598 B9R1.12 CCNCc1ccsc1 8d2a00279cff0e97c4d4139ed8f7ead4 [0,0,0,0,1,0|3,0,0]=4 1599 B9R1.12 CCOCc1cc[nH]c1 59d617c736c503e8fe59f893e6c21bac [0,0,0,0,1,0|3,0,0]=4 1600 B9R1.12 CCOCc1ccc[nH]1 0b5c52ca398d6e6823ab9d1f4fb92621 [0,0,0,0,1,0|3,0,0]=4 1601 B9R1.12 CCOCc1ccco1 e774f039f2ee21ec2e9d047bdeb979aa [0,0,0,0,1,0|3,0,0]=4 1602 B9R1.12 CCOCc1cccs1 8766881c6db57c6784fc6c93385667d4 [0,0,0,0,1,0|3,0,0]=4 1603 B9R1.12 CCOCc1ccsc1 386d4e7246ff291707b3e218c5edbe51 [0,0,0,0,1,0|3,0,0]=4 1604 B9R1.12 COCCN1CC=CC1 093d4d897c468c60d6ad4ebee967ea47 [0,0,0,0,1,0|1,0,2]=4 1605 B9R1.12 COCNc1cc[nH]n1 b47457f2c12b45103e8aedafe7c92ddb [0,0,0,0,1,0|3,0,0]=4 1606 B9R1.12 COCNc1cccs1 a445fc20137d5de04e37049f9b7acf2c [0,0,0,0,1,0|2,0,0]=3 1607 B9R1.12 COCNc1ccno1 d755508b800677986f100d0e5f1274a2 [0,0,0,0,1,0|3,0,0]=4 1608 B9R1.12 COCNc1ccns1 74bd416b6da6dbc80fd170afd43b9bf9 [0,0,0,0,1,0|3,0,0]=4 1609 B9R1.12 COCNc1ccon1 5b9e5a5c367d444b35c135d5299eaa97 [0,0,0,0,1,0|3,0,0]=4 1610 B9R1.12 COCNc1ccsc1 b1f054b12d453203e8f9a03a0c803158 [0,0,0,0,1,0|2,0,0]=3 1611 B9R1.12 COCNc1cn[nH]c1 5f7f6e8068634f3f4548f33681ef2f1a [0,0,0,0,1,0|3,0,0]=4 1612 B9R1.12 COCNc1cncs1 d8aa9030b888e2ce0dd175cd8386e218 [0,0,0,0,1,0|3,0,0]=4 1613 B9R1.12 COCNc1cnoc1 1c0e5d3d00b585620b1b3a85394afa63 [0,0,0,0,1,0|3,0,0]=4 1614 B9R1.12 COCNc1cnsc1 f7da1f332354abfe9e421d8cd30795e3 [0,0,0,0,1,0|3,0,0]=4 1615 B9R1.12 COCNc1cocn1 4d48960ad634ba6e5d27e7c4f7d64a79 [0,0,0,0,1,0|3,0,0]=4 1616 B9R1.12 COCNc1cscn1 57d9af23d0960816e9f0917fc1df0f86 [0,0,0,0,1,0|3,0,0]=4 1617 B9R1.12 COCNc1ncc[nH]1 40f6f94346f0489624dbd120791daf0f [0,0,0,0,1,0|3,0,0]=4 1618 B9R1.12 COCNc1ncco1 ef48d84ae70ad4ac2e098cff7a885ffc [0,0,0,0,1,0|3,0,0]=4 1619 B9R1.12 COCNc1nccs1 a9a82eb2fef3eceb9545f8e4c6ef3225 [0,0,0,0,1,0|3,0,0]=4 1620 B9R1.12 COCOc1c[nH]cn1 6c2115fe6273b19af20bea24cbbde651 [0,0,0,0,1,0|3,0,0]=4 1621 B9R1.12 COCOc1ccco1 e04897991e5b5a23be25371e2fdd1455 [0,0,0,0,1,0|2,0,0]=3 1622 B9R1.12 COCOc1cccs1 f7e2b3cd366d3a572662b6a110d9cdff [0,0,0,0,1,0|2,0,0]=3 1623 B9R1.12 COCOc1ccn[nH]1 3b68d0dff601b1769a10360beb00fe7d [0,0,0,0,1,0|3,0,0]=4 1624 B9R1.12 COCOc1ccsc1 49538f86247396d6cbaa2d0525ffe326 [0,0,0,0,1,0|2,0,0]=3 1625 B9R1.12 COCOc1cn[nH]c1 3b37c34b294fe38a467e570e41a44a5a [0,0,0,0,1,0|3,0,0]=4 1626 B9R1.12 COCOc1cnoc1 094c7a265777147fd1badd985979b55f [0,0,0,0,1,0|3,0,0]=4 1627 B9R1.12 COCOc1nccs1 c88505ed52fd613977542dc936050055 [0,0,0,0,1,0|3,0,0]=4 1628 B9R1.12 COCOn1cccn1 ef1cebe7353bf75e6a834546462668ad [0,0,0,0,1,0|3,0,0]=4 1629 B9R1.12 COCOn1ccnc1 fa3400d6b363065703bee688bf91bda7 [0,0,0,0,1,0|3,0,0]=4 1630 B9R1.12 CSCNc1cccs1 9666dae99bc2c28068bd9eb8da246d16 [0,0,0,0,1,0|2,1,0]=4 1631 B9R1.12 CSCNc1ccsc1 d321f0c68ba20091ba171cf0778dbfb2 [0,0,0,0,1,0|2,1,0]=4 1632 B9R1.12 CSCOc1ccco1 1390e2388610ba4d2a6a9c5a27789bf5 [0,0,0,0,1,0|2,1,0]=4 1633 B9R1.12 CSCOc1cccs1 bce12fac0c68c414ccd2f558ed87d259 [0,0,0,0,1,0|2,1,0]=4 1634 B9R1.12 CSCOc1ccsc1 807436c00e66b00c405a78aa81eb9f6c [0,0,0,0,1,0|2,1,0]=4 1635 B8R0.11 C=CC(C=C)OCOC 5666c635c087a4e11ddbf21c90e2c7df [1,0,1,0,0,0|1,0,1]=4 1636 B10R0.91 C=C/C=C/C(=O)NCCCC 10ab5b019fd666fa7fd5d4798cb4be3a [0,1,1,0,0,0|2,0,0]=4 1637 B10R0.91 C=C/C=C/C(=O)NCCOC 351ba5c30d213fd54c2f17a189d04388 [0,1,1,0,0,0|1,0,0]=3 1638 B10R0.91 C=C/C=C/C(=O)NCCON 8bd552802846e5d0314c53c27dc62d81 [0,1,1,0,0,0|2,0,0]=4 1639 B10R0.91 C=C/C=C/C(=O)NCCSC c13e7c621bf4db18540150cd963cf5ed [0,1,1,0,0,0|1,1,0]=4 1640 B10R0.91 C=C/C=C\C(=O)NCCCC c8a18923925d2c2145bb35dcf37ddb4d [0,1,1,0,0,0|2,0,0]=4 1641 B10R0.91 C=C/C=C\C(=O)NCCOC 74cd1c11300b875ba10c35c1245ea91d [0,1,1,0,0,0|1,0,0]=3 1642 B10R0.91 C=C/C=C\C(=O)NCCON 6f923789747b1f8b4f9a20a580516b14 [0,1,1,0,0,0|2,0,0]=4 1643 B10R0.91 C=C/C=C\C(=O)NCCSC d379853bed74c31943de8c2d57b4bf72 [0,1,1,0,0,0|1,1,0]=4 1644 B10R0.91 C=CC=CC(=O)NCCCC 20646493048f04a031bdcfa6bf608cd9 [0,1,1,0,0,0|2,0,0]=4 1645 B10R0.91 C=CC=CC(=O)NCCOC a81a1a536aaf63bef2438638c1ba6b98 [0,1,1,0,0,0|1,0,0]=3 1646 B10R0.91 C=CC=CC(=O)NCCON f215f2d54048dd16f354f2e4fe40ccc0 [0,1,1,0,0,0|2,0,0]=4 1647 B10R0.91 C=CC=CC(=O)NCCSC 25fa53b9da06a0362fd21b95abbcb80a [0,1,1,0,0,0|1,1,0]=4 1648 B10R0.24 C=CCC(C=C)OCCOC 6b381a415a23d86984eedaba1c29d249 [0,1,1,0,0,0|0,0,2]=4 1649 B10R0.90 C=CCN(CC=C)CCOC 79056abd70305b79c77e4c4e4e87a9fd [0,1,1,0,0,0|1,0,1]=4 1650 B10R0.71 C/C=C/C=C/COCCOC 09d182365213d814b51c617be63aafcf [0,1,1,0,0,0|0,0,2]=4 1651 B10R0.71 C=C/C=C/CCNCCOC 7b5f127017eb8e148e5acd68c20b812c [0,1,1,0,0,0|0,0,2]=4 1652 B10R0.71 CC=CC=CCOCCOC 39a09f3f320ae5f898ad13e2186ab48e [0,1,1,0,0,0|0,0,2]=4 1653 B10R1.1 CCNc1ccc(=O)[nH]c1 cda5f6466914b9089a8f399c4d41b9f1 [1,1,0,0,0,0|2,0,0]=4 1654 B10R1.1 CCNc1ccc(cc1)Br e7368b650d842df07f1a9668bf0b4031 [1,1,0,0,0,0|1,0,0]=3 1655 B10R1.1 CCNc1ccc(cc1)C 5bd280a2c0e051bd626f67ade06cc665 [1,1,0,0,0,0|1,0,0]=3 1656 B10R1.1 CCNc1ccc(cc1)Cl 78a77ff2de1029463881d0096e3c40b4 [1,1,0,0,0,0|1,0,0]=3 1657 B10R1.1 CCNc1ccc(cc1)F 7245e23faec7214139cc638d5d7041df [1,1,0,0,0,0|1,0,0]=3 1658 B10R1.1 CCNc1ccc(cc1)I 08dbf719260fe2b9101a362dcb5b3f5c [1,1,0,0,0,0|1,0,0]=3 1659 B10R1.1 CCNc1ccc(cc1)S d391e984cf82ddd3585ab73e3af8af78 [1,1,0,0,0,0|1,0,0]=3 1660 B10R1.1 CCNc1ccc(cn1)Br 639f883e838120d440c275f266387630 [1,1,0,0,0,0|2,0,0]=4 1661 B10R1.1 CCNc1ccc(cn1)C fb256d19526c3e4e7db09097bf1226ae [1,1,0,0,0,0|2,0,0]=4 1662 B10R1.1 CCNc1ccc(cn1)Cl 86942235d68fec688c4d98a640636bda [1,1,0,0,0,0|2,0,0]=4 1663 B10R1.1 CCNc1ccc(cn1)F bc6bc6f1cc565acba301cdb52762e02f [1,1,0,0,0,0|2,0,0]=4 1664 B10R1.1 CCNc1ccc(cn1)I 52b76d004d4ec36a1450a88eb15ee235 [1,1,0,0,0,0|2,0,0]=4 1665 B10R1.1 CCNc1ccc(nc1)Br 59c1c575d4cf738922707e4ac33945e2 [1,1,0,0,0,0|2,0,0]=4 1666 B10R1.1 CCNc1ccc(nc1)C c6a305032b477973c3c3fbf0a9e4e681 [1,1,0,0,0,0|2,0,0]=4 1667 B10R1.1 CCNc1ccc(nc1)Cl a3742bd50e5ddc0bb8d9bcc0351dba6f [1,1,0,0,0,0|2,0,0]=4 1668 B10R1.1 CCNc1ccc(nc1)F 1c8d0a2e7c3ebc9b796eced21d4d67da [1,1,0,0,0,0|2,0,0]=4 1669 B10R1.1 CCNc1ccc(nc1)I b055045d2de39aafb4b6d6710f7ae0e8 [1,1,0,0,0,0|2,0,0]=4 1670 B10R1.1 CCOc1ccc(cc1)Br 0e76a95a836dd2981a43d0b194227fd8 [1,1,0,0,0,0|1,0,0]=3 1671 B10R1.1 CCOc1ccc(cc1)C 26efd14f9e8649940b64cdf1b3738f1b [1,1,0,0,0,0|1,0,0]=3 1672 B10R1.1 CCOc1ccc(cc1)Cl 945eb2c259d4cb8905c1789c25d510a9 [1,1,0,0,0,0|1,0,0]=3 1673 B10R1.1 CCOc1ccc(cc1)F 5faab7d15ff0cf2f779560e4d5e7448c [1,1,0,0,0,0|1,0,0]=3 1674 B10R1.1 CCOc1ccc(cc1)I 53aa34317b2540d22d9ec7de628cac3d [1,1,0,0,0,0|1,0,0]=3 1675 B10R1.1 CCOc1ccc(cc1)S 99269a211e814d9abbdc09864e525389 [1,1,0,0,0,0|1,0,0]=3 1676 B10R1.1 CCOc1ccc(cn1)C f777259bf4373954cda4bbb8405a47a2 [1,1,0,0,0,0|2,0,0]=4 1677 B10R1.1 CCOc1ccc(cn1)Cl cd4f070a79f4939e7eca32fa7a8d0e7f [1,1,0,0,0,0|2,0,0]=4 1678 B10R1.1 CCOc1ccc(cn1)F b50f8cb60dc9806fa9d9175eac7405e9 [1,1,0,0,0,0|2,0,0]=4 1679 B10R1.1 CCOc1ccc(cn1)I 134eef0ef437844eb5a79430a3f4f022 [1,1,0,0,0,0|2,0,0]=4 1680 B10R1.1 CCOc1ccc(nc1)Br bac9395e09cd94d673b47afe64f445de [1,1,0,0,0,0|2,0,0]=4 1681 B10R1.1 CCOc1ccc(nc1)C a681f7f0cc1b45047bb455631f3beced [1,1,0,0,0,0|2,0,0]=4 1682 B10R1.1 CCOc1ccc(nc1)Cl 1b78e4b95bbcd168fec166181ff52b61 [1,1,0,0,0,0|2,0,0]=4 1683 B10R1.1 CCOc1ccc(nc1)F a0e05acc1f44f1bf919de4da94e9dd90 [1,1,0,0,0,0|2,0,0]=4 1684 B10R1.1 CCOc1ccc(nc1)I 131dd3afd2712c4ddfbf28645dd95597 [1,1,0,0,0,0|2,0,0]=4 1685 B10R1.1 Cc1ccc(cc1)NCF bc1e070a03926f4bf6c7312d5f79c7d7 [1,1,0,0,0,0|2,0,0]=4 1686 B10R1.1 Cc1ccc(cc1)NCO 626a801ae48c57fa3fcbb53e76d595f1 [1,1,0,0,0,0|1,0,0]=3 1687 B10R1.1 Cc1ccc(cc1)OCF 1ff33ac4ceb2cbf44a59770aa34ca71f [1,1,0,0,0,0|2,0,0]=4 1688 B10R1.1 Cc1ccc(cn1)NCO fd814a39a039a510f879e6acc6bae8ec [1,1,0,0,0,0|2,0,0]=4 1689 B10R1.1 Cc1ccc(nc1)NCO a3d787a21cbcad7f0f8fd58a7dfe7945 [1,1,0,0,0,0|2,0,0]=4 1690 B10R1.1 FCNc1ccc(cc1)Br 9a61248e2cb3b89f6eda1c85794bcc18 [1,1,0,0,0,0|2,0,0]=4 1691 B10R1.1 FCNc1ccc(cc1)Cl 758cd93e824e8d8fe0f2c7b44d621ed4 [1,1,0,0,0,0|2,0,0]=4 1692 B10R1.1 FCNc1ccc(cc1)F 371043c79a08be334292394da386365b [1,1,0,0,0,0|2,0,0]=4 1693 B10R1.1 FCNc1ccc(cc1)I c777c25d05ef7069ce73e36f40a5c833 [1,1,0,0,0,0|2,0,0]=4 1694 B10R1.1 FCNc1ccc(cc1)S 4e916ab7b0222d51e372a5dff4038b6f [1,1,0,0,0,0|2,0,0]=4 1695 B10R1.1 FCOc1ccc(cc1)Br bc13401ff1b5b76f437683a94bdf2ed8 [1,1,0,0,0,0|2,0,0]=4 1696 B10R1.1 FCOc1ccc(cc1)Cl 4e8cdf8131543ffc8a8f19ac10dd354e [1,1,0,0,0,0|2,0,0]=4 1697 B10R1.1 FCOc1ccc(cc1)F d9961c874524e60966f13168de74d68e [1,1,0,0,0,0|2,0,0]=4 1698 B10R1.1 FCOc1ccc(cc1)I 31e9a7d342257542e659914127a8d1e9 [1,1,0,0,0,0|2,0,0]=4 1699 B10R1.1 FCOc1ccc(cc1)S 3c6768610977ef2105a56aef384b857c [1,1,0,0,0,0|2,0,0]=4 1700 B10R1.1 O=c1ccc(c[nH]1)NCO 6c49f3fcbfcda41856e9a3ef89f0e0b2 [1,1,0,0,0,0|2,0,0]=4 1701 B10R1.1 OCNc1ccc(cc1)Br 8a6f77c6bbe9ea4e056c3d8d66d7853d [1,1,0,0,0,0|1,0,0]=3 1702 B10R1.1 OCNc1ccc(cc1)Cl 86437eba67664b7a79a0b9f1be727594 [1,1,0,0,0,0|1,0,0]=3 1703 B10R1.1 OCNc1ccc(cc1)F 713130e1345d066522caa5c40a69b374 [1,1,0,0,0,0|1,0,0]=3 1704 B10R1.1 OCNc1ccc(cc1)I b3ec7df4f137e654c56c2616ca2d7a8a [1,1,0,0,0,0|1,0,0]=3 1705 B10R1.1 OCNc1ccc(cc1)S a2d81e6a6f1ccdc29f69d5fbee093f77 [1,1,0,0,0,0|1,0,0]=3 1706 B10R1.1 OCNc1ccc(cn1)Br df4ffeb7d3426fa3f30c970836be5a07 [1,1,0,0,0,0|2,0,0]=4 1707 B10R1.1 OCNc1ccc(cn1)Cl d8643f93dc56c4026f45d75600865cf1 [1,1,0,0,0,0|2,0,0]=4 1708 B10R1.1 OCNc1ccc(cn1)F c678380a06127762dfcfe4f997000000 [1,1,0,0,0,0|2,0,0]=4 1709 B10R1.1 OCNc1ccc(cn1)I 4da26305a3e4c2d76ed4b2a820524344 [1,1,0,0,0,0|2,0,0]=4 1710 B10R1.1 OCNc1ccc(nc1)Br 399f860b3f8af2a89c07a3b0752fb11e [1,1,0,0,0,0|2,0,0]=4 1711 B10R1.1 OCNc1ccc(nc1)Cl d6034f7aa3e9576c3befbcbc74c36153 [1,1,0,0,0,0|2,0,0]=4 1712 B10R1.1 OCNc1ccc(nc1)F 9c48cfa9cdfaaee705bc9f41b078a0e2 [1,1,0,0,0,0|2,0,0]=4 1713 B10R1.1 OCNc1ccc(nc1)I 115f65afea3289921087b1ab2d1633ed [1,1,0,0,0,0|2,0,0]=4 1714 B10R1.4 CCNc1ccc[nH]c1=S 67a5b3b55c36deab6cc15e67fc040e75 [1,1,0,0,0,0|2,0,0]=4 1715 B10R1.4 CCNc1cccc[n+]1[O-] 02091f95b7d222da69935edad316aa89 [1,1,0,0,0,0|2,0,0]=4 1716 B10R1.4 CCNc1ccccc1Cl 2dfb513d252d373232906f5030075d40 [1,1,0,0,0,0|1,0,0]=3 1717 B10R1.4 CCNc1ccccc1F 7ab2c72548cf5934972f59a05bcf3b98 [1,1,0,0,0,0|1,0,0]=3 1718 B10R1.4 CCNc1ccccc1I a15e1e777d9cb3c3c67c713eae1f152f [1,1,0,0,0,0|1,0,0]=3 1719 B10R1.4 CCNc1cccnc1Br a2373bd4dbeea9e96613175b1fa389be [1,1,0,0,0,0|2,0,0]=4 1720 B10R1.4 CCNc1cccnc1C aa29ce1aae1cb0173cce32ed6de53439 [1,1,0,0,0,0|2,0,0]=4 1721 B10R1.4 CCNc1cccnc1Cl cabaa73226660203e29d27ac34157732 [1,1,0,0,0,0|2,0,0]=4 1722 B10R1.4 CCNc1cccnc1F 1c26bd9832ea7353d5986c5b2a82ebeb [1,1,0,0,0,0|2,0,0]=4 1723 B10R1.4 CCNc1cccnc1I aa60c46f7fe874be857c1ace71f86b31 [1,1,0,0,0,0|2,0,0]=4 1724 B10R1.4 CCNc1ccncc1Br ffd2eb38e4cf903045585acdfa177024 [1,1,0,0,0,0|2,0,0]=4 1725 B10R1.4 CCNc1ccncc1C a4036471d4d817efbd65f0f570537bae [1,1,0,0,0,0|2,0,0]=4 1726 B10R1.4 CCNc1ccncc1Cl cc17327e7d09812cb4857d56245710a7 [1,1,0,0,0,0|2,0,0]=4 1727 B10R1.4 CCNc1ccncc1F 2cf4abf23adb3e08a46ff5f679cb5913 [1,1,0,0,0,0|2,0,0]=4 1728 B10R1.4 CCNc1ccncc1I 079ccaf1613a9f898aa33de4b63592f7 [1,1,0,0,0,0|2,0,0]=4 1729 B10R1.4 CCNc1cnccc1Br 16ccd75ae6484f9482a40238b5f84138 [1,1,0,0,0,0|2,0,0]=4 1730 B10R1.4 CCNc1cnccc1C 4e74c1f11dcd52a7c20dfdd6b5662790 [1,1,0,0,0,0|2,0,0]=4 1731 B10R1.4 CCNc1cnccc1Cl fce9e815cea92983ee0d8ac5fb395bc8 [1,1,0,0,0,0|2,0,0]=4 1732 B10R1.4 CCNc1cnccc1F efcbd8573a43bcdf8091057e7ebdf59e [1,1,0,0,0,0|2,0,0]=4 1733 B10R1.4 CCNc1cnccc1I 11de2c92a556b377d01b5ed33d779892 [1,1,0,0,0,0|2,0,0]=4 1734 B10R1.4 CCNc1cnccc1S b06232fe6249f36d78efb086b14dd641 [1,1,0,0,0,0|2,0,0]=4 1735 B10R1.4 CCNc1ncccc1Br c725f87792bbf69d61dad0e1008718dc [1,1,0,0,0,0|2,0,0]=4 1736 B10R1.4 CCNc1ncccc1C a7fd36b27f175706adc74e2aac7526d2 [1,1,0,0,0,0|2,0,0]=4 1737 B10R1.4 CCNc1ncccc1Cl 38db51258030951890daf204f7ed0b90 [1,1,0,0,0,0|2,0,0]=4 1738 B10R1.4 CCNc1ncccc1F 708bbe73960ac127c7a4adb5124c7937 [1,1,0,0,0,0|2,0,0]=4 1739 B10R1.4 CCNc1ncccc1I 816a15b4e18519781f24dc419625ba99 [1,1,0,0,0,0|2,0,0]=4 1740 B10R1.4 CCOc1ccc[nH]c1=S 8c21bc69d2dc6be5a606751c990f45b9 [1,1,0,0,0,0|2,0,0]=4 1741 B10R1.4 CCOc1cccc[n+]1[O-] 5e2e6a3eb33be14884bc8c1831a174ad [1,1,0,0,0,0|2,0,0]=4 1742 B10R1.4 CCOc1ccccc1C dc9ee1b6b8a241cf6f51757c9fedb385 [1,1,0,0,0,0|1,0,0]=3 1743 B10R1.4 CCOc1ccccc1Cl 9b9ed61fe6629f2df6b1eaddc9ec2e8a [1,1,0,0,0,0|1,0,0]=3 1744 B10R1.4 CCOc1ccccc1F 41f85306b1c4b7c4daecba5a00d66cce [1,1,0,0,0,0|1,0,0]=3 1745 B10R1.4 CCOc1ccccc1I 3bfd90529c85539df6076f624de1f80d [1,1,0,0,0,0|1,0,0]=3 1746 B10R1.4 CCOc1cccnc1Br 08b45b24e31de1110a9d86520664a434 [1,1,0,0,0,0|2,0,0]=4 1747 B10R1.4 CCOc1cccnc1C 0260c4935677d055d800178e37d974b6 [1,1,0,0,0,0|2,0,0]=4 1748 B10R1.4 CCOc1cccnc1Cl 684709ad9eeb4a1f4f9e4a19760d89be [1,1,0,0,0,0|2,0,0]=4 1749 B10R1.4 CCOc1cccnc1F eb46cca158e1b62d818714a01a5af0f3 [1,1,0,0,0,0|2,0,0]=4 1750 B10R1.4 CCOc1cccnc1I 792b0a09e935918385422ce79b947b91 [1,1,0,0,0,0|2,0,0]=4 1751 B10R1.4 CCOc1cccoc1=O 7ff4b51ee01af505d2964258091f5c59 [1,1,0,0,0,0|2,0,0]=4 1752 B10R1.4 CCOc1ccncc1Br 55a5d7eb5c6e1589c96bf824d7208a22 [1,1,0,0,0,0|2,0,0]=4 1753 B10R1.4 CCOc1ccncc1C 20c8f7e703c3d3baef36021d316a4da0 [1,1,0,0,0,0|2,0,0]=4 1754 B10R1.4 CCOc1ccncc1Cl 5e0f3ecd2dfdb5f220c2bf78ed519c55 [1,1,0,0,0,0|2,0,0]=4 1755 B10R1.4 CCOc1ccncc1F eea1222228b0061fe90624479072235a [1,1,0,0,0,0|2,0,0]=4 1756 B10R1.4 CCOc1cnccc1Br cc65e9d894dca176f1e04b368966ac9b [1,1,0,0,0,0|2,0,0]=4 1757 B10R1.4 CCOc1cnccc1C 50b788e4b20e4d60835564cb398dcb8c [1,1,0,0,0,0|2,0,0]=4 1758 B10R1.4 CCOc1cnccc1Cl 9252fbdc2aaa496a5df46d8e859e8bec [1,1,0,0,0,0|2,0,0]=4 1759 B10R1.4 CCOc1cnccc1F 48497666769166ce90aacce840caeccc [1,1,0,0,0,0|2,0,0]=4 1760 B10R1.4 CCOc1cnccc1I b3ec03f0e98ec8d0e34044a0a69fa976 [1,1,0,0,0,0|2,0,0]=4 1761 B10R1.4 CCOc1coccc1=O f03228b8de8c0c009e2b1ec644801385 [1,1,0,0,0,0|2,0,0]=4 1762 B10R1.4 CCOc1ncccc1Br f4383148a14f49cafea4eeb34cba2f7d [1,1,0,0,0,0|2,0,0]=4 1763 B10R1.4 CCOc1ncccc1C e8543da7a575b70db65e7933cc01e850 [1,1,0,0,0,0|2,0,0]=4 1764 B10R1.4 CCOc1ncccc1Cl 4590ed1a2376b9070dd9165912ca6275 [1,1,0,0,0,0|2,0,0]=4 1765 B10R1.4 CCOc1ncccc1F a8635691cfd51eb96b174213d32b56ee [1,1,0,0,0,0|2,0,0]=4 1766 B10R1.4 CCOn1ccccc1=N 066e010845a5f633ef5690a0c60b3ada [1,1,0,0,0,0|2,0,0]=4 1767 B10R1.4 CCOn1ccccc1=O 0b23c2e0447fcd6e93837fb5b83fe2d6 [1,1,0,0,0,0|2,0,0]=4 1768 B10R1.4 CCOn1ccccc1=S 3f6c47def882e136a1b020f7dbe062b5 [1,1,0,0,0,0|2,0,0]=4 1769 B10R1.4 Cc1ccccc1OCF 8baad2379a58970c56de2a8d01203209 [1,1,0,0,0,0|2,0,0]=4 1770 B10R1.4 Cc1cccnc1NCO b9826d2a8449ec373392c9bb98cfc60e [1,1,0,0,0,0|2,0,0]=4 1771 B10R1.4 Cc1ccncc1NCO e4933813d96bfefaf0bee2f99290507f [1,1,0,0,0,0|2,0,0]=4 1772 B10R1.4 Cc1cnccc1NCO 9c8541485e7e2429c3deeaca1ea35ffc [1,1,0,0,0,0|2,0,0]=4 1773 B10R1.4 Cc1ncccc1NCO 2163da6c3951ac44c1be417e09664d52 [1,1,0,0,0,0|2,0,0]=4 1774 B10R1.4 FCNc1ccccc1Cl d9b123aca09542405b035cbfc7a3c90b [1,1,0,0,0,0|2,0,0]=4 1775 B10R1.4 FCNc1ccccc1F 0a7d0fadca34184ec755df42efe17064 [1,1,0,0,0,0|2,0,0]=4 1776 B10R1.4 FCNc1ccccc1I 5959339ca8fbd24d83e04ddfbe0e0157 [1,1,0,0,0,0|2,0,0]=4 1777 B10R1.4 FCNc1ccccc1S d634255285ab47bb94c2bca0b3757d2a [1,1,0,0,0,0|2,0,0]=4 1778 B10R1.4 FCOc1ccccc1Cl a5299ee9d2e64e316b2aa5d3a27153e6 [1,1,0,0,0,0|2,0,0]=4 1779 B10R1.4 FCOc1ccccc1F 5806cc0111f0c8f01c1e2cf9018d81c2 [1,1,0,0,0,0|2,0,0]=4 1780 B10R1.4 FCOc1ccccc1I decd9faac1634980fd9c104b6a434168 [1,1,0,0,0,0|2,0,0]=4 1781 B10R1.4 OCNc1ccccc1I 10ade089d4f881d90e5208c43f98902f [1,1,0,0,0,0|1,0,0]=3 1782 B10R1.4 OCNc1cccnc1Br 7e757b1b55f902889855879ddc522fb0 [1,1,0,0,0,0|2,0,0]=4 1783 B10R1.4 OCNc1cccnc1Cl 698ab8db9bc7be3255bc7380ce9aaa39 [1,1,0,0,0,0|2,0,0]=4 1784 B10R1.4 OCNc1cccnc1F fa95074763d1b79d4379cbccbf606177 [1,1,0,0,0,0|2,0,0]=4 1785 B10R1.4 OCNc1cccnc1I 24ae1d254ba17b837d586845f299b407 [1,1,0,0,0,0|2,0,0]=4 1786 B10R1.4 OCNc1ccncc1Br 043c6178a1ab58a98fa93ec425d203ca [1,1,0,0,0,0|2,0,0]=4 1787 B10R1.4 OCNc1ccncc1Cl 2b47f51ab4733ba853a497ee10ffa423 [1,1,0,0,0,0|2,0,0]=4 1788 B10R1.4 OCNc1ccncc1F 40fbda4234bf042d70ef0fda5d7316e1 [1,1,0,0,0,0|2,0,0]=4 1789 B10R1.4 OCNc1ccncc1I 3ac21fc2c03a013c796b1896ac37dcd3 [1,1,0,0,0,0|2,0,0]=4 1790 B10R1.4 OCNc1cnccc1Br 5d032f06debe2317bdc278b84367b2a4 [1,1,0,0,0,0|2,0,0]=4 1791 B10R1.4 OCNc1cnccc1Cl 303a576d9462a0faf85137d3188ebf11 [1,1,0,0,0,0|2,0,0]=4 1792 B10R1.4 OCNc1cnccc1F 3f2dcb75eda77bcd64256bb0d5fa488d [1,1,0,0,0,0|2,0,0]=4 1793 B10R1.4 OCNc1cnccc1I b87052664ee5286776a0964c0ae129c4 [1,1,0,0,0,0|2,0,0]=4 1794 B10R1.4 OCNc1cnccc1S 72adbafda58b2f8f71778b7cbd9fa239 [1,1,0,0,0,0|2,0,0]=4 1795 B10R1.4 OCNc1ncccc1Br 77f1d94fff1c3354e71f7578b9db6e71 [1,1,0,0,0,0|2,0,0]=4 1796 B10R1.4 OCNc1ncccc1Cl 256af2a4e5339bf92fd701c592729960 [1,1,0,0,0,0|2,0,0]=4 1797 B10R1.4 OCNc1ncccc1F dba34b55d72c76512ea1914953015207 [1,1,0,0,0,0|2,0,0]=4 1798 B10R1.4 OCNc1ncccc1I f23791fb28fbf315ed36948d7065f414 [1,1,0,0,0,0|2,0,0]=4 1799 B10R1.4 [O-][n+]1ccccc1NCO fb15ecba3e81f851e97973b2f9b23d07 [1,1,0,0,0,0|2,0,0]=4 1800 B10R1.10 CCNc1cc(ccn1)Br d059085370442a13584ded71a5ddc9b8 [1,1,0,0,0,0|2,0,0]=4 1801 B10R1.10 CCNc1cc(ccn1)C ead6e66bc426bd20a03df23491bb9b54 [1,1,0,0,0,0|2,0,0]=4 1802 B10R1.10 CCNc1cc(ccn1)Cl b2a45afedb1a2c06b6d2ed398b1b9fd7 [1,1,0,0,0,0|2,0,0]=4 1803 B10R1.10 CCNc1cc(ccn1)F fbdfc8a9a414de8ffb419ecbd943de26 [1,1,0,0,0,0|2,0,0]=4 1804 B10R1.10 CCNc1cc(ccn1)I d53a5d370716816198e976ed0d538017 [1,1,0,0,0,0|2,0,0]=4 1805 B10R1.10 CCNc1cc[nH]c(=S)c1 18279867df6bd2717d53a0a712c5f251 [1,1,0,0,0,0|2,0,0]=4 1806 B10R1.10 CCNc1cccc(c1)Br 3559ffa0b462d1bd714cf3ca993ed95e [1,1,0,0,0,0|1,0,0]=3 1807 B10R1.10 CCNc1cccc(c1)C 7e90094bdff0d2ffec0927834a6a088a [1,1,0,0,0,0|1,0,0]=3 1808 B10R1.10 CCNc1cccc(c1)Cl e86c6a0dbdc5ec7691435dfb2bf0caac [1,1,0,0,0,0|1,0,0]=3 1809 B10R1.10 CCNc1cccc(c1)F fb10d26ad355d9adf069631a680226b5 [1,1,0,0,0,0|1,0,0]=3 1810 B10R1.10 CCNc1cccc(c1)I 9531fa5d8f78367f3126484c4e782fa9 [1,1,0,0,0,0|1,0,0]=3 1811 B10R1.10 CCNc1cccc(c1)S a44d310b6eb926e6cc396b05b3cff23a [1,1,0,0,0,0|1,0,0]=3 1812 B10R1.10 CCNc1cccc(n1)Br bdf3c98d55e3185cc2a435a8a4fbf30b [1,1,0,0,0,0|2,0,0]=4 1813 B10R1.10 CCNc1cccc(n1)C a6d43cd595c5eb0b178fe2416f91b131 [1,1,0,0,0,0|2,0,0]=4 1814 B10R1.10 CCNc1cccc(n1)Cl 5a7a857b9ff459dab8398e6aa9d75650 [1,1,0,0,0,0|2,0,0]=4 1815 B10R1.10 CCNc1cccc(n1)F 5b24b54d716d9dced5c7bc536933db9c [1,1,0,0,0,0|2,0,0]=4 1816 B10R1.10 CCNc1cccc(n1)I 5bd2f7aa302878c630f540d50c1902a7 [1,1,0,0,0,0|2,0,0]=4 1817 B10R1.10 CCNc1ccnc(c1)Br b0de2c7dd0b2afc8e0058a60dc5eeb05 [1,1,0,0,0,0|2,0,0]=4 1818 B10R1.10 CCNc1ccnc(c1)C 58ebbaae6a202dff8555d7dd291a0bc7 [1,1,0,0,0,0|2,0,0]=4 1819 B10R1.10 CCNc1ccnc(c1)Cl 5dd6887f0e4e47b60cccdce22d76d27c [1,1,0,0,0,0|2,0,0]=4 1820 B10R1.10 CCNc1ccnc(c1)F 456c27c0065facf0db581015b185dd5e [1,1,0,0,0,0|2,0,0]=4 1821 B10R1.10 CCNc1ccnc(c1)I 9f90991b3c2f748f9a394e0717385ee7 [1,1,0,0,0,0|2,0,0]=4 1822 B10R1.10 CCNc1cncc(c1)Br 32c3d20c2a967ffd8b369baff96df78b [1,1,0,0,0,0|2,0,0]=4 1823 B10R1.10 CCNc1cncc(c1)C 3532d78dae514f8ef5b485b2e6860ebe [1,1,0,0,0,0|2,0,0]=4 1824 B10R1.10 CCNc1cncc(c1)Cl 291ad30b57031986784f4e159245ef5b [1,1,0,0,0,0|2,0,0]=4 1825 B10R1.10 CCNc1cncc(c1)F eb3b221df4c2b29925e5d3320a410797 [1,1,0,0,0,0|2,0,0]=4 1826 B10R1.10 CCNc1cncc(c1)I e218a1afe6a6aca6d71c039b21806c27 [1,1,0,0,0,0|2,0,0]=4 1827 B10R1.10 CCOc1cc(ccn1)Br 47baa3e649bbd6c09eab191c6164e915 [1,1,0,0,0,0|2,0,0]=4 1828 B10R1.10 CCOc1cc(ccn1)C 2da9c0524b55cd9ee02f9192b348218b [1,1,0,0,0,0|2,0,0]=4 1829 B10R1.10 CCOc1cc(ccn1)Cl f1569f953b6ce89dfd8a230ba1b746f0 [1,1,0,0,0,0|2,0,0]=4 1830 B10R1.10 CCOc1cc(ccn1)F b1acf79f5addc912dd21fb19cb9afccc [1,1,0,0,0,0|2,0,0]=4 1831 B10R1.10 CCOc1ccc[n+](c1)[O-] fe135ea11184d89f3d575034577b6c53 [1,1,0,0,0,0|2,0,0]=4 1832 B10R1.10 CCOc1cccc(=O)[nH]1 c94839f401af37d9f4dfdf393db93386 [1,1,0,0,0,0|2,0,0]=4 1833 B10R1.10 CCOc1cccc(c1)Br 59b0f5cf1b6eeed19f09ca4b10ff10f6 [1,1,0,0,0,0|1,0,0]=3 1834 B10R1.10 CCOc1cccc(c1)C c484b8098bb494764323b4d807c3d871 [1,1,0,0,0,0|1,0,0]=3 1835 B10R1.10 CCOc1cccc(c1)Cl 0302a2b3778df08595f07cb1f730b10b [1,1,0,0,0,0|1,0,0]=3 1836 B10R1.10 CCOc1cccc(c1)F e3c752114bd9c3d3cb33513b156f9036 [1,1,0,0,0,0|1,0,0]=3 1837 B10R1.10 CCOc1cccc(c1)I 0d8a8a4223f2d3d3697a5720204df0bd [1,1,0,0,0,0|1,0,0]=3 1838 B10R1.10 CCOc1cccc(c1)S 0a6998f5983825c4343bcc0ed4a9090c [1,1,0,0,0,0|1,0,0]=3 1839 B10R1.10 CCOc1cccc(n1)Br 7baff524721e41ab6ff879a1139b25ea [1,1,0,0,0,0|2,0,0]=4 1840 B10R1.10 CCOc1cccc(n1)C 8886c898bef83c4de5a441ddd5f1e8cd [1,1,0,0,0,0|2,0,0]=4 1841 B10R1.10 CCOc1cccc(n1)F d128ec09e8d7b22b6dee7bd24841de35 [1,1,0,0,0,0|2,0,0]=4 1842 B10R1.10 CCOc1ccnc(c1)Br f5f413b01305a0260bc310cf9726afec [1,1,0,0,0,0|2,0,0]=4 1843 B10R1.10 CCOc1ccnc(c1)C 4df81811aab21f04d442f5835764e2f5 [1,1,0,0,0,0|2,0,0]=4 1844 B10R1.10 CCOc1ccnc(c1)Cl 18f5c214b51f15f58d3b02a0d1cd8938 [1,1,0,0,0,0|2,0,0]=4 1845 B10R1.10 CCOc1ccnc(c1)F f1a83957d98d4974100f6d16082a66d4 [1,1,0,0,0,0|2,0,0]=4 1846 B10R1.10 CCOc1cncc(c1)C 9fa5233d4ea9ce3b8225bbc243f1f651 [1,1,0,0,0,0|2,0,0]=4 1847 B10R1.10 CCOc1cncc(c1)Cl a02433d9cea7b28adfbfbce32981ccfd [1,1,0,0,0,0|2,0,0]=4 1848 B10R1.10 CCOc1cncc(c1)F 31714c319aae0ab59ee10e9b01cc1a2a [1,1,0,0,0,0|2,0,0]=4 1849 B10R1.10 CCOc1cncc(c1)I 50cf1cd1a59fe9ac9a9438b380797254 [1,1,0,0,0,0|2,0,0]=4 1850 B10R1.10 Cc1cc(ccn1)NCO 353dcdae75673eff669a504a76ea86a7 [1,1,0,0,0,0|2,0,0]=4 1851 B10R1.10 Cc1cccc(c1)NCF f51cf3458817b85dd255a9237b903e6d [1,1,0,0,0,0|2,0,0]=4 1852 B10R1.10 Cc1cccc(c1)NCO eb61e002278030a37368dc2bd095ceec [1,1,0,0,0,0|1,0,0]=3 1853 B10R1.10 Cc1cccc(c1)OCF 44a22e926d5d6090dde9bff2fda50b6b [1,1,0,0,0,0|2,0,0]=4 1854 B10R1.10 Cc1cccc(n1)NCO 14b645ff6dbf83910f77237887d6e3d4 [1,1,0,0,0,0|2,0,0]=4 1855 B10R1.10 Cc1ccnc(c1)NCO 65994d174363031ffa8868b3de8821ab [1,1,0,0,0,0|2,0,0]=4 1856 B10R1.10 Cc1cncc(c1)NCO ee496a79f8157af8a8b0a0a3c499d815 [1,1,0,0,0,0|2,0,0]=4 1857 B10R1.10 FCNc1cccc(c1)Br c9704cbdbb1fdbdf56d8ebff639cbd91 [1,1,0,0,0,0|2,0,0]=4 1858 B10R1.10 FCNc1cccc(c1)Cl b872f9905f1be884c21a425e188a3799 [1,1,0,0,0,0|2,0,0]=4 1859 B10R1.10 FCNc1cccc(c1)F 7d4f26ca413cdb267cd9918eadc7e27c [1,1,0,0,0,0|2,0,0]=4 1860 B10R1.10 FCNc1cccc(c1)I e0561328f6c898e6107a8b27b3024339 [1,1,0,0,0,0|2,0,0]=4 1861 B10R1.10 FCNc1cccc(c1)S 086bce0acd48689019a74b3e6fa25e44 [1,1,0,0,0,0|2,0,0]=4 1862 B10R1.10 FCOc1cccc(c1)Br 80d2510913f89b70a700b0a85c7b5f8c [1,1,0,0,0,0|2,0,0]=4 1863 B10R1.10 FCOc1cccc(c1)Cl 923cd2deba2a91f957f577166c83db17 [1,1,0,0,0,0|2,0,0]=4 1864 B10R1.10 FCOc1cccc(c1)F 32af0f234c8dc4ce890ff812ba75b297 [1,1,0,0,0,0|2,0,0]=4 1865 B10R1.10 FCOc1cccc(c1)I 162f72df4c690124de0a310faac4bb60 [1,1,0,0,0,0|2,0,0]=4 1866 B10R1.10 FCOc1cccc(c1)S 89704a073d3d1c53c665a8dc23513f21 [1,1,0,0,0,0|2,0,0]=4 1867 B10R1.10 OCNc1cc(ccn1)Br 16aad26f9e609d5d8d2a1c7fb05ca65b [1,1,0,0,0,0|2,0,0]=4 1868 B10R1.10 OCNc1cc(ccn1)Cl 2b06f0190859c78504d004a8e6534b2d [1,1,0,0,0,0|2,0,0]=4 1869 B10R1.10 OCNc1cc(ccn1)F c7590a86957b6cff19c24517f150f55d [1,1,0,0,0,0|2,0,0]=4 1870 B10R1.10 OCNc1cc(ccn1)I fe68574e126dc1d2ad8fea565fb194e5 [1,1,0,0,0,0|2,0,0]=4 1871 B10R1.10 OCNc1cc[nH]c(=S)c1 85b1a0788ca6a1ae6d09278931ec345f [1,1,0,0,0,0|2,0,0]=4 1872 B10R1.10 OCNc1cccc(c1)Br 87332989ccf0a06305ed11c761d0693f [1,1,0,0,0,0|1,0,0]=3 1873 B10R1.10 OCNc1cccc(c1)Cl 68445f3d0584c980a0fba61df5ca8efe [1,1,0,0,0,0|1,0,0]=3 1874 B10R1.10 OCNc1cccc(c1)F 24a19ac850850294d97609fe4487e656 [1,1,0,0,0,0|1,0,0]=3 1875 B10R1.10 OCNc1cccc(c1)I ac2d74171e11e079d9ebd4692866b125 [1,1,0,0,0,0|1,0,0]=3 1876 B10R1.10 OCNc1cccc(c1)S 0a81563d3a78719492df94f2bfff9ef9 [1,1,0,0,0,0|1,0,0]=3 1877 B10R1.10 OCNc1cccc(n1)Br ec23cf0a73dbcad5ea46c52481edfe7e [1,1,0,0,0,0|2,0,0]=4 1878 B10R1.10 OCNc1cccc(n1)Cl 9e37454f7ddda321db943a2776f00577 [1,1,0,0,0,0|2,0,0]=4 1879 B10R1.10 OCNc1cccc(n1)F 8cbd1461b9b16d73df43b4022a07d4b9 [1,1,0,0,0,0|2,0,0]=4 1880 B10R1.10 OCNc1cccc(n1)I 3dfc93003bb9b64fea97872de444ea1b [1,1,0,0,0,0|2,0,0]=4 1881 B10R1.10 OCNc1ccnc(c1)Br f34c84263462672ec08c1545d87606f1 [1,1,0,0,0,0|2,0,0]=4 1882 B10R1.10 OCNc1ccnc(c1)Cl 035bab7c33e3139ab7e61c532e36a8da [1,1,0,0,0,0|2,0,0]=4 1883 B10R1.10 OCNc1ccnc(c1)F 8f926e1f9368883964881b96087d85c9 [1,1,0,0,0,0|2,0,0]=4 1884 B10R1.10 OCNc1ccnc(c1)I 9c2baa838f3f9d27815664d79d1a550a [1,1,0,0,0,0|2,0,0]=4 1885 B10R1.10 OCNc1cncc(c1)Br 22786331e0dc6b8b09cf20d0897d5f3b [1,1,0,0,0,0|2,0,0]=4 1886 B10R1.10 OCNc1cncc(c1)Cl 258ed832222e8466a5881e98d79e789b [1,1,0,0,0,0|2,0,0]=4 1887 B10R1.10 OCNc1cncc(c1)F 2545bb631007d7963e0a0dd86ab2e1bf [1,1,0,0,0,0|2,0,0]=4 1888 B10R1.10 OCNc1cncc(c1)I 73140cc0c98763c1139ab7b397b91de3 [1,1,0,0,0,0|2,0,0]=4 1889 B10R1.15 CCN(C)c1ccccc1 9cc6568b1f30abe04427bdea858da30e [1,1,0,0,0,0|1,0,0]=3 1890 B10R1.15 CCN(C)c1cccnc1 04b21f569d4c75e23135eca19e8dfd7f [1,1,0,0,0,0|2,0,0]=4 1891 B10R1.15 CCN(C)c1ccncc1 b94b8554b6698451ca404459911593cc [1,1,0,0,0,0|2,0,0]=4 1892 B10R1.15 CN(CO)c1ccccn1 a93cc933fdb4d1c91563e07701d40cda [1,1,0,0,0,0|2,0,0]=4 1893 B10R1.15 CN(CO)c1cccnc1 021ae75de63d9271d48b9d5b4bd35a1c [1,1,0,0,0,0|2,0,0]=4 1894 B10R1.15 CN(CO)c1ccncc1 80b84f29ca23cc8379579376d55abff3 [1,1,0,0,0,0|2,0,0]=4 1895 B10R1.18 CC(C)Nc1ccccc1 678b2595d663b993cd638fb4df86366a [1,1,0,0,0,0|1,0,0]=3 1896 B10R1.18 CC(C)Nc1ccccn1 8f41ba2831fdc97ef841b17526dcf604 [1,1,0,0,0,0|2,0,0]=4 1897 B10R1.18 CC(C)Nc1cccnc1 b32b013363863cea153240b96e97c19f [1,1,0,0,0,0|2,0,0]=4 1898 B10R1.18 CC(C)Nc1ccncc1 ed919cf6533ea85c87fe5a974cf5c4b4 [1,1,0,0,0,0|2,0,0]=4 1899 B10R1.18 CC(C)Oc1ccccn1 0855bdc27823287e98107cda25a8e4de [1,1,0,0,0,0|2,0,0]=4 1900 B10R1.18 CC(C)Oc1cccnc1 2d5fbf8b6573bcaaa6ad1437daf348fa [1,1,0,0,0,0|2,0,0]=4 1901 B10R1.18 CC(C)Oc1ccncc1 fcbd1de824cfd0b7040632344868de57 [1,1,0,0,0,0|2,0,0]=4 1902 B10R1.11 COCN(C)c1ccsc1 12b364790fdaa56918c9e6d7032ed233 [0,1,0,0,1,0|2,0,0]=4 1903 B10R1.16 COCNc1ccc(s1)Br 0f565c8a38f0c97c349f31cbf3f243e9 [0,1,0,0,1,0|2,0,0]=4 1904 B10R1.16 COCNc1ccc(s1)C 0d400194d1ff72f419596482873fbaac [0,1,0,0,1,0|2,0,0]=4 1905 B10R1.16 COCOc1cc(cs1)C fcb9a730d266f881ad3036a278dc5505 [0,1,0,0,1,0|2,0,0]=4 1906 B10R1.16 COCOc1ccc(s1)Br ae909183b85c49b85b2aee55c741dd92 [0,1,0,0,1,0|2,0,0]=4 1907 B10R1.21 CCCCNc1ccco1 59676670e7fa0c04d4e8b3beb240e350 [0,1,0,0,1,0|2,0,0]=4 1908 B10R1.21 CCCCNc1cccs1 d0e1e22576c5f6dbd0951ff409f4ab02 [0,1,0,0,1,0|2,0,0]=4 1909 B10R1.21 CCCCNc1ccoc1 640322940a87afc9d827bccc7d39ae5e [0,1,0,0,1,0|2,0,0]=4 1910 B10R1.21 CCCCNc1ccsc1 c64d8e4067791c5f42e37c69db44e430 [0,1,0,0,1,0|2,0,0]=4 1911 B10R1.21 CCCCOc1ccco1 69ea1c44ba0b20cb45990b8719447407 [0,1,0,0,1,0|2,0,0]=4 1912 B10R1.21 CCCCOc1cccs1 d524184ff2bb44cbc7ae5ab279df4ef4 [0,1,0,0,1,0|2,0,0]=4 1913 B10R1.21 CCCCOc1ccsc1 770f8463a70d6c9063754e6f8e52cc5c [0,1,0,0,1,0|2,0,0]=4 1914 B10R1.21 CCCNCc1cc[nH]c1 4f9270308a7b6b414b088262dd2b2c1b [0,1,0,0,1,0|2,0,0]=4 1915 B10R1.21 CCCNCc1ccc[nH]1 389a419bddfc3ec4dd8aa13cc5a47be3 [0,1,0,0,1,0|2,0,0]=4 1916 B10R1.21 CCCNCc1ccco1 de6afd493c9d06f3af6e49358fd71eee [0,1,0,0,1,0|2,0,0]=4 1917 B10R1.21 CCCNCc1cccs1 a6b46c4b7b3d26eb24d84a1cd913df52 [0,1,0,0,1,0|2,0,0]=4 1918 B10R1.21 CCCNCc1ccoc1 77a12cc2355259eba3cfabf094f8d919 [0,1,0,0,1,0|2,0,0]=4 1919 B10R1.21 CCCNCc1ccsc1 66232677ec2023d5a802635b8a1a6d73 [0,1,0,0,1,0|2,0,0]=4 1920 B10R1.21 CCCOCc1cc[nH]c1 1c6e3834cbfb57fddc05135d2d1d0cc0 [0,1,0,0,1,0|2,0,0]=4 1921 B10R1.21 CCCOCc1ccc[nH]1 cd7c6439400e4582d3103a4de108225f [0,1,0,0,1,0|2,0,0]=4 1922 B10R1.21 CCCOCc1ccco1 68fddc7fa2e66c072844daffb93c2167 [0,1,0,0,1,0|2,0,0]=4 1923 B10R1.21 CCCOCc1cccs1 a6f03adf2a826c0d56d546cb620a5207 [0,1,0,0,1,0|2,0,0]=4 1924 B10R1.21 CCCOCc1ccoc1 350ab1ab3ec612f4eb7fb879044afc2a [0,1,0,0,1,0|2,0,0]=4 1925 B10R1.21 CCCOCc1ccsc1 c1bc026f3b06598ff523439403fe1fe6 [0,1,0,0,1,0|2,0,0]=4 1926 B10R1.21 CCNCCc1ccc[nH]1 8213ac8e4b9d94b1198a75f34bf94d78 [0,1,0,0,1,0|2,0,0]=4 1927 B10R1.21 CCNCCc1ccco1 1ad917faeddbc2d8d316341d3d41b62a [0,1,0,0,1,0|2,0,0]=4 1928 B10R1.21 CCNCCc1cccs1 f1bb449dfb857924f62fa7b623b4a581 [0,1,0,0,1,0|2,0,0]=4 1929 B10R1.21 CCNCCc1ccsc1 2ea71ee3ba82753ba2a28e730c57ed02 [0,1,0,0,1,0|2,0,0]=4 1930 B10R1.21 CCNCCn1cccc1 d2c2451b9536ba91b7a45cd25defb648 [0,1,0,0,1,0|2,0,0]=4 1931 B10R1.21 CCOCCc1c[nH]cn1 aedba343b36eaee1c14567760ebbcea9 [0,1,0,0,1,0|2,0,0]=4 1932 B10R1.21 CCOCCc1cc[nH]n1 04018fbda8bfe185685a5f55a4225098 [0,1,0,0,1,0|2,0,0]=4 1933 B10R1.21 CCOCCc1ccc[nH]1 8ef61c623e3daff29562378e78c2e3e6 [0,1,0,0,1,0|1,0,0]=3 1934 B10R1.21 CCOCCc1ccco1 bed872e177b1646746b6cb5e6f761166 [0,1,0,0,1,0|1,0,0]=3 1935 B10R1.21 CCOCCc1cccs1 acaaec43fbd0c8ea9b4724789b403b3c [0,1,0,0,1,0|1,0,0]=3 1936 B10R1.21 CCOCCc1ccoc1 036407c3a22d5cc5d73147c1dce3e7e4 [0,1,0,0,1,0|1,0,0]=3 1937 B10R1.21 CCOCCc1ccon1 7d935ca9b30187c624e295d7a3bd3830 [0,1,0,0,1,0|2,0,0]=4 1938 B10R1.21 CCOCCc1ccsc1 ca4812c0bdd5d5c44828e294c88d13c1 [0,1,0,0,1,0|1,0,0]=3 1939 B10R1.21 CCOCCc1cn[nH]c1 887aad48ae6d6990ae2fc264df22acd3 [0,1,0,0,1,0|2,0,0]=4 1940 B10R1.21 CCOCCc1cnoc1 74b82d537593da2024e97b84d80d8fb7 [0,1,0,0,1,0|2,0,0]=4 1941 B10R1.21 CCOCCc1cscn1 1cd5c95d3af30f19b925f6c604b09676 [0,1,0,0,1,0|2,0,0]=4 1942 B10R1.21 CCOCCc1ncc[nH]1 86ab996304566281ad18cdeb99647a8f [0,1,0,0,1,0|2,0,0]=4 1943 B10R1.21 CCOCCc1nccs1 90e0ee1837f8d21c5ec390dafb9ef905 [0,1,0,0,1,0|2,0,0]=4 1944 B10R1.21 CCOCCn1cccc1 b8b6f334754cac390d35c493d0f942fe [0,1,0,0,1,0|1,0,0]=3 1945 B10R1.21 CCOCCn1cccn1 8ba965522a54437e6ed1cca019b603d2 [0,1,0,0,1,0|2,0,0]=4 1946 B10R1.21 CCOCCn1ccnc1 70f935f79cf2dd9c6b1fc42b80178e58 [0,1,0,0,1,0|2,0,0]=4 1947 B10R1.21 CCOCNc1cccs1 fdc9729af7149ad96898b9c1e1995195 [0,1,0,0,1,0|2,0,0]=4 1948 B10R1.21 CCOCNc1ccsc1 b26cc038bdb1c3e6592d9ff0bb4cc274 [0,1,0,0,1,0|2,0,0]=4 1949 B10R1.21 CCOCOc1ccco1 50027f11f0ebc3bb1d65662891127453 [0,1,0,0,1,0|2,0,0]=4 1950 B10R1.21 CCOCOc1cccs1 f1905e8f0a82ed892bc2c970faf9dff2 [0,1,0,0,1,0|2,0,0]=4 1951 B10R1.21 CCOCOc1ccsc1 5f5c6ca2bf7fd5ada01a82ef0afd3e4b [0,1,0,0,1,0|2,0,0]=4 1952 B10R1.21 COCCNc1c[nH]cn1 31b5e19647757b8c8ff224c51156209f [0,1,0,0,1,0|2,0,0]=4 1953 B10R1.21 COCCNc1cc[nH]n1 8e13804df54af8b968ee26c161d84f41 [0,1,0,0,1,0|2,0,0]=4 1954 B10R1.21 COCCNc1ccco1 6446037fd2435f1d5d632a2ea17e6335 [0,1,0,0,1,0|1,0,0]=3 1955 B10R1.21 COCCNc1cccs1 4679346317f357faed462ffad2613f4e [0,1,0,0,1,0|1,0,0]=3 1956 B10R1.21 COCCNc1ccno1 adedf48200497bd8ece47a916d2f6e29 [0,1,0,0,1,0|2,0,0]=4 1957 B10R1.21 COCCNc1ccns1 8f48bedaeef7f2b7f3f76028628ad821 [0,1,0,0,1,0|2,0,0]=4 1958 B10R1.21 COCCNc1ccoc1 9d6bf01177d31be17a28caf95f550025 [0,1,0,0,1,0|1,0,0]=3 1959 B10R1.21 COCCNc1ccon1 6954b7496643468f7475703d0e035c89 [0,1,0,0,1,0|2,0,0]=4 1960 B10R1.21 COCCNc1ccsc1 fa12ac19f0680dbd0ab3feff8ede4d6f [0,1,0,0,1,0|1,0,0]=3 1961 B10R1.21 COCCNc1ccsn1 8f2a607444523eea96d2a2964919bd0a [0,1,0,0,1,0|2,0,0]=4 1962 B10R1.21 COCCNc1cn[nH]c1 a120ece27b0e412b39ff21412d6d529b [0,1,0,0,1,0|2,0,0]=4 1963 B10R1.21 COCCNc1cncs1 89cfbce3ba957eb0c5c8c888455c1a24 [0,1,0,0,1,0|2,0,0]=4 1964 B10R1.21 COCCNc1cnoc1 4eee64cf60d9745e33e54986c9871937 [0,1,0,0,1,0|2,0,0]=4 1965 B10R1.21 COCCNc1cnsc1 a301ebebee021834e2cbd147e1944b55 [0,1,0,0,1,0|2,0,0]=4 1966 B10R1.21 COCCNc1cocn1 158584353c7c2800e7a7976ae871024d [0,1,0,0,1,0|2,0,0]=4 1967 B10R1.21 COCCNc1cscn1 b6ebb9a88d2989f940228f51d24df076 [0,1,0,0,1,0|2,0,0]=4 1968 B10R1.21 COCCNc1ncc[nH]1 e38f19dcac7f98aeb7cbe943254f0b87 [0,1,0,0,1,0|2,0,0]=4 1969 B10R1.21 COCCNc1ncco1 27ef3b5cdb6ddb84737afcdb0a8564a1 [0,1,0,0,1,0|2,0,0]=4 1970 B10R1.21 COCCNc1nccs1 999a710edbc3e1b4131c6168cf4aff5d [0,1,0,0,1,0|2,0,0]=4 1971 B10R1.21 COCCOc1c[nH]cn1 c22d372def312a114ce12682b28da196 [0,1,0,0,1,0|2,0,0]=4 1972 B10R1.21 COCCOc1ccco1 7edab0eeb45cb66520c905082a1511e1 [0,1,0,0,1,0|1,0,0]=3 1973 B10R1.21 COCCOc1cccs1 376aff47162023b820da889700ce60b2 [0,1,0,0,1,0|1,0,0]=3 1974 B10R1.21 COCCOc1ccn[nH]1 36b86c8cb1fcaa39f8e91bc5dc2dd764 [0,1,0,0,1,0|2,0,0]=4 1975 B10R1.21 COCCOc1ccsc1 e986a4921184eaf2e88bed3033e7fa91 [0,1,0,0,1,0|1,0,0]=3 1976 B10R1.21 COCCOc1cn[nH]c1 32a3761e613b38dfd9f782468f4704a1 [0,1,0,0,1,0|2,0,0]=4 1977 B10R1.21 COCCOc1cnoc1 ffaf2a78489e7ef5e920e9f47b40d931 [0,1,0,0,1,0|2,0,0]=4 1978 B10R1.21 COCCOc1nccs1 d38e4915d887bda4d8f4cc1d19b8b69f [0,1,0,0,1,0|2,0,0]=4 1979 B10R1.21 COCCOn1cccn1 ed5cda64fbb03049c23386a66a575e0e [0,1,0,0,1,0|2,0,0]=4 1980 B10R1.21 COCCOn1ccnc1 478b458e1b99b3667a69af98a7e6a502 [0,1,0,0,1,0|2,0,0]=4 1981 B10R1.21 COCNCc1cc[nH]c1 76f00173f5381901b807ffc69f5b23d6 [0,1,0,0,1,0|1,0,0]=3 1982 B10R1.21 COCNCc1ccc[nH]1 beb90f93b0b4d35af75c15067af5f89f [0,1,0,0,1,0|1,0,0]=3 1983 B10R1.21 COCNCc1ccco1 ab0a134b649505be2ef4a9f4f282a23e [0,1,0,0,1,0|1,0,0]=3 1984 B10R1.21 COCNCc1cccs1 75615c372e8efa80d8b79813eacfd51c [0,1,0,0,1,0|1,0,0]=3 1985 B10R1.21 COCNCc1ccn[nH]1 784351bf77eb65c3e998889280b5e72e [0,1,0,0,1,0|2,0,0]=4 1986 B10R1.21 COCNCc1ccno1 15ef8536fda72fd586a760f6b4c8c70d [0,1,0,0,1,0|2,0,0]=4 1987 B10R1.21 COCNCc1ccns1 c93aecfe0d58260c29b387663a42f8a8 [0,1,0,0,1,0|2,0,0]=4 1988 B10R1.21 COCNCc1ccoc1 b9bee659116f1fbfd5e48ad504ac6d3a [0,1,0,0,1,0|1,0,0]=3 1989 B10R1.21 COCNCc1ccon1 7b0726b8ae30de78aa3eea0e48368e4c [0,1,0,0,1,0|2,0,0]=4 1990 B10R1.21 COCNCc1ccsc1 11890153644e1e909af9b7b2120aad7a [0,1,0,0,1,0|1,0,0]=3 1991 B10R1.21 COCNCc1ccsn1 1e48a25f8b06fdc976ba945245ed35bb [0,1,0,0,1,0|2,0,0]=4 1992 B10R1.21 COCNCc1cn[nH]c1 871d3e103689ad546f2cb945621d5173 [0,1,0,0,1,0|2,0,0]=4 1993 B10R1.21 COCNCc1cnco1 0f6f0c3ae363e9893583c8f12ea2cd44 [0,1,0,0,1,0|2,0,0]=4 1994 B10R1.21 COCNCc1cncs1 ed996eb366b53547b37ae8d6853aa6f0 [0,1,0,0,1,0|2,0,0]=4 1995 B10R1.21 COCNCc1cnoc1 5fda05396cfcbba9a088ca2dc438b58e [0,1,0,0,1,0|2,0,0]=4 1996 B10R1.21 COCNCc1cnsc1 a323e51dfe74bff450aed973f98bf433 [0,1,0,0,1,0|2,0,0]=4 1997 B10R1.21 COCNCc1cocn1 aa5fb02551dc1d5f7f2a72b8a48bb34b [0,1,0,0,1,0|2,0,0]=4 1998 B10R1.21 COCNCc1cscn1 bce10801c73dd019748f545bb927f17c [0,1,0,0,1,0|2,0,0]=4 1999 B10R1.21 COCNCc1ncc[nH]1 d722755837fa30e284eb449f205d4537 [0,1,0,0,1,0|2,0,0]=4 2000 B10R1.21 COCNCc1ncco1 d043a8b15ac8e8808dfe091199c948fd [0,1,0,0,1,0|2,0,0]=4 2001 B10R1.21 COCNCc1nccs1 202e41462156ac4af84eb15825fa488f [0,1,0,0,1,0|2,0,0]=4 2002 B10R1.21 COCOCc1cc[nH]c1 5e7354b1e989aa7eb0bc5dc13f8b4885 [0,1,0,0,1,0|1,0,0]=3 2003 B10R1.21 COCOCc1ccc[nH]1 8602fb3b96d0845f62a61e91c638d526 [0,1,0,0,1,0|1,0,0]=3 2004 B10R1.21 COCOCc1ccco1 529eee71e246af8b856ae502514aa81f [0,1,0,0,1,0|1,0,0]=3 2005 B10R1.21 COCOCc1cccs1 8035084dd952e2619b91998ee1e10055 [0,1,0,0,1,0|1,0,0]=3 2006 B10R1.21 COCOCc1ccn[nH]1 784ed237dbb5016d2f5a689a6f4b1d52 [0,1,0,0,1,0|2,0,0]=4 2007 B10R1.21 COCOCc1ccno1 ff01a1e4f50dfacf1f2eb0f4413c32ac [0,1,0,0,1,0|2,0,0]=4 2008 B10R1.21 COCOCc1ccns1 fae7870140bca99c12770471a4e4b7c1 [0,1,0,0,1,0|2,0,0]=4 2009 B10R1.21 COCOCc1ccon1 ff29b1b8d89737fcd8a95436983cc6a5 [0,1,0,0,1,0|2,0,0]=4 2010 B10R1.21 COCOCc1ccsc1 4290534bcd79846327c3dde1810f4ca1 [0,1,0,0,1,0|1,0,0]=3 2011 B10R1.21 COCOCc1ccsn1 b2c63e603f9b324825cbfc1176c52408 [0,1,0,0,1,0|2,0,0]=4 2012 B10R1.21 COCOCc1cn[nH]c1 7283b6cbda74e5b6d53b1dfaef872392 [0,1,0,0,1,0|2,0,0]=4 2013 B10R1.21 COCOCc1cnc[nH]1 f88cd0b210075c480ba31c5a01c8e53b [0,1,0,0,1,0|2,0,0]=4 2014 B10R1.21 COCOCc1cnco1 c11598e267d02c4916b65bfc27609cc0 [0,1,0,0,1,0|2,0,0]=4 2015 B10R1.21 COCOCc1cncs1 4a7506a69d88fbb7a4b9224239c77616 [0,1,0,0,1,0|2,0,0]=4 2016 B10R1.21 COCOCc1cnoc1 40eb355b1d97d1f14c6112a21cddf2c7 [0,1,0,0,1,0|2,0,0]=4 2017 B10R1.21 COCOCc1cnsc1 c7e954d174ed9ed667cdf9ad71f68330 [0,1,0,0,1,0|2,0,0]=4 2018 B10R1.21 COCOCc1cocn1 bedb62e7056b6565bcb94d39499d9e5e [0,1,0,0,1,0|2,0,0]=4 2019 B10R1.21 COCOCc1cscn1 102dc771e3273d6b14435080bb9699d5 [0,1,0,0,1,0|2,0,0]=4 2020 B10R1.21 COCOCc1ncc[nH]1 004647102510bf1bf740a135b7848ae8 [0,1,0,0,1,0|2,0,0]=4 2021 B10R1.21 COCOCc1ncco1 17bdc640c34efccfe1e90b9530eec152 [0,1,0,0,1,0|2,0,0]=4 2022 B10R1.21 COCOCc1nccs1 bdcb85494f3e12978e2f5f2474f894bb [0,1,0,0,1,0|2,0,0]=4 2023 B10R1.21 COCOCn1cccn1 e459438f3f7b93503eb426c5cea0a1f4 [0,1,0,0,1,0|2,0,0]=4 2024 B10R1.21 COCOCn1ccnc1 0db8c8966271f93ddfda54af4b495459 [0,1,0,0,1,0|2,0,0]=4 2025 B10R1.21 CSCCNc1ccco1 16997d2db32ec42d1356855cff785f3f [0,1,0,0,1,0|1,1,0]=4 2026 B10R1.21 CSCCNc1cccs1 01d49ac6e99e11e56f4bd6fc081c9e5f [0,1,0,0,1,0|1,1,0]=4 2027 B10R1.21 CSCCNc1ccoc1 1d0567434f0a48bd98518f53a448361e [0,1,0,0,1,0|1,1,0]=4 2028 B10R1.21 CSCCNc1ccsc1 f6c2dced6fbf754bcf5769e0ac76907b [0,1,0,0,1,0|1,1,0]=4 2029 B10R1.21 CSCCOc1ccco1 5259ce914bbcf53da4292d4e69a6b1eb [0,1,0,0,1,0|1,1,0]=4 2030 B10R1.21 CSCCOc1cccs1 7150bd7e2c4ada0071b0350ef4644150 [0,1,0,0,1,0|1,1,0]=4 2031 B10R1.21 CSCCOc1ccsc1 24a4d86ca0141910d86531f8039bc371 [0,1,0,0,1,0|1,1,0]=4 2032 B10R1.21 CSCNCc1cc[nH]c1 47ed8cd436f09b3013d91e46e1b150cc [0,1,0,0,1,0|1,1,0]=4 2033 B10R1.21 CSCNCc1ccc[nH]1 fd07486fc4e4526a8ba8b2968c8e0c70 [0,1,0,0,1,0|1,1,0]=4 2034 B10R1.21 CSCNCc1ccco1 45b3d80d16b3c23ee837399e5f9cf973 [0,1,0,0,1,0|1,1,0]=4 2035 B10R1.21 CSCNCc1cccs1 19102dc4b21db64523b39a937d0f0fcd [0,1,0,0,1,0|1,1,0]=4 2036 B10R1.21 CSCNCc1ccoc1 9ad7cde6fc8060ab0463b8cc53c45142 [0,1,0,0,1,0|1,1,0]=4 2037 B10R1.21 CSCNCc1ccsc1 5227019be6bbd0bbbe6fefc9148901c2 [0,1,0,0,1,0|1,1,0]=4 2038 B10R1.21 CSCOCc1cc[nH]c1 facfbd7c215ee7ff3015eef21b64acad [0,1,0,0,1,0|1,1,0]=4 2039 B10R1.21 CSCOCc1ccc[nH]1 227018605e900994ca4503decc33cb19 [0,1,0,0,1,0|1,1,0]=4 2040 B10R1.21 CSCOCc1ccco1 d82d2c3aff1c65cd9f5801d7e0281663 [0,1,0,0,1,0|1,1,0]=4 2041 B10R1.21 CSCOCc1cccs1 3cff4a60d95ea1637015dd5821e001bd [0,1,0,0,1,0|1,1,0]=4 2042 B10R1.21 CSCOCc1ccoc1 ba96e166b002fa1da107846027ed2a16 [0,1,0,0,1,0|1,1,0]=4 2043 B10R1.21 CSCOCc1ccsc1 be2d4b9bddf1d383f22e5bca6b2f8053 [0,1,0,0,1,0|1,1,0]=4 2044 B10R1.21 FCNCCc1ccc[nH]1 7f781d01a7bc67bc21d7d7beac4484f1 [0,1,0,0,1,0|2,0,0]=4 2045 B10R1.21 FCNCCc1ccco1 c274e2fe40f74a5250d921378d833f9d [0,1,0,0,1,0|2,0,0]=4 2046 B10R1.21 FCNCCc1cccs1 88ba79d1c29808d8d8edddbef80e3f02 [0,1,0,0,1,0|2,0,0]=4 2047 B10R1.21 FCNCCc1ccsc1 078e8a1eb650ec980524b1574dc15e3e [0,1,0,0,1,0|2,0,0]=4 2048 B10R1.21 FCNCCn1cccc1 402f5d0de25cd5256b0ed7e4d9cf69c0 [0,1,0,0,1,0|2,0,0]=4 2049 B10R1.21 FCOCCc1c[nH]cn1 4d549ea41c918a10f0105a3f3b12fe92 [0,1,0,0,1,0|2,0,0]=4 2050 B10R1.21 FCOCCc1cc[nH]n1 5039ce57e9c2b7193db2734a96d0f629 [0,1,0,0,1,0|2,0,0]=4 2051 B10R1.21 FCOCCc1ccc[nH]1 c9539e478ac1399bce062501fc9ca424 [0,1,0,0,1,0|1,0,0]=3 2052 B10R1.21 FCOCCc1ccco1 b932bcc9cfe884b19a450cd3b0242ac1 [0,1,0,0,1,0|1,0,0]=3 2053 B10R1.21 FCOCCc1cccs1 3cabc60798d0a799d77c6a3a1fd267e4 [0,1,0,0,1,0|1,0,0]=3 2054 B10R1.21 FCOCCc1ccoc1 e77eab8c1d929f532887b6d2fc60e6b0 [0,1,0,0,1,0|1,0,0]=3 2055 B10R1.21 FCOCCc1ccon1 aa3ae114f28661c31ccce8105f15fa76 [0,1,0,0,1,0|2,0,0]=4 2056 B10R1.21 FCOCCc1ccsc1 a19a3727c3d02698fba58a803ae6170e [0,1,0,0,1,0|1,0,0]=3 2057 B10R1.21 FCOCCc1cn[nH]c1 acba981387102a7afc0dd9b4ca2470b0 [0,1,0,0,1,0|2,0,0]=4 2058 B10R1.21 FCOCCc1cnoc1 61a24283abd52d56dfe4aa99b49408f6 [0,1,0,0,1,0|2,0,0]=4 2059 B10R1.21 FCOCCc1cscn1 d4aea58e5a3232319d47219f66e6635e [0,1,0,0,1,0|2,0,0]=4 2060 B10R1.21 FCOCCc1ncc[nH]1 ac062c52e912017f57f4bd334a92ab0a [0,1,0,0,1,0|2,0,0]=4 2061 B10R1.21 FCOCCc1nccs1 452774d96f8ecb2923fc4dbeaad1871b [0,1,0,0,1,0|2,0,0]=4 2062 B10R1.21 FCOCCn1cccc1 53b19cefaea779d5126b463e4453f16e [0,1,0,0,1,0|1,0,0]=3 2063 B10R1.21 FCOCCn1cccn1 2b37a8f1c45d34eb3e86a21498b6c553 [0,1,0,0,1,0|2,0,0]=4 2064 B10R1.21 FCOCCn1ccnc1 c8167190d72c89d919fd8a59ebfed0a8 [0,1,0,0,1,0|2,0,0]=4 2065 B10R1.21 NOCCNc1ccco1 982512c5e2d50fb1ae411cdaf4bf2093 [0,1,0,0,1,0|2,0,0]=4 2066 B10R1.21 NOCCNc1cccs1 69e4d1de354c8d522c3eb86313f8e589 [0,1,0,0,1,0|2,0,0]=4 2067 B10R1.21 NOCCNc1ccoc1 146061510fa0f5793076d9ae116551fd [0,1,0,0,1,0|2,0,0]=4 2068 B10R1.21 NOCCNc1ccsc1 bb60a1df3af9aafc34e1cc94c0a39607 [0,1,0,0,1,0|2,0,0]=4 2069 B10R1.21 OCNCCc1ccc[nH]1 e1c3eae46650a92ca10d84d6e4068368 [0,1,0,0,1,0|2,0,0]=4 2070 B10R1.21 OCNCCc1ccco1 a517e208412caca7f657ad953f1e4b62 [0,1,0,0,1,0|2,0,0]=4 2071 B10R1.21 OCNCCc1cccs1 1b8ef25e4acd5b269ce70b8ca5f424ab [0,1,0,0,1,0|2,0,0]=4 2072 B10R1.21 OCNCCc1ccsc1 fbedc51742e1bca48984479dc3c8fec2 [0,1,0,0,1,0|2,0,0]=4 2073 B10R1.21 OCNCCn1cccc1 ffae6d28a24a6c4800c8cb0eaea07bd0 [0,1,0,0,1,0|2,0,0]=4 2074 B10R1.29 COCNc1ccsc1C 3b6f44b0065f692a170f9d5d75bd7ace [0,1,0,0,1,0|2,0,0]=4 2075 B10R1.29 COCNc1cscc1Br 82219b5c5311189ae3d9a4c23c9cd7df [0,1,0,0,1,0|2,0,0]=4 2076 B10R1.29 COCNc1cscc1C 7f6ebbdc548d3c2a37e01b274cb3ae85 [0,1,0,0,1,0|2,0,0]=4 2077 B10R1.29 COCOc1cccn1C ca535af67b7be7436148db7b2bbc60b4 [0,1,0,0,1,0|2,0,0]=4 2078 B12R1.18 CCCNc1cccccc1=O 09505d7ac1be0a057eeab434bb2dc286 [0,1,0,0,0,1|2,0,0]=4 2079 B12R1.18 CCCOc1cccccc1=O c6bf279e24481c309b0f02f4f9001ec6 [0,1,0,0,0,1|2,0,0]=4 2080 B12R1.18 CSCOc1cccccc1=O 9a727aaaef4ab54fe409f984583485c4 [0,1,0,0,0,1|1,1,0]=4 2081 B12R1.1 BrCCNCc1ccc(cc1)Br 20450213ce8b054b984ff490a50ef1fa [0,2,0,0,0,0|2,0,0]=4 2082 B12R1.1 BrCCNCc1ccc(cc1)I cb0bc4759e46ae9c4f093aeccd44029f [0,2,0,0,0,0|2,0,0]=4 2083 B12R1.1 Brc1ccc(cc1)CNCCI 73ba4c9bc494173a2854cf80c7bda7f2 [0,2,0,0,0,0|2,0,0]=4 2084 B12R1.1 C#CCCNc1ccc(cc1)Br 48d9f4a3333d3fe4fe53df3108ca7bbf [0,2,0,0,0,0|1,0,1]=4 2085 B12R1.1 C#CCCNc1ccc(cc1)C 72825946d0b2a2742246d8ec9bdc7501 [0,2,0,0,0,0|1,0,1]=4 2086 B12R1.1 C#CCCNc1ccc(cc1)Cl 0c9d4d8d8affbd9f180238845f9dc28a [0,2,0,0,0,0|1,0,1]=4 2087 B12R1.1 C#CCCNc1ccc(cc1)F b585ec89ea66d2e64e2c70d23d965742 [0,2,0,0,0,0|1,0,1]=4 2088 B12R1.1 C#CCCNc1ccc(cc1)I 992c9b3bfec4451c143f4f3fdef713ab [0,2,0,0,0,0|1,0,1]=4 2089 B12R1.1 C#CCCNc1ccc(cc1)S 15160346b9d9dd2eeccbdd6ed204e709 [0,2,0,0,0,0|1,0,1]=4 2090 B12R1.1 C#CCCOc1ccc(cc1)Br 90bab65f218a5293355c3414096f31e9 [0,2,0,0,0,0|1,0,1]=4 2091 B12R1.1 C#CCCOc1ccc(cc1)C 4ae39eaec668d523d73862b8a291a305 [0,2,0,0,0,0|1,0,1]=4 2092 B12R1.1 C#CCCOc1ccc(cc1)Cl 2358efe1f73084d5fc80339ce416d124 [0,2,0,0,0,0|1,0,1]=4 2093 B12R1.1 C#CCCOc1ccc(cc1)F d24851604e1430614941720de9040a9d [0,2,0,0,0,0|1,0,1]=4 2094 B12R1.1 C#CCCOc1ccc(cc1)I 6f2b9f67797a38e7a90ffde44e28683b [0,2,0,0,0,0|1,0,1]=4 2095 B12R1.1 C#CCCOc1ccc(cc1)S 1cb91c34fea1afe7df12981e91a38ca2 [0,2,0,0,0,0|1,0,1]=4 2096 B12R1.1 C#CCNCc1ccc(cc1)Br e2290f3b331a657082e9e95da9693e91 [0,2,0,0,0,0|1,0,1]=4 2097 B12R1.1 C#CCNCc1ccc(cc1)C 2a994c80798dee310861034c22837f00 [0,2,0,0,0,0|1,0,1]=4 2098 B12R1.1 C#CCNCc1ccc(cc1)Cl fa35d0bae050d5429106b0f12bde4120 [0,2,0,0,0,0|1,0,1]=4 2099 B12R1.1 C#CCNCc1ccc(cc1)F 71930675a8eed580c35cd02db4f7b93f [0,2,0,0,0,0|1,0,1]=4 2100 B12R1.1 C#CCNCc1ccc(cc1)I 10e4dba8184cba76f141431a9bf7d509 [0,2,0,0,0,0|1,0,1]=4 2101 B12R1.1 C#CCOCc1ccc(cc1)Br b15ea64acc335332bbd0140632abdedf [0,2,0,0,0,0|1,0,1]=4 2102 B12R1.1 C#CCOCc1ccc(cc1)C 6e4005fd7d6c453041aa068a9edf9af0 [0,2,0,0,0,0|1,0,1]=4 2103 B12R1.1 C#CCOCc1ccc(cc1)Cl 0b4792dfdd64f7ae9ca32ac81e6c76a7 [0,2,0,0,0,0|1,0,1]=4 2104 B12R1.1 C#CCOCc1ccc(cc1)F 7ac7615cdc05bcfb0a77160e928407fb [0,2,0,0,0,0|1,0,1]=4 2105 B12R1.1 C#CCOCc1ccc(cc1)I cab7864b2bff2234123569293c81687d [0,2,0,0,0,0|1,0,1]=4 2106 B12R1.1 C#CCOCc1ccc(cc1)S dcd7e06bb7d12dcf2d872f5d7fd878bd [0,2,0,0,0,0|1,0,1]=4 2107 B12R1.1 C/C=C/CNc1ccc(cc1)Br e9d79593c873a13ad8a6bafcc81e85e6 [0,2,0,0,0,0|1,0,1]=4 2108 B12R1.1 C/C=C/CNc1ccc(cc1)C 117fb35c32f4fcd90d489486214b8fdf [0,2,0,0,0,0|1,0,1]=4 2109 B12R1.1 C/C=C/CNc1ccc(cc1)Cl 467057be232b55430c088b3b08c0a906 [0,2,0,0,0,0|1,0,1]=4 2110 B12R1.1 C/C=C/CNc1ccc(cc1)F 5c4bd221a3da9a4f95f1eacac352b50c [0,2,0,0,0,0|1,0,1]=4 2111 B12R1.1 C/C=C/CNc1ccc(cc1)I e1b61c378e7295bca2584f113cd07198 [0,2,0,0,0,0|1,0,1]=4 2112 B12R1.1 C/C=C/CNc1ccc(cc1)S b21df545969e011054ac00e4feebe28e [0,2,0,0,0,0|1,0,1]=4 2113 B12R1.1 C/C=C/COc1ccc(cc1)Br 26ecc795fd1981af41457d9e3ad18ced [0,2,0,0,0,0|1,0,1]=4 2114 B12R1.1 C/C=C/COc1ccc(cc1)C f8d69d24da03e61b44e653ec4867d71f [0,2,0,0,0,0|1,0,1]=4 2115 B12R1.1 C/C=C/COc1ccc(cc1)Cl 3ce58a05b75f6368eff8d88fe226452e [0,2,0,0,0,0|1,0,1]=4 2116 B12R1.1 C/C=C/COc1ccc(cc1)F 91730cc9eb30130ee9e655cedd7da81e [0,2,0,0,0,0|1,0,1]=4 2117 B12R1.1 C/C=C/COc1ccc(cc1)I b881dc53dafdfb1bf15165b68942a173 [0,2,0,0,0,0|1,0,1]=4 2118 B12R1.1 C/C=C/COc1ccc(cc1)S fa0d4e800768238c75ac4b429285c91b [0,2,0,0,0,0|1,0,1]=4 2119 B12R1.1 C/C=C\CNc1ccc(cc1)Br 96e01a5586b993be8cb1adece25a7ac4 [0,2,0,0,0,0|1,0,1]=4 2120 B12R1.1 C/C=C\CNc1ccc(cc1)C e4135b47a2c2aba20230ba272853902b [0,2,0,0,0,0|1,0,1]=4 2121 B12R1.1 C/C=C\CNc1ccc(cc1)Cl 176adb130153a94d2957d935a9efceb3 [0,2,0,0,0,0|1,0,1]=4 2122 B12R1.1 C/C=C\CNc1ccc(cc1)F 05f4bf8e58a65d666328222853478aee [0,2,0,0,0,0|1,0,1]=4 2123 B12R1.1 C/C=C\CNc1ccc(cc1)I a16e71f2932f3bd8c40d37c9a12ea2cb [0,2,0,0,0,0|1,0,1]=4 2124 B12R1.1 C/C=C\CNc1ccc(cc1)S babf17c94680dd70befc5ec2c0d17a5a [0,2,0,0,0,0|1,0,1]=4 2125 B12R1.1 C/C=C\COc1ccc(cc1)Br 932a92de9934dbed970c282c28c7e041 [0,2,0,0,0,0|1,0,1]=4 2126 B12R1.1 C/C=C\COc1ccc(cc1)C 3a708db0a3ff03fe131be8835427e3d6 [0,2,0,0,0,0|1,0,1]=4 2127 B12R1.1 C/C=C\COc1ccc(cc1)Cl 4d1f69e87809aa08d9775150a61530ec [0,2,0,0,0,0|1,0,1]=4 2128 B12R1.1 C/C=C\COc1ccc(cc1)F 5cb2bf3d08583ea0caef753401664318 [0,2,0,0,0,0|1,0,1]=4 2129 B12R1.1 C/C=C\COc1ccc(cc1)I eb94fd237cb188efafef86a4d82db7c0 [0,2,0,0,0,0|1,0,1]=4 2130 B12R1.1 C/C=C\COc1ccc(cc1)S 52b354367f01642f2d2a23fc34cbacd8 [0,2,0,0,0,0|1,0,1]=4 2131 B12R1.1 C=CCCNc1ccc(cc1)Br a8dddaaa42aff058b50ec664d48f6bac [0,2,0,0,0,0|1,0,1]=4 2132 B12R1.1 C=CCCNc1ccc(cc1)C 9faa2995fb33053f6ac559d1ed03e90d [0,2,0,0,0,0|1,0,1]=4 2133 B12R1.1 C=CCCNc1ccc(cc1)Cl 81b76ee632ac6ec6ab1bfceb3501f2b1 [0,2,0,0,0,0|1,0,1]=4 2134 B12R1.1 C=CCCNc1ccc(cc1)F 08817bd031d1061648352aa5f20acd40 [0,2,0,0,0,0|1,0,1]=4 2135 B12R1.1 C=CCCNc1ccc(cc1)I e8c90f380a0392fb3cebc9407ec04946 [0,2,0,0,0,0|1,0,1]=4 2136 B12R1.1 C=CCCNc1ccc(cc1)S f64767463bb0a521a7682840fe3edafd [0,2,0,0,0,0|1,0,1]=4 2137 B12R1.1 C=CCCOc1ccc(cc1)Br 94e47812df2545d86d3331d62576b75a [0,2,0,0,0,0|1,0,1]=4 2138 B12R1.1 C=CCCOc1ccc(cc1)C e6edc605179aa4448840cba8a7447b15 [0,2,0,0,0,0|1,0,1]=4 2139 B12R1.1 C=CCCOc1ccc(cc1)Cl 7d728c077286285b288dca86fc0d5079 [0,2,0,0,0,0|1,0,1]=4 2140 B12R1.1 C=CCCOc1ccc(cc1)F ca048b3d1d394f37c6780234634cb8de [0,2,0,0,0,0|1,0,1]=4 2141 B12R1.1 C=CCCOc1ccc(cc1)I 0a15f4b884f20a07befbc3b00bf98b27 [0,2,0,0,0,0|1,0,1]=4 2142 B12R1.1 C=CCCOc1ccc(cc1)S af8f852bbe8e5fa3d393a0db10976745 [0,2,0,0,0,0|1,0,1]=4 2143 B12R1.1 C=CCNCc1ccc(cc1)Br 355888b8a681d37256ffb8d298cf9aa8 [0,2,0,0,0,0|1,0,1]=4 2144 B12R1.1 C=CCNCc1ccc(cc1)C 1f36d3f8cd3b4d49cc5d62116694f44c [0,2,0,0,0,0|1,0,1]=4 2145 B12R1.1 C=CCNCc1ccc(cc1)Cl 11dd62e0bdbf8473fd23bb5a59a1eacd [0,2,0,0,0,0|1,0,1]=4 2146 B12R1.1 C=CCNCc1ccc(cc1)F 4d15be72f4754e46cab059d70d4be76e [0,2,0,0,0,0|1,0,1]=4 2147 B12R1.1 C=CCNCc1ccc(cc1)I 64a314ec4eebdd83c9147d05f0ab94cb [0,2,0,0,0,0|1,0,1]=4 2148 B12R1.1 C=CCOCc1ccc(cc1)Br 806248abe044909b3a432df0318fdee3 [0,2,0,0,0,0|1,0,1]=4 2149 B12R1.1 C=CCOCc1ccc(cc1)C 47e939dbfe8054deecfaba3a3473809c [0,2,0,0,0,0|1,0,1]=4 2150 B12R1.1 C=CCOCc1ccc(cc1)Cl 4bee8fab81d49d42f63eed8509aab6f8 [0,2,0,0,0,0|1,0,1]=4 2151 B12R1.1 C=CCOCc1ccc(cc1)F 1136f707ffa1d7dac49d2390d75678ef [0,2,0,0,0,0|1,0,1]=4 2152 B12R1.1 C=CCOCc1ccc(cc1)I e2d7f8d7c9a07d80e150e5bd46ee65a0 [0,2,0,0,0,0|1,0,1]=4 2153 B12R1.1 C=CCOCc1ccc(cc1)S a094ba0073c77bfa2ed05d47548d1bf3 [0,2,0,0,0,0|1,0,1]=4 2154 B12R1.1 CC=CCNc1ccc(cc1)C d117377d9afde8cadbf219f6c96c4cdd [0,2,0,0,0,0|1,0,1]=4 2155 B12R1.1 CC=CCNc1ccc(cc1)F 04e3464eea2c1dda13c70e8427cd77b2 [0,2,0,0,0,0|1,0,1]=4 2156 B12R1.1 CC=CCNc1ccc(cc1)O e6664ac98f0809d499103c3ffca72e3d [0,2,0,0,0,0|1,0,1]=4 2157 B12R1.1 CC=CCNc1ccc(cc1)S c6abfc26577d70ee04f2466186b1b7af [0,2,0,0,0,0|1,0,1]=4 2158 B12R1.1 CCCCNc1ccc(=O)[nH]c1 02a79ca1969806667926017962f8be99 [0,2,0,0,0,0|2,0,0]=4 2159 B12R1.1 CCCCNc1ccc(cc1)Br e89341169cbc44b59d16faec024cd1cb [0,2,0,0,0,0|1,0,0]=3 2160 B12R1.1 CCCCNc1ccc(cc1)C 0509e0e75b6937a8ea7e0f62aa8886c7 [0,2,0,0,0,0|1,0,0]=3 2161 B12R1.1 CCCCNc1ccc(cc1)Cl 1775dd898ae9be4c4106930801b27a2f [0,2,0,0,0,0|1,0,0]=3 2162 B12R1.1 CCCCNc1ccc(cc1)F 205012603421f378155c17b633b33114 [0,2,0,0,0,0|1,0,0]=3 2163 B12R1.1 CCCCNc1ccc(cc1)I 92f4d6d08bf3c52ef14290fb1084639a [0,2,0,0,0,0|1,0,0]=3 2164 B12R1.1 CCCCNc1ccc(cc1)S 74533acd090bd71f2b34f5065040b599 [0,2,0,0,0,0|1,0,0]=3 2165 B12R1.1 CCCCNc1ccc(cn1)Br 2147d0487acab31419a643db0484fa62 [0,2,0,0,0,0|2,0,0]=4 2166 B12R1.1 CCCCNc1ccc(cn1)C 998adba6fba82ff0970d6030353c7365 [0,2,0,0,0,0|2,0,0]=4 2167 B12R1.1 CCCCNc1ccc(cn1)Cl 042111bb41580bf256eb9f12ba97b780 [0,2,0,0,0,0|2,0,0]=4 2168 B12R1.1 CCCCNc1ccc(cn1)F 746733710bba02fd4d704c1e085b8b50 [0,2,0,0,0,0|2,0,0]=4 2169 B12R1.1 CCCCNc1ccc(cn1)I 0047bdc6626e6145afb77fb61f2e6165 [0,2,0,0,0,0|2,0,0]=4 2170 B12R1.1 CCCCNc1ccc(nc1)Br 03175bcde4b54162bbf246fba10395a8 [0,2,0,0,0,0|2,0,0]=4 2171 B12R1.1 CCCCNc1ccc(nc1)C cfc8492ab8a121a11fbcba16a1747a17 [0,2,0,0,0,0|2,0,0]=4 2172 B12R1.1 CCCCNc1ccc(nc1)Cl 571e53e10e8cb1d62f214726f101dfe1 [0,2,0,0,0,0|2,0,0]=4 2173 B12R1.1 CCCCNc1ccc(nc1)F 0b3ebaf1b1b3f43bf02ddb3b8b9cba97 [0,2,0,0,0,0|2,0,0]=4 2174 B12R1.1 CCCCNc1ccc(nc1)I 7c29fa746193ba14b69f78a98be6bb00 [0,2,0,0,0,0|2,0,0]=4 2175 B12R1.1 CCCCOc1ccc(cc1)Br 8eb0c018af7c0260ba3c2a30117b04a8 [0,2,0,0,0,0|1,0,0]=3 2176 B12R1.1 CCCCOc1ccc(cc1)C 279c306997ac21401db621e075a1234e [0,2,0,0,0,0|1,0,0]=3 2177 B12R1.1 CCCCOc1ccc(cc1)Cl 7d5544a2fd61c6804d0b5f9a5dcaff5e [0,2,0,0,0,0|1,0,0]=3 2178 B12R1.1 CCCCOc1ccc(cc1)F 267efa67a22e96e8517f1d16b28b6cda [0,2,0,0,0,0|1,0,0]=3 2179 B12R1.1 CCCCOc1ccc(cc1)I 576e978d44aba041bf60b2e8c0ca77dc [0,2,0,0,0,0|1,0,0]=3 2180 B12R1.1 CCCCOc1ccc(cc1)S 32b0d10568509e9aba7b8b876a1dcd97 [0,2,0,0,0,0|1,0,0]=3 2181 B12R1.1 CCCCOc1ccc(cn1)C 73f80a64d75c76f1625ecd7b6bf60afd [0,2,0,0,0,0|2,0,0]=4 2182 B12R1.1 CCCCOc1ccc(cn1)Cl 2f3f36b0755b6968d932427b919a5191 [0,2,0,0,0,0|2,0,0]=4 2183 B12R1.1 CCCCOc1ccc(cn1)F 714f99d2bf60a4e198c8d7fc7d3992d6 [0,2,0,0,0,0|2,0,0]=4 2184 B12R1.1 CCCCOc1ccc(cn1)I 7a11f6fcbd5b72cfe1708e440ade4c11 [0,2,0,0,0,0|2,0,0]=4 2185 B12R1.1 CCCCOc1ccc(nc1)Br edb7642f5597a5dbfa6d9f7163f9d53f [0,2,0,0,0,0|2,0,0]=4 2186 B12R1.1 CCCCOc1ccc(nc1)C 4c062804bd5d363b81cb36e3fd4cfb06 [0,2,0,0,0,0|2,0,0]=4 2187 B12R1.1 CCCCOc1ccc(nc1)Cl 0bc8dbabaffb09d392f3692c89f0a74d [0,2,0,0,0,0|2,0,0]=4 2188 B12R1.1 CCCCOc1ccc(nc1)F 3a0976877ce97243ef82f159d6a097b4 [0,2,0,0,0,0|2,0,0]=4 2189 B12R1.1 CCCCOc1ccc(nc1)I 8140092992cfe9c6902291788a1266f6 [0,2,0,0,0,0|2,0,0]=4 2190 B12R1.1 CCCNCc1ccc(=O)[nH]c1 7538f417ad561b957ce036f792a167ba [0,2,0,0,0,0|2,0,0]=4 2191 B12R1.1 CCCNCc1ccc(cc1)Br 6d7acb5c1d6eb4035cfecd636670ec88 [0,2,0,0,0,0|1,0,0]=3 2192 B12R1.1 CCCNCc1ccc(cc1)C 821f67acfdb50b145a70c837e9673303 [0,2,0,0,0,0|1,0,0]=3 2193 B12R1.1 CCCNCc1ccc(cc1)Cl a02313d9aa520f59216ac1ef5bf23381 [0,2,0,0,0,0|1,0,0]=3 2194 B12R1.1 CCCNCc1ccc(cc1)F 788f6e4abed6506e1bd98834e24d71da [0,2,0,0,0,0|1,0,0]=3 2195 B12R1.1 CCCNCc1ccc(cc1)I 25058b9c523bb9b3441cc38523ac0681 [0,2,0,0,0,0|1,0,0]=3 2196 B12R1.1 CCCNCc1ccc(cn1)Br ce6bf34b40a640b4111b2e5163e26705 [0,2,0,0,0,0|2,0,0]=4 2197 B12R1.1 CCCNCc1ccc(cn1)C 0859440e6ab41c7baa50b4dbb7bfaf38 [0,2,0,0,0,0|2,0,0]=4 2198 B12R1.1 CCCNCc1ccc(cn1)Cl 518b2eeb37bf5f7f7618b8da0a2f2225 [0,2,0,0,0,0|2,0,0]=4 2199 B12R1.1 CCCNCc1ccc(cn1)F 1bb258a69067a228981a13b7c8ffa600 [0,2,0,0,0,0|2,0,0]=4 2200 B12R1.1 CCCNCc1ccc(nc1)Br 98a2a9f55c0e6a24dfd04ba8e737f4fe [0,2,0,0,0,0|2,0,0]=4 2201 B12R1.1 CCCNCc1ccc(nc1)C 0861f89260ac0b04cea33d150d25c2c7 [0,2,0,0,0,0|2,0,0]=4 2202 B12R1.1 CCCNCc1ccc(nc1)Cl 9f529880edca32193f0a62a30cf0afb2 [0,2,0,0,0,0|2,0,0]=4 2203 B12R1.1 CCCNCc1ccc(nc1)F bd740dfa814b0679fc0c7f702414e823 [0,2,0,0,0,0|2,0,0]=4 2204 B12R1.1 CCCOCc1cc[n+](cc1)[O-] b301fdbcacf119c101f8a1e22f942cbe [0,2,0,0,0,0|2,0,0]=4 2205 B12R1.1 CCCOCc1ccc(cc1)Br 809153d8a160030943d450bde94926b3 [0,2,0,0,0,0|1,0,0]=3 2206 B12R1.1 CCCOCc1ccc(cc1)C cdf710de7aab36c209d4f1e83badcc9f [0,2,0,0,0,0|1,0,0]=3 2207 B12R1.1 CCCOCc1ccc(cc1)Cl 2e02717de8c7d8c7b558a4e515a34b08 [0,2,0,0,0,0|1,0,0]=3 2208 B12R1.1 CCCOCc1ccc(cc1)F 0b046f7636661272767e3d62ac05dc4e [0,2,0,0,0,0|1,0,0]=3 2209 B12R1.1 CCCOCc1ccc(cc1)I 93d3c433bb8fbd6d9bf77528cb7bdc86 [0,2,0,0,0,0|1,0,0]=3 2210 B12R1.1 CCCOCc1ccc(cc1)S 430871fe1cf3c8f148963d62cce89de2 [0,2,0,0,0,0|1,0,0]=3 2211 B12R1.1 CCCOCc1ccc(cn1)Br 49b2165de8bf470f908d401448c5b410 [0,2,0,0,0,0|2,0,0]=4 2212 B12R1.1 CCCOCc1ccc(cn1)C ff405956dedef2634c60e1436e98f714 [0,2,0,0,0,0|2,0,0]=4 2213 B12R1.1 CCCOCc1ccc(cn1)Cl 73222df82ad400a79f3ed27e070a7524 [0,2,0,0,0,0|2,0,0]=4 2214 B12R1.1 CCCOCc1ccc(cn1)F 47efbedbe7a90cd69d4a967f412f2768 [0,2,0,0,0,0|2,0,0]=4 2215 B12R1.1 CCCOCc1ccc(cn1)I 4983eead99cd391642e4ce62b61f7868 [0,2,0,0,0,0|2,0,0]=4 2216 B12R1.1 CCCOCc1ccc(nc1)Br 5986c242d7c14820af1b46ea82277777 [0,2,0,0,0,0|2,0,0]=4 2217 B12R1.1 CCCOCc1ccc(nc1)C 916d4ce8b149ccc705c0ba761cb705cc [0,2,0,0,0,0|2,0,0]=4 2218 B12R1.1 CCCOCc1ccc(nc1)Cl 1a3c2f03dd347e64a0cd18252287212e [0,2,0,0,0,0|2,0,0]=4 2219 B12R1.1 CCCOCc1ccc(nc1)F 924d4c24e4b904e8e6dc77785e7bf92a [0,2,0,0,0,0|2,0,0]=4 2220 B12R1.1 CCNCCc1ccc(cc1)Br c1e1856c8e561693e17b3fba9688bb01 [0,2,0,0,0,0|1,0,0]=3 2221 B12R1.1 CCNCCc1ccc(cc1)C 9668e7887400d136ec1e3eb391085876 [0,2,0,0,0,0|1,0,0]=3 2222 B12R1.1 CCNCCc1ccc(cc1)Cl 8e5264010838622c7519fd0dcde4d0b4 [0,2,0,0,0,0|1,0,0]=3 2223 B12R1.1 CCNCCc1ccc(cc1)F 1a1f9ac0f1e5162cebd8c21d993978c3 [0,2,0,0,0,0|1,0,0]=3 2224 B12R1.1 CCNCCc1ccc(cc1)I a943177ded045228b7557ed18509fc40 [0,2,0,0,0,0|1,0,0]=3 2225 B12R1.1 CCNCCc1ccc(cn1)Br 071a48b22deb6b821a1caa4a94f022f3 [0,2,0,0,0,0|2,0,0]=4 2226 B12R1.1 CCNCCc1ccc(nc1)Br 40501d04b290bcc6bd2ecdbd3d864206 [0,2,0,0,0,0|2,0,0]=4 2227 B12R1.1 CCNCCc1ccc(nc1)C da0b9278676dd0fba6c61fc0ed22f989 [0,2,0,0,0,0|2,0,0]=4 2228 B12R1.1 CCNCCc1ccc(nc1)Cl 0cc577b224a2d134852779de1dd40420 [0,2,0,0,0,0|2,0,0]=4 2229 B12R1.1 CCOCCc1ccc(cc1)Br 373b968b1c2796bb8ccc0d6636f1b3d3 [0,2,0,0,0,0|0,0,0]=2 2230 B12R1.1 CCOCCc1ccc(cc1)C 42e633922cb44e7ff341e38a29688961 [0,2,0,0,0,0|0,0,0]=2 2231 B12R1.1 CCOCCc1ccc(cc1)Cl 724e191c5f6d1be9c5d9a12f103488fa [0,2,0,0,0,0|0,0,0]=2 2232 B12R1.1 CCOCCc1ccc(cc1)F fd874c97516f9d501a7a7d365142f992 [0,2,0,0,0,0|0,0,0]=2 2233 B12R1.1 CCOCCc1ccc(cc1)I e2ec89c0bf90f2dda962bfa898555cdd [0,2,0,0,0,0|0,0,0]=2 2234 B12R1.1 CCOCCc1ccc(cn1)Br 4da8f1abec1823983ba9123c240ed526 [0,2,0,0,0,0|1,0,0]=3 2235 B12R1.1 CCOCCc1ccc(cn1)C f8bfa9a6b9c5cf25e679ebe20d4c34d1 [0,2,0,0,0,0|1,0,0]=3 2236 B12R1.1 CCOCCc1ccc(cn1)F 3104047a4d03b030dadc14553fe02c80 [0,2,0,0,0,0|1,0,0]=3 2237 B12R1.1 CCOCCc1ccc(nc1)Br 77c550d44806648781a348047e80994f [0,2,0,0,0,0|1,0,0]=3 2238 B12R1.1 CCOCCc1ccc(nc1)C d2cbfdfb1b149499f3a63e1ec7ca2e87 [0,2,0,0,0,0|1,0,0]=3 2239 B12R1.1 CCOCCc1ccc(nc1)Cl cc1500b445b266c7e229a33c575d1f83 [0,2,0,0,0,0|1,0,0]=3 2240 B12R1.1 CCOCCc1ccc(nc1)F 21d533bb352b69aa08b705a9a98802c5 [0,2,0,0,0,0|1,0,0]=3 2241 B12R1.1 CCOCCc1cnc(nc1)Cl 57bf1dd6b60592ae0bcaad498a3d17b7 [0,2,0,0,0,0|2,0,0]=4 2242 B12R1.1 CCOCCc1ncc(cn1)Br b41735d6bdaa47066712f76e8c99df06 [0,2,0,0,0,0|2,0,0]=4 2243 B12R1.1 CCOCNc1ccc(=O)[nH]c1 ab09dfacfd46837650b475c3da1497ba [0,2,0,0,0,0|2,0,0]=4 2244 B12R1.1 CCOCNc1ccc(cc1)Br 4ee5ca282eba946fa39404fb9f2e2f49 [0,2,0,0,0,0|1,0,0]=3 2245 B12R1.1 CCOCNc1ccc(cc1)C 40728cee7584de662c92ec4d4f9f2bce [0,2,0,0,0,0|1,0,0]=3 2246 B12R1.1 CCOCNc1ccc(cc1)Cl d0dbb68cddbf57bccc516d9c4f88982a [0,2,0,0,0,0|1,0,0]=3 2247 B12R1.1 CCOCNc1ccc(cc1)F 6741493e952a075c24d7387b1a13f85c [0,2,0,0,0,0|1,0,0]=3 2248 B12R1.1 CCOCNc1ccc(cc1)I 98926b4f8768901e7cec2d6a87d3ecb7 [0,2,0,0,0,0|1,0,0]=3 2249 B12R1.1 CCOCNc1ccc(cc1)S cebbce0e1e667215a01e85034183120b [0,2,0,0,0,0|1,0,0]=3 2250 B12R1.1 CCOCNc1ccc(cn1)C f5772f37de2a2ea2043bf8a4113a58e4 [0,2,0,0,0,0|2,0,0]=4 2251 B12R1.1 CCOCNc1ccc(cn1)I 83da325f98e749e3d9037a936828200c [0,2,0,0,0,0|2,0,0]=4 2252 B12R1.1 CCOCNc1ccc(nc1)Br ec126696984a1173abb5296c44c83800 [0,2,0,0,0,0|2,0,0]=4 2253 B12R1.1 CCOCNc1ccc(nc1)C 267d8596f736daddb702365b7eb8476f [0,2,0,0,0,0|2,0,0]=4 2254 B12R1.1 CCOCNc1ccc(nc1)Cl ff482724d6db6c1b5defa6bda0419b1a [0,2,0,0,0,0|2,0,0]=4 2255 B12R1.1 CCOCNc1ccc(nc1)F b4b54a87660cd51660e70ebcae66b8b3 [0,2,0,0,0,0|2,0,0]=4 2256 B12R1.1 CCOCOc1ccc(cc1)C 7ff79dea53674124be82709c4597b73f [0,2,0,0,0,0|1,0,0]=3 2257 B12R1.1 CCOCOc1ccc(cc1)F 50357452ef2cbab5421b2c59afb55a46 [0,2,0,0,0,0|1,0,0]=3 2258 B12R1.1 CCOCOc1ccc(cc1)I a2fff1ccbab39ecbcb6c924c73f9242f [0,2,0,0,0,0|1,0,0]=3 2259 B12R1.1 CCOCOc1ccc(nc1)F 6a35de2caa7b327c4ad6edc85d3834e3 [0,2,0,0,0,0|2,0,0]=4 2260 B12R1.1 COCCNc1c[nH]c(=S)cn1 34785b721ff2231183888f83e0ed652d [0,2,0,0,0,0|2,0,0]=4 2261 B12R1.1 COCCNc1cc[n+](cc1)[O-] 8df1e5f26764e7d16e45b2e81d1c413f [0,2,0,0,0,0|1,0,0]=3 2262 B12R1.1 COCCNc1ccc(=O)[nH]c1 2658be545f60feb81fc0fe240399c7b2 [0,2,0,0,0,0|1,0,0]=3 2263 B12R1.1 COCCNc1ccc(=O)oc1 082bf48eef0cc5837b61aadc07e7d747 [0,2,0,0,0,0|1,0,0]=3 2264 B12R1.1 COCCNc1ccc(cc1)Br 2d926fbb1fcdd16bacc6f211d0fcfb4e [0,2,0,0,0,0|0,0,0]=2 2265 B12R1.1 COCCNc1ccc(cc1)C 74fbcfec57bd0edf1bc5b11b7509662c [0,2,0,0,0,0|0,0,0]=2 2266 B12R1.1 COCCNc1ccc(cc1)Cl af73116263228e2b54dd7e7b16a6a3a1 [0,2,0,0,0,0|0,0,0]=2 2267 B12R1.1 COCCNc1ccc(cc1)F a4e8c5020277e3ea67e453e11663517f [0,2,0,0,0,0|0,0,0]=2 2268 B12R1.1 COCCNc1ccc(cc1)I 043a7b95c30b748da12a71766d6e5d51 [0,2,0,0,0,0|0,0,0]=2 2269 B12R1.1 COCCNc1ccc(cc1)O df6722b40212b9f51eec6a88b45d31aa [0,2,0,0,0,0|0,0,0]=2 2270 B12R1.1 COCCNc1ccc(cc1)S 5c0c330b3d01b6a4f1cb1b35b6bc670a [0,2,0,0,0,0|0,0,0]=2 2271 B12R1.1 COCCNc1ccc(cn1)Br deaba88b45a644de34ea2cfea007e007 [0,2,0,0,0,0|1,0,0]=3 2272 B12R1.1 COCCNc1ccc(cn1)C 007698baeb5f195743191a9f71971722 [0,2,0,0,0,0|1,0,0]=3 2273 B12R1.1 COCCNc1ccc(cn1)Cl c3ac47963e38142d5204c0bfeb95e232 [0,2,0,0,0,0|1,0,0]=3 2274 B12R1.1 COCCNc1ccc(cn1)F f762f45dc64dea0ba1842fef1445e94e [0,2,0,0,0,0|1,0,0]=3 2275 B12R1.1 COCCNc1ccc(cn1)I 54360701a034983285b4ecfc45d90891 [0,2,0,0,0,0|1,0,0]=3 2276 B12R1.1 COCCNc1ccc(cn1)O bd0ec413fe2f63d0c0ec77cd40a01221 [0,2,0,0,0,0|1,0,0]=3 2277 B12R1.1 COCCNc1ccc(cn1)S 57bcb276d04bcf19a32b8db4540c7c69 [0,2,0,0,0,0|1,0,0]=3 2278 B12R1.1 COCCNc1ccc(nc1)Br ea6ef9177409c883e3ae79b1b9a0df8b [0,2,0,0,0,0|1,0,0]=3 2279 B12R1.1 COCCNc1ccc(nc1)C ee23fd27ebee66df1b9513c41657d697 [0,2,0,0,0,0|1,0,0]=3 2280 B12R1.1 COCCNc1ccc(nc1)Cl 7f04bd35b40cca5c48b3485e7f58f185 [0,2,0,0,0,0|1,0,0]=3 2281 B12R1.1 COCCNc1ccc(nc1)F 81fc4f3e0695a46c43d61b81718ee262 [0,2,0,0,0,0|1,0,0]=3 2282 B12R1.1 COCCNc1ccc(nc1)I 498894a91188dae1f5d2f0c9eb382827 [0,2,0,0,0,0|1,0,0]=3 2283 B12R1.1 COCCNc1ccc(nc1)S 3e95ce311e38d686da8ad7f38a89f078 [0,2,0,0,0,0|1,0,0]=3 2284 B12R1.1 COCCNc1ccc(nn1)Br 94f463f5ed2990afcc836b9c259a7924 [0,2,0,0,0,0|2,0,0]=4 2285 B12R1.1 COCCNc1ccc(nn1)C 9db904ee912e73c22c11afe9285f79ac [0,2,0,0,0,0|2,0,0]=4 2286 B12R1.1 COCCNc1ccc(nn1)Cl 01c2c721814cc30fc15735e751d1e38e [0,2,0,0,0,0|2,0,0]=4 2287 B12R1.1 COCCNc1ccc(nn1)F b1c9c05533bb8dd2c376c1f77ad915e5 [0,2,0,0,0,0|2,0,0]=4 2288 B12R1.1 COCCNc1ccc(nn1)I 0f2de95a7a678ceab59a5771626bda5a [0,2,0,0,0,0|2,0,0]=4 2289 B12R1.1 COCCNc1ccc(nn1)O 3cfacd130096811576171f6d12884a3d [0,2,0,0,0,0|2,0,0]=4 2290 B12R1.1 COCCNc1ccc(nn1)S e3f18aa8697b0f538813615921bb7468 [0,2,0,0,0,0|2,0,0]=4 2291 B12R1.1 COCCNc1cnc(=O)[nH]c1 9a790b513d023060a30bde484b65c279 [0,2,0,0,0,0|2,0,0]=4 2292 B12R1.1 COCCNc1cnc(=S)[nH]c1 1c26a4f95c825090bfdee3c8fc4d6f2d [0,2,0,0,0,0|2,0,0]=4 2293 B12R1.1 COCCNc1cnc(cn1)Br 111c0888ab3e9a9d58c57d0cbb24b9c0 [0,2,0,0,0,0|2,0,0]=4 2294 B12R1.1 COCCNc1cnc(cn1)C 7eb18b46848f3aa84be4334401e9e2f5 [0,2,0,0,0,0|2,0,0]=4 2295 B12R1.1 COCCNc1cnc(cn1)Cl 1bec16033cfdc5aabf4ed80b8d251f53 [0,2,0,0,0,0|2,0,0]=4 2296 B12R1.1 COCCNc1cnc(cn1)F 09e0703b145c367ffe5dd1e9d0769d02 [0,2,0,0,0,0|2,0,0]=4 2297 B12R1.1 COCCNc1cnc(cn1)I 8460f2e5ed3d77c99a6aa3049fbfb733 [0,2,0,0,0,0|2,0,0]=4 2298 B12R1.1 COCCNc1cnc(nc1)Br f5a58e65528b8388b1b6e78950571e0d [0,2,0,0,0,0|2,0,0]=4 2299 B12R1.1 COCCNc1cnc(nc1)C e0b1745838bb56ae22c3eae928ed1d13 [0,2,0,0,0,0|2,0,0]=4 2300 B12R1.1 COCCNc1cnc(nc1)Cl 2c913bf2dbb3d9866e71501f5cd038f4 [0,2,0,0,0,0|2,0,0]=4 2301 B12R1.1 COCCNc1cnc(nc1)F d473ba9960a46d24f58a7dbf3dc25ed0 [0,2,0,0,0,0|2,0,0]=4 2302 B12R1.1 COCCNc1cnc(nc1)I 50faddb0ce9f903ca327473120aff014 [0,2,0,0,0,0|2,0,0]=4 2303 B12R1.1 COCCNc1ncc(cn1)Br 1f570e179e8b5d7cf84a1673c9658abc [0,2,0,0,0,0|2,0,0]=4 2304 B12R1.1 COCCNc1ncc(cn1)C d5a2d6676b8961e03ab7aeab75bdaf8e [0,2,0,0,0,0|2,0,0]=4 2305 B12R1.1 COCCNc1ncc(cn1)Cl 093359052cee853f666d7484ae37650a [0,2,0,0,0,0|2,0,0]=4 2306 B12R1.1 COCCNc1ncc(cn1)F 24482449be47cdeb429801d5dc53c2e7 [0,2,0,0,0,0|2,0,0]=4 2307 B12R1.1 COCCNc1ncc(cn1)I 64594ca2803097170424dd94e7247585 [0,2,0,0,0,0|2,0,0]=4 2308 B12R1.1 COCCOc1ccc(cc1)Br 59f81cc694fddf63dd9c397498a8f71c [0,2,0,0,0,0|0,0,0]=2 2309 B12R1.1 COCCOc1ccc(cc1)C b1d5560e5a325a25c8f516e70c9b7dd3 [0,2,0,0,0,0|0,0,0]=2 2310 B12R1.1 COCCOc1ccc(cc1)Cl aedf1b3f939e7afd0ecf936ea9af8427 [0,2,0,0,0,0|0,0,0]=2 2311 B12R1.1 COCCOc1ccc(cc1)F 353ef53d5cd36cd30d3c5a3be3e143d2 [0,2,0,0,0,0|0,0,0]=2 2312 B12R1.1 COCCOc1ccc(cc1)I 1af5a8e2ac91f91f1a45abad84e7a86b [0,2,0,0,0,0|0,0,0]=2 2313 B12R1.1 COCCOc1ccc(cc1)S be18e0df09b470cb83227bd8e52a0281 [0,2,0,0,0,0|0,0,0]=2 2314 B12R1.1 COCCOc1ccc(cn1)C 2cfd14c3999f5320927b336c794e493e [0,2,0,0,0,0|1,0,0]=3 2315 B12R1.1 COCCOc1ccc(cn1)Cl 4b74273ee1f05769173febcc208cf94c [0,2,0,0,0,0|1,0,0]=3 2316 B12R1.1 COCCOc1ccc(cn1)F b41abae1ad93fc2b2f8d2b0e97bab001 [0,2,0,0,0,0|1,0,0]=3 2317 B12R1.1 COCCOc1ccc(cn1)I ba4f627d8af5acdf2b979abccf1809da [0,2,0,0,0,0|1,0,0]=3 2318 B12R1.1 COCCOc1ccc(nc1)Br f19a854ba8995a1bf0da9a7b6369a3fd [0,2,0,0,0,0|1,0,0]=3 2319 B12R1.1 COCCOc1ccc(nc1)C 789b0414d3bf1eb85a8e9d3bd9a44ef9 [0,2,0,0,0,0|1,0,0]=3 2320 B12R1.1 COCCOc1ccc(nc1)Cl 8cbe357e6c22ac377c81a92dde67806a [0,2,0,0,0,0|1,0,0]=3 2321 B12R1.1 COCCOc1ccc(nc1)F 49990f366caf10309682628e14982ca4 [0,2,0,0,0,0|1,0,0]=3 2322 B12R1.1 COCCOc1ccc(nc1)I 1953640f6f3491825780257a5d8704e0 [0,2,0,0,0,0|1,0,0]=3 2323 B12R1.1 COCCOc1ccc(nn1)Br 9443bd99c59c47a12720a215eb3f4a4b [0,2,0,0,0,0|2,0,0]=4 2324 B12R1.1 COCCOc1ccc(nn1)C bed956e7bebf4eb92533afa355cfa7d3 [0,2,0,0,0,0|2,0,0]=4 2325 B12R1.1 COCCOc1ccc(nn1)Cl 78e8a4b0b5f1bb6b257a3cfc24440e55 [0,2,0,0,0,0|2,0,0]=4 2326 B12R1.1 COCCOc1cnc(cn1)Br 0a27659687505238691c023021d655b7 [0,2,0,0,0,0|2,0,0]=4 2327 B12R1.1 COCCOc1cnc(cn1)C a578dbc6742a7faea0c50f888cc8d721 [0,2,0,0,0,0|2,0,0]=4 2328 B12R1.1 COCCOc1cnc(cn1)Cl c8dc2af3d8c2242303f1d81f07d52fd1 [0,2,0,0,0,0|2,0,0]=4 2329 B12R1.1 COCCOc1cnc(cn1)I 409aaed4c75f8a543978f535c8b59b3c [0,2,0,0,0,0|2,0,0]=4 2330 B12R1.1 COCCOc1cnc(nc1)Br fa53b197a4a4ab6ebe44b5dad7f950b2 [0,2,0,0,0,0|2,0,0]=4 2331 B12R1.1 COCCOc1cnc(nc1)C 84239a2e638ac33e4bd8c1f7047e5537 [0,2,0,0,0,0|2,0,0]=4 2332 B12R1.1 COCCOc1cnc(nc1)Cl 4346bbc1b567c71beb15dca587e4e50d [0,2,0,0,0,0|2,0,0]=4 2333 B12R1.1 COCCOc1ncc(cn1)Br be501de68c17976590a099799c9e58f4 [0,2,0,0,0,0|2,0,0]=4 2334 B12R1.1 COCCOc1ncc(cn1)C 3a3efc4911bd7444ed9c45f30bb9b7c2 [0,2,0,0,0,0|2,0,0]=4 2335 B12R1.1 COCCOc1ncc(cn1)F 4368cba2d7a0f49d60c947008e52cd0e [0,2,0,0,0,0|2,0,0]=4 2336 B12R1.1 COCCOc1ncc(cn1)I 3378789fe27f687312eebfc227048341 [0,2,0,0,0,0|2,0,0]=4 2337 B12R1.1 COCNCc1ccc(=O)[nH]c1 966504355f5007bd365d9a0bdf28b307 [0,2,0,0,0,0|1,0,0]=3 2338 B12R1.1 COCNCc1ccc(cc1)Br 2101c8ffb2742f9e20614ebc2902f4e9 [0,2,0,0,0,0|0,0,0]=2 2339 B12R1.1 COCNCc1ccc(cc1)C 1ddbf711bb1fd8e5bb368c453428b7c3 [0,2,0,0,0,0|0,0,0]=2 2340 B12R1.1 COCNCc1ccc(cc1)Cl 2d350432a72c42f08586f91f64cfeb55 [0,2,0,0,0,0|0,0,0]=2 2341 B12R1.1 COCNCc1ccc(cc1)F 1c3d2fa163bb11a20df738f7c1f91179 [0,2,0,0,0,0|0,0,0]=2 2342 B12R1.1 COCNCc1ccc(cc1)I 37d68c073753166fb2f5673ea356dd9f [0,2,0,0,0,0|0,0,0]=2 2343 B12R1.1 COCNCc1ccc(cn1)Br eb4a5b86258c2c3116f7d5cf571588ec [0,2,0,0,0,0|1,0,0]=3 2344 B12R1.1 COCNCc1ccc(cn1)C 33eab755a5d001639e66d07c6417c96e [0,2,0,0,0,0|1,0,0]=3 2345 B12R1.1 COCNCc1ccc(cn1)Cl 0de3190092ada4c1cfea21fb494ae49f [0,2,0,0,0,0|1,0,0]=3 2346 B12R1.1 COCNCc1ccc(cn1)F 414fd94fc5410186eaafb50870e732b4 [0,2,0,0,0,0|1,0,0]=3 2347 B12R1.1 COCNCc1ccc(nc1)Br a450861ef2a8d843c3f632a69a5afba6 [0,2,0,0,0,0|1,0,0]=3 2348 B12R1.1 COCNCc1ccc(nc1)C b6ec1a4369c74ebcdf401f7d3323876f [0,2,0,0,0,0|1,0,0]=3 2349 B12R1.1 COCNCc1ccc(nc1)Cl e243f371ffc80e4703b3846090cf3eed [0,2,0,0,0,0|1,0,0]=3 2350 B12R1.1 COCNCc1ccc(nc1)F 1d1902f78c1feb5cb64fd352e4686a8c [0,2,0,0,0,0|1,0,0]=3 2351 B12R1.1 COCNCc1ccc(nn1)C fec57b78d30e77aa9af2e336bb520a55 [0,2,0,0,0,0|2,0,0]=4 2352 B12R1.1 COCNCc1ccc(nn1)Cl ca520033f52b2ea702e653f58560728f [0,2,0,0,0,0|2,0,0]=4 2353 B12R1.1 COCNCc1cnc(cn1)Br 8c4efb38b951e964a5b9b8810a5594f5 [0,2,0,0,0,0|2,0,0]=4 2354 B12R1.1 COCNCc1cnc(cn1)C 81e84bc76b2ade70ed1ded71a6955653 [0,2,0,0,0,0|2,0,0]=4 2355 B12R1.1 COCNCc1cnc(cn1)Cl 179e149d3a09b7b54f104929ed090ec9 [0,2,0,0,0,0|2,0,0]=4 2356 B12R1.1 COCNCc1cnc(nc1)C 9cc444ee411b769fd094ccd63387c0a1 [0,2,0,0,0,0|2,0,0]=4 2357 B12R1.1 COCNCc1cnc(nc1)Cl 38b0d5e377ff206fb9b9012d59d9b821 [0,2,0,0,0,0|2,0,0]=4 2358 B12R1.1 COCNCc1ncc(cn1)Br f39716d454c51d53b5097865d3cfb924 [0,2,0,0,0,0|2,0,0]=4 2359 B12R1.1 COCNCc1ncc(cn1)C 56aa0d1f342c4d977b4c917b8f81f199 [0,2,0,0,0,0|2,0,0]=4 2360 B12R1.1 COCNCc1ncc(cn1)Cl 136a402775046611a293ed1f98b62771 [0,2,0,0,0,0|2,0,0]=4 2361 B12R1.1 COCNCc1ncc(cn1)F 196cecd178670275d2cd880f82c03734 [0,2,0,0,0,0|2,0,0]=4 2362 B12R1.1 COCOCc1cc[n+](cc1)[O-] bfcdee60c4850a9b239170ecf999d32e [0,2,0,0,0,0|1,0,0]=3 2363 B12R1.1 COCOCc1ccc(cc1)Br 428c0675138106422df59babd0a4742f [0,2,0,0,0,0|0,0,0]=2 2364 B12R1.1 COCOCc1ccc(cc1)C 193aa9ab931a6a24231e20923141b26a [0,2,0,0,0,0|0,0,0]=2 2365 B12R1.1 COCOCc1ccc(cc1)Cl 8d1220ebec17a1d5ad87d7ecbe17ddba [0,2,0,0,0,0|0,0,0]=2 2366 B12R1.1 COCOCc1ccc(cc1)F 837a7f154b9d2ab539edcef32fc8cbf5 [0,2,0,0,0,0|0,0,0]=2 2367 B12R1.1 COCOCc1ccc(cc1)I d3b117bbf06fbd5bf254ea112ff039c6 [0,2,0,0,0,0|0,0,0]=2 2368 B12R1.1 COCOCc1ccc(cc1)S fff07ccf7efce07c78db73dc16d32001 [0,2,0,0,0,0|0,0,0]=2 2369 B12R1.1 COCOCc1ccc(cn1)Br 5ba023b8a8ffd631584ce6b06f5f8da6 [0,2,0,0,0,0|1,0,0]=3 2370 B12R1.1 COCOCc1ccc(cn1)C ff676d411c527e57b34dd5d8979cdb04 [0,2,0,0,0,0|1,0,0]=3 2371 B12R1.1 COCOCc1ccc(cn1)Cl d33e1130f1bc4798404db81ef9589c56 [0,2,0,0,0,0|1,0,0]=3 2372 B12R1.1 COCOCc1ccc(cn1)F da9e7d0f7b824c6250f1fa01987f41fa [0,2,0,0,0,0|1,0,0]=3 2373 B12R1.1 COCOCc1ccc(cn1)I 4ad87f486e6db41b8fe45a5bb7e8e090 [0,2,0,0,0,0|1,0,0]=3 2374 B12R1.1 COCOCc1ccc(nc1)Br ee11061558138f6dd7217b5092657e29 [0,2,0,0,0,0|1,0,0]=3 2375 B12R1.1 COCOCc1ccc(nc1)C 6fd52164cc715d7ee25b55c0c745c9b4 [0,2,0,0,0,0|1,0,0]=3 2376 B12R1.1 COCOCc1ccc(nc1)Cl 3335a8d8c199536dab9ac47783d19e6d [0,2,0,0,0,0|1,0,0]=3 2377 B12R1.1 COCOCc1ccc(nc1)F f4d37e2b4cd268e7edcc451a4ee17635 [0,2,0,0,0,0|1,0,0]=3 2378 B12R1.1 COCOCc1ccc(nn1)C 506e61954b860d47cbb3d8f8ea07a26d [0,2,0,0,0,0|2,0,0]=4 2379 B12R1.1 COCOCc1ccc(nn1)Cl 79c7c53020a23d7b9a35f99bf0251ddb [0,2,0,0,0,0|2,0,0]=4 2380 B12R1.1 COCOCc1cnc(cn1)Br fc35590e92e9da1d9e6c76e7e3b672a6 [0,2,0,0,0,0|2,0,0]=4 2381 B12R1.1 COCOCc1cnc(cn1)C e83d2da28eed3e4c1e0c2770156ee9f0 [0,2,0,0,0,0|2,0,0]=4 2382 B12R1.1 COCOCc1cnc(cn1)Cl 2b68c2cca15a6925138a23ad2a02ae16 [0,2,0,0,0,0|2,0,0]=4 2383 B12R1.1 COCOCc1cnc(nc1)Br 4046bfc7cfc6ccc4ea2d160c649c73da [0,2,0,0,0,0|2,0,0]=4 2384 B12R1.1 COCOCc1cnc(nc1)C 6bff21f7f8e4769276107aecad7b47bd [0,2,0,0,0,0|2,0,0]=4 2385 B12R1.1 COCOCc1cnc(nc1)Cl baabf936dbc6dc91ea2e71b902c03e0d [0,2,0,0,0,0|2,0,0]=4 2386 B12R1.1 COCOCc1ncc(cn1)Br e930119ed36541cae5c91c99a6790aaa [0,2,0,0,0,0|2,0,0]=4 2387 B12R1.1 COCOCc1ncc(cn1)C 661563b9a8784a567fe4cccbee191f45 [0,2,0,0,0,0|2,0,0]=4 2388 B12R1.1 COCOCc1ncc(cn1)Cl eaf798c8d4c809ab2b64a31a860c4bdf [0,2,0,0,0,0|2,0,0]=4 2389 B12R1.1 COCOCc1ncc(cn1)F c8beb739ecdfd1f25e3237802a8fbbd8 [0,2,0,0,0,0|2,0,0]=4 2390 B12R1.1 CSCCNc1ccc(=O)[nH]c1 9af7033f4814fd940ab7ea17dd876142 [0,2,0,0,0,0|1,1,0]=4 2391 B12R1.1 CSCCNc1ccc(cc1)Br 8ab0677987b0eea2f7ca5e75fb396aff [0,2,0,0,0,0|0,1,0]=3 2392 B12R1.1 CSCCNc1ccc(cc1)C 310ae1408eff8b26413c520510ae11cf [0,2,0,0,0,0|0,1,0]=3 2393 B12R1.1 CSCCNc1ccc(cc1)Cl 4f204a2d9fd4023e1a5daab1a4b97091 [0,2,0,0,0,0|0,1,0]=3 2394 B12R1.1 CSCCNc1ccc(cc1)F 28f70803d3770470a142bfaa1613d9e1 [0,2,0,0,0,0|0,1,0]=3 2395 B12R1.1 CSCCNc1ccc(cc1)I 6aefca79dea20870dc631870bac7bc12 [0,2,0,0,0,0|0,1,0]=3 2396 B12R1.1 CSCCNc1ccc(cc1)S 23d5e26bcf03f49e0545130793e63a46 [0,2,0,0,0,0|0,1,0]=3 2397 B12R1.1 CSCCNc1ccc(cn1)Br 9297cb49290c0d777c151a347665d807 [0,2,0,0,0,0|1,1,0]=4 2398 B12R1.1 CSCCNc1ccc(cn1)C c920f84822cda5a81ab400730a4f716e [0,2,0,0,0,0|1,1,0]=4 2399 B12R1.1 CSCCNc1ccc(cn1)Cl 53a1f58cb26cbaa401ebbe18f45d7192 [0,2,0,0,0,0|1,1,0]=4 2400 B12R1.1 CSCCNc1ccc(cn1)F 0b315319f184871f5b6d9e18e418dd6a [0,2,0,0,0,0|1,1,0]=4 2401 B12R1.1 CSCCNc1ccc(cn1)I 22052232a7766d5d81c3093544cf6a06 [0,2,0,0,0,0|1,1,0]=4 2402 B12R1.1 CSCCNc1ccc(nc1)Br edab30a327757eef605c15e26b5127f2 [0,2,0,0,0,0|1,1,0]=4 2403 B12R1.1 CSCCNc1ccc(nc1)C c1dd8f0f85bc13f5e7de773ee0119a0e [0,2,0,0,0,0|1,1,0]=4 2404 B12R1.1 CSCCNc1ccc(nc1)Cl 70280c54efcd05a760a8a47c23cf696b [0,2,0,0,0,0|1,1,0]=4 2405 B12R1.1 CSCCNc1ccc(nc1)F e1cdf1c9ebb302df28d9d3a1ea311a66 [0,2,0,0,0,0|1,1,0]=4 2406 B12R1.1 CSCCNc1ccc(nc1)I e0d5f95377e926a1d58289e8c66bec67 [0,2,0,0,0,0|1,1,0]=4 2407 B12R1.1 CSCCOc1ccc(cc1)Br c234e90f741991c47604f539f2d99f42 [0,2,0,0,0,0|0,1,0]=3 2408 B12R1.1 CSCCOc1ccc(cc1)C 24a3be47a5236d6fcfdb3dd31ef924e1 [0,2,0,0,0,0|0,1,0]=3 2409 B12R1.1 CSCCOc1ccc(cc1)Cl 198ed529c59d9f64135f4216da3c0c09 [0,2,0,0,0,0|0,1,0]=3 2410 B12R1.1 CSCCOc1ccc(cc1)F fefa248d3af27dfc611f32de34246b14 [0,2,0,0,0,0|0,1,0]=3 2411 B12R1.1 CSCCOc1ccc(cc1)I 7e7eedf216c574333f818acb7f46b313 [0,2,0,0,0,0|0,1,0]=3 2412 B12R1.1 CSCCOc1ccc(cc1)S 1f2c0987d2a08e98131fab5ab97aece6 [0,2,0,0,0,0|0,1,0]=3 2413 B12R1.1 CSCCOc1ccc(cn1)C f38a553ea061c70bde8c7ea2bd5eb464 [0,2,0,0,0,0|1,1,0]=4 2414 B12R1.1 CSCCOc1ccc(cn1)Cl 6c38c88f57811a01ba287e33cc0797d3 [0,2,0,0,0,0|1,1,0]=4 2415 B12R1.1 CSCCOc1ccc(cn1)F b12ea9cb4b04080e725dda6c3dded86e [0,2,0,0,0,0|1,1,0]=4 2416 B12R1.1 CSCCOc1ccc(cn1)I 414a8d4e020159230d9442c2db17f0ed [0,2,0,0,0,0|1,1,0]=4 2417 B12R1.1 CSCCOc1ccc(nc1)Br 2a3016e931df1608a6cd1c317fb9573e [0,2,0,0,0,0|1,1,0]=4 2418 B12R1.1 CSCCOc1ccc(nc1)C a8b292e770db6753094b1677f18fbf73 [0,2,0,0,0,0|1,1,0]=4 2419 B12R1.1 CSCCOc1ccc(nc1)Cl c18a3bc38635e385026f8df19222c3a9 [0,2,0,0,0,0|1,1,0]=4 2420 B12R1.1 CSCCOc1ccc(nc1)F 40dd45b680e1167adf27b3ede4dab40f [0,2,0,0,0,0|1,1,0]=4 2421 B12R1.1 CSCCOc1ccc(nc1)I fb571478a59862ca0d7614c8c75001e8 [0,2,0,0,0,0|1,1,0]=4 2422 B12R1.1 CSCNCc1ccc(=O)[nH]c1 92a09b479c77a6eae01f81079c0ef138 [0,2,0,0,0,0|1,1,0]=4 2423 B12R1.1 CSCNCc1ccc(cc1)Br 693801023c71ab41fb46dfde2783c840 [0,2,0,0,0,0|0,1,0]=3 2424 B12R1.1 CSCNCc1ccc(cc1)C 9fc32bcf202f13dafa59ca6cad147642 [0,2,0,0,0,0|0,1,0]=3 2425 B12R1.1 CSCNCc1ccc(cc1)Cl 0bfdbe8848ec3a5aff321142c87584b1 [0,2,0,0,0,0|0,1,0]=3 2426 B12R1.1 CSCNCc1ccc(cc1)F c6129a00308c9d4832a29e22c5adc4b0 [0,2,0,0,0,0|0,1,0]=3 2427 B12R1.1 CSCNCc1ccc(cc1)I b29bd17b4320cd66526146eb19c64d3d [0,2,0,0,0,0|0,1,0]=3 2428 B12R1.1 CSCNCc1ccc(cn1)C 2526d339bf492358ab7424e0ac27e7c0 [0,2,0,0,0,0|1,1,0]=4 2429 B12R1.1 CSCNCc1ccc(cn1)Cl efca04196fbe5126c26b656a71dc17eb [0,2,0,0,0,0|1,1,0]=4 2430 B12R1.1 CSCNCc1ccc(cn1)F ca2916f6c07cf3ff7aa118ff8d12f35f [0,2,0,0,0,0|1,1,0]=4 2431 B12R1.1 CSCNCc1ccc(nc1)Br 62d655dd29bea258f954f0a58425c116 [0,2,0,0,0,0|1,1,0]=4 2432 B12R1.1 CSCNCc1ccc(nc1)C 6b008f1534076ea9e6c24700a9fe866d [0,2,0,0,0,0|1,1,0]=4 2433 B12R1.1 CSCNCc1ccc(nc1)Cl 9ee398b55aea9fa4d57b26ce9ef18f5c [0,2,0,0,0,0|1,1,0]=4 2434 B12R1.1 CSCNCc1ccc(nc1)F 9af83d74314598e16cc41934241e43e0 [0,2,0,0,0,0|1,1,0]=4 2435 B12R1.1 CSCOCc1cc[n+](cc1)[O-] 1fae5de009f50061d6fdf282f601fd92 [0,2,0,0,0,0|1,1,0]=4 2436 B12R1.1 CSCOCc1ccc(cc1)Br 04076c930c60c8026e8859d12af51795 [0,2,0,0,0,0|0,1,0]=3 2437 B12R1.1 CSCOCc1ccc(cc1)C 8f292a47087d0909cd576163e4db1532 [0,2,0,0,0,0|0,1,0]=3 2438 B12R1.1 CSCOCc1ccc(cc1)Cl 03e78d5cbe8215e8240c6356bb118866 [0,2,0,0,0,0|0,1,0]=3 2439 B12R1.1 CSCOCc1ccc(cc1)F 2f1cad00f1363f49def9c4fdb797866b [0,2,0,0,0,0|0,1,0]=3 2440 B12R1.1 CSCOCc1ccc(cc1)I 31f9b1d8cf943b9f6280d8a2c534b898 [0,2,0,0,0,0|0,1,0]=3 2441 B12R1.1 CSCOCc1ccc(cc1)S fc2f705e251814c6788644bc46a6aca1 [0,2,0,0,0,0|0,1,0]=3 2442 B12R1.1 CSCOCc1ccc(cn1)Br 7691a2ac9876054dccd283c60be52d5a [0,2,0,0,0,0|1,1,0]=4 2443 B12R1.1 CSCOCc1ccc(cn1)C 1773de23779958289212fb11c198f5e3 [0,2,0,0,0,0|1,1,0]=4 2444 B12R1.1 CSCOCc1ccc(cn1)Cl 5e4e2939a91f1fa42020a9c1c6944fd9 [0,2,0,0,0,0|1,1,0]=4 2445 B12R1.1 CSCOCc1ccc(cn1)F b95159b84111d70642a2846b981cccef [0,2,0,0,0,0|1,1,0]=4 2446 B12R1.1 CSCOCc1ccc(cn1)I c50d84c0b46eec93fec0896f14bb0ddd [0,2,0,0,0,0|1,1,0]=4 2447 B12R1.1 CSCOCc1ccc(nc1)Br a7322e66fd537e7ed80b39c4c257be75 [0,2,0,0,0,0|1,1,0]=4 2448 B12R1.1 CSCOCc1ccc(nc1)C ec6b504af767d17c6d1f652df0895a65 [0,2,0,0,0,0|1,1,0]=4 2449 B12R1.1 CSCOCc1ccc(nc1)Cl 87600a19365702a174a414163b18b5b5 [0,2,0,0,0,0|1,1,0]=4 2450 B12R1.1 CSCOCc1ccc(nc1)F d6f8e6149cf4d54361230c67acfb65cc [0,2,0,0,0,0|1,1,0]=4 2451 B12R1.1 Cc1ccc(cc1)CCNC#N 53ca67ea915f9e6fd72cd5b205cad1da [0,2,0,0,0,0|1,0,1]=4 2452 B12R1.1 Cc1ccc(cc1)CCNC=O b9ea689c80c53698375479d2429cc620 [0,2,0,0,0,0|1,0,1]=4 2453 B12R1.1 Cc1ccc(cc1)CCNCF 55db78b5c6b65959b4c4a038e04170d2 [0,2,0,0,0,0|1,0,0]=3 2454 B12R1.1 Cc1ccc(cc1)CCNCO 8265feb14c5c78ac0b9f16d74e5916ae [0,2,0,0,0,0|1,0,0]=3 2455 B12R1.1 Cc1ccc(cc1)CCOCF 23e471ed521d6c702e5222c5224f343c [0,2,0,0,0,0|0,0,0]=2 2456 B12R1.1 Cc1ccc(cc1)CNCC#N 6301ba8ae4527ff19eecb5fd69750981 [0,2,0,0,0,0|2,0,0]=4 2457 B12R1.1 Cc1ccc(cc1)CNCC=O 9ed531c7409d343a9f3e4dfabbd1e863 [0,2,0,0,0,0|2,0,0]=4 2458 B12R1.1 Cc1ccc(cc1)CNCCBr 2d8aaef5002dee05b5b0d139516346b7 [0,2,0,0,0,0|2,0,0]=4 2459 B12R1.1 Cc1ccc(cc1)CNCCF 45de62b9a51bd1d0feae8b987f81bbf3 [0,2,0,0,0,0|2,0,0]=4 2460 B12R1.1 Cc1ccc(cc1)CNCCI 0f947b3f245796fc1dcd52661dd84fa8 [0,2,0,0,0,0|2,0,0]=4 2461 B12R1.1 Cc1ccc(cc1)CNCCO 47cbe1348c331b475579d0d8d51b73f3 [0,2,0,0,0,0|2,0,0]=4 2462 B12R1.1 Cc1ccc(cc1)CNCCS f4f6d094efa9a75c2d676e4e1bf95e4c [0,2,0,0,0,0|2,0,0]=4 2463 B12R1.1 Cc1ccc(cc1)COCC#N 7ad69d8bca54acaa0ae71e54f084eb7f [0,2,0,0,0,0|2,0,0]=4 2464 B12R1.1 Cc1ccc(cc1)COCC=O cb278d9115f41eba0ece67792b3dc07a [0,2,0,0,0,0|2,0,0]=4 2465 B12R1.1 Cc1ccc(cc1)COCCF 0d130b7ab7dcfaf08d1b5194bdc3e4e7 [0,2,0,0,0,0|2,0,0]=4 2466 B12R1.1 Cc1ccc(cc1)COCCS fa0ba5736fc27a43635ffecb1320bef1 [0,2,0,0,0,0|2,0,0]=4 2467 B12R1.1 Cc1ccc(cc1)NCCC#N 96edf6767ab47e7e3396c7cf9b23fcc9 [0,2,0,0,0,0|2,0,0]=4 2468 B12R1.1 Cc1ccc(cc1)NCCC=O c651134122dc9987497d7c8070f8742d [0,2,0,0,0,0|2,0,0]=4 2469 B12R1.1 Cc1ccc(cc1)NCCCCl 20a97402e32410da2dbcec2aa3bbe78c [0,2,0,0,0,0|2,0,0]=4 2470 B12R1.1 Cc1ccc(cc1)NCCCF 851b4770ba02f29cfff9aabe778a437d [0,2,0,0,0,0|2,0,0]=4 2471 B12R1.1 Cc1ccc(cc1)NCCCO 46aa73ad3705fe83d5925f133ae7c772 [0,2,0,0,0,0|2,0,0]=4 2472 B12R1.1 Cc1ccc(cc1)NCCCS 72b037e31eb66dc652e81da4beb6cd18 [0,2,0,0,0,0|2,0,0]=4 2473 B12R1.1 Cc1ccc(cc1)NCCON 0d462662735047ab290ae578de1f84ea [0,2,0,0,0,0|1,0,0]=3 2474 B12R1.1 Cc1ccc(cc1)OCCC#N 0685b0845c99939bc67acce3954e2d5b [0,2,0,0,0,0|2,0,0]=4 2475 B12R1.1 Cc1ccc(cc1)OCCC=O 4b1d290849b9df8dffabc68535138876 [0,2,0,0,0,0|2,0,0]=4 2476 B12R1.1 Cc1ccc(cc1)OCCCF feeaf145cc496d1fd07364d6aa7e43fc [0,2,0,0,0,0|2,0,0]=4 2477 B12R1.1 Cc1ccc(cc1)OCCCS 29a5e3dab250bf0932d27e1725c97389 [0,2,0,0,0,0|2,0,0]=4 2478 B12R1.1 Cc1ccc(cn1)CCNCF 92bd35007be893fe4e6d51d0da75e41d [0,2,0,0,0,0|2,0,0]=4 2479 B12R1.1 Cc1ccc(cn1)CCNCO 554900c10a1e8a24f1017c92d45b378f [0,2,0,0,0,0|2,0,0]=4 2480 B12R1.1 Cc1ccc(cn1)CCOCF 056a99742a44cd54d90e218fa02818ef [0,2,0,0,0,0|1,0,0]=3 2481 B12R1.1 Cc1ccc(cn1)NCCON b51477dfb474ee96f0e6b060b5ba0855 [0,2,0,0,0,0|2,0,0]=4 2482 B12R1.1 Cc1ccc(nc1)CCOCF 7f2d0a874f431f6002914f87185517b3 [0,2,0,0,0,0|1,0,0]=3 2483 B12R1.1 Cc1ccc(nc1)NCCON 417657a818a5d60d713b77dea8ad331f [0,2,0,0,0,0|2,0,0]=4 2484 B12R1.1 Clc1ccc(cc1)CNCCBr c65ca8fd38a5e054055efe4671ab857e [0,2,0,0,0,0|2,0,0]=4 2485 B12R1.1 Clc1ccc(cc1)CNCCI 8c14ff739e3e87d5f74de98bc200ad53 [0,2,0,0,0,0|2,0,0]=4 2486 B12R1.1 FCCCNc1ccc(cc1)Br 2bb0b8b5de9be84e6aa954805b9bdc6f [0,2,0,0,0,0|2,0,0]=4 2487 B12R1.1 FCCCNc1ccc(cc1)Cl 3bac999676431694f615544eac89e910 [0,2,0,0,0,0|2,0,0]=4 2488 B12R1.1 FCCCNc1ccc(cc1)F 79d6de3a9c368c231cd818521f7ebf62 [0,2,0,0,0,0|2,0,0]=4 2489 B12R1.1 FCCCNc1ccc(cc1)I 9c99a2b01242c00192aedbe231fc2bd2 [0,2,0,0,0,0|2,0,0]=4 2490 B12R1.1 FCCCNc1ccc(cc1)S ad5b6b8a015045fcbbb030babf864b53 [0,2,0,0,0,0|2,0,0]=4 2491 B12R1.1 FCCCOc1ccc(cc1)Br 475788e0200e75281ddc0e6025f8bdff [0,2,0,0,0,0|2,0,0]=4 2492 B12R1.1 FCCCOc1ccc(cc1)Cl 139fdae034a870836c2920fee7b7b718 [0,2,0,0,0,0|2,0,0]=4 2493 B12R1.1 FCCCOc1ccc(cc1)F 9be3c4201031cb2036b0bb1acb87a0c4 [0,2,0,0,0,0|2,0,0]=4 2494 B12R1.1 FCCCOc1ccc(cc1)I 1fe701e7027f1edb027816d43c4777ec [0,2,0,0,0,0|2,0,0]=4 2495 B12R1.1 FCCCOc1ccc(cc1)S bbb5166fd0fd5ed564b64a2107cb5fc0 [0,2,0,0,0,0|2,0,0]=4 2496 B12R1.1 FCCNCc1ccc(cc1)Br 65d8c489335e2e57798d1d4248bd2ae5 [0,2,0,0,0,0|2,0,0]=4 2497 B12R1.1 FCCNCc1ccc(cc1)Cl 55328c35608650689df7bcb63925e617 [0,2,0,0,0,0|2,0,0]=4 2498 B12R1.1 FCCNCc1ccc(cc1)F 3eacca31e9c8a1445938595857c2b92a [0,2,0,0,0,0|2,0,0]=4 2499 B12R1.1 FCCNCc1ccc(cc1)I d63e3036898d8ab0af6d516afab80e3f [0,2,0,0,0,0|2,0,0]=4 2500 B12R1.1 FCCOCc1ccc(cc1)Br 92495eb32b3f433b2bab7c5380980e79 [0,2,0,0,0,0|2,0,0]=4 2501 B12R1.1 FCCOCc1ccc(cc1)Cl f2abd9f5353336c91b3534a565e7e4bc [0,2,0,0,0,0|2,0,0]=4 2502 B12R1.1 FCCOCc1ccc(cc1)F 14e4a988dfdb52dc5cdd6f42bb1b065c [0,2,0,0,0,0|2,0,0]=4 2503 B12R1.1 FCCOCc1ccc(cc1)I c4f71ecd033c4f8ae03483191d011e18 [0,2,0,0,0,0|2,0,0]=4 2504 B12R1.1 FCCOCc1ccc(cc1)S af1a831e53f70462c0b307028f23b689 [0,2,0,0,0,0|2,0,0]=4 2505 B12R1.1 FCNCCc1ccc(cc1)Br 8638beffc47a42ce959ab1c0805990f5 [0,2,0,0,0,0|1,0,0]=3 2506 B12R1.1 FCNCCc1ccc(cc1)Cl 70d590d4b56811c02c2e304f3cf87f38 [0,2,0,0,0,0|1,0,0]=3 2507 B12R1.1 FCNCCc1ccc(cc1)F c5cbf3f1d30444969ee6f1c3b2a29381 [0,2,0,0,0,0|1,0,0]=3 2508 B12R1.1 FCNCCc1ccc(cc1)I cc57343573354e520cfcdabf8150e29c [0,2,0,0,0,0|1,0,0]=3 2509 B12R1.1 FCNCCc1ccc(nc1)Br fce433292d0bbb355897eca5e0dcfe9a [0,2,0,0,0,0|2,0,0]=4 2510 B12R1.1 FCNCCc1ccc(nc1)Cl 3e4b95c3a7e0769f01bb9bad57372eb4 [0,2,0,0,0,0|2,0,0]=4 2511 B12R1.1 FCOCCc1ccc(cc1)Br 3d5bf9390babc43444cfa414157b2f9a [0,2,0,0,0,0|0,0,0]=2 2512 B12R1.1 FCOCCc1ccc(cc1)Cl c19707c796ee492aada5636e67f70282 [0,2,0,0,0,0|0,0,0]=2 2513 B12R1.1 FCOCCc1ccc(cc1)F ccdf7834bb3ad7b62c366a300838c3f0 [0,2,0,0,0,0|0,0,0]=2 2514 B12R1.1 FCOCCc1ccc(cc1)I ac6c9e6f007389bdbaa2b46b1b627f52 [0,2,0,0,0,0|0,0,0]=2 2515 B12R1.1 FCOCCc1ccc(cn1)Br 87a383c5bca931871672fa4519a9dcee [0,2,0,0,0,0|1,0,0]=3 2516 B12R1.1 FCOCCc1ccc(cn1)F 50cfde45d8f1f3102e39e67c980e33c8 [0,2,0,0,0,0|1,0,0]=3 2517 B12R1.1 FCOCCc1ccc(nc1)Br aa58de6f5fbcaf8564822606cc93b5c8 [0,2,0,0,0,0|1,0,0]=3 2518 B12R1.1 FCOCCc1ccc(nc1)Cl 973467d86542ca9fa624aa16ca4e3dd6 [0,2,0,0,0,0|1,0,0]=3 2519 B12R1.1 FCOCCc1ccc(nc1)F bd0733951901b6ae9d034b2b265c8647 [0,2,0,0,0,0|1,0,0]=3 2520 B12R1.1 FCOCCc1cnc(nc1)Cl fa5e5959e9cd08ac6b4a95799f30fddc [0,2,0,0,0,0|2,0,0]=4 2521 B12R1.1 FCOCCc1ncc(cn1)Br 648630d7453469e5c5e54e9d076e720c [0,2,0,0,0,0|2,0,0]=4 2522 B12R1.1 Fc1ccc(cc1)CNCCBr 072eab35a0497e904436919e1fef6884 [0,2,0,0,0,0|2,0,0]=4 2523 B12R1.1 Fc1ccc(cc1)CNCCI 2873609fdbac0a9541e33e6ac7c1cb32 [0,2,0,0,0,0|2,0,0]=4 2524 B12R1.1 Fc1ccc(cc1)CNCCS 88ed63e95aaf218af2a93443072e06ef [0,2,0,0,0,0|2,0,0]=4 2525 B12R1.1 Fc1ccc(cc1)COCCS 86c8939ca17403844281e346ea792870 [0,2,0,0,0,0|2,0,0]=4 2526 B12R1.1 Fc1ccc(cc1)NCCCCl 9a2f2f4691174593f4155dfa4b67c91f [0,2,0,0,0,0|2,0,0]=4 2527 B12R1.1 Fc1ccc(cc1)NCCCS 7e053f391e122f52af50e8234f5dc2e0 [0,2,0,0,0,0|2,0,0]=4 2528 B12R1.1 Fc1ccc(cc1)OCCCS ae2c14497042619ab205edaf6d20d829 [0,2,0,0,0,0|2,0,0]=4 2529 B12R1.1 ICCNCc1ccc(cc1)I 29f1572640797dc773f75c818257fe5a [0,2,0,0,0,0|2,0,0]=4 2530 B12R1.1 N#CCCNc1ccc(cc1)Br cf1c817b228a0e4c4877a07c4854ab66 [0,2,0,0,0,0|2,0,0]=4 2531 B12R1.1 N#CCCNc1ccc(cc1)Cl c5c6b57ba1c8a8cb44a58c4f237bb557 [0,2,0,0,0,0|2,0,0]=4 2532 B12R1.1 N#CCCNc1ccc(cc1)F 8f002f7dac4d7b5c8caa6f855bade1f9 [0,2,0,0,0,0|2,0,0]=4 2533 B12R1.1 N#CCCNc1ccc(cc1)I c041250222c642f84c55e3df0ae06448 [0,2,0,0,0,0|2,0,0]=4 2534 B12R1.1 N#CCCNc1ccc(cc1)S a2caf6181f266c6fbbc1cb56432ac7eb [0,2,0,0,0,0|2,0,0]=4 2535 B12R1.1 N#CCCOc1ccc(cc1)Br 823d43f8c35150bec55f461c2cbf8603 [0,2,0,0,0,0|2,0,0]=4 2536 B12R1.1 N#CCCOc1ccc(cc1)Cl 5e3536c92026b3f8585cf0847edaf1ee [0,2,0,0,0,0|2,0,0]=4 2537 B12R1.1 N#CCCOc1ccc(cc1)F cadbb25e60263050fa0a2d2f28f70d26 [0,2,0,0,0,0|2,0,0]=4 2538 B12R1.1 N#CCCOc1ccc(cc1)I 423b9c2b3b3b28a9e07d0d4f55d5ccc0 [0,2,0,0,0,0|2,0,0]=4 2539 B12R1.1 N#CCCOc1ccc(cc1)S bd7de0019bdd91c7081fa09b425fabfb [0,2,0,0,0,0|2,0,0]=4 2540 B12R1.1 N#CCNCc1ccc(cc1)Br 67a1904661597a0e3a00db674558a8b7 [0,2,0,0,0,0|2,0,0]=4 2541 B12R1.1 N#CCNCc1ccc(cc1)Cl 2a9a01961bd8e9efde30309201d4ca0e [0,2,0,0,0,0|2,0,0]=4 2542 B12R1.1 N#CCNCc1ccc(cc1)F ba290b2076da0eaff27c2f2c955e9125 [0,2,0,0,0,0|2,0,0]=4 2543 B12R1.1 N#CCNCc1ccc(cc1)I 9fbc183a1d34baaee258d42d1b107a0e [0,2,0,0,0,0|2,0,0]=4 2544 B12R1.1 N#CCOCc1ccc(cc1)Br 12c0641e58a146601e12a82a3477f304 [0,2,0,0,0,0|2,0,0]=4 2545 B12R1.1 N#CCOCc1ccc(cc1)Cl d70961d9fe1bc384a5e0bdb35f1f5be7 [0,2,0,0,0,0|2,0,0]=4 2546 B12R1.1 N#CCOCc1ccc(cc1)F 0ced03f44c769e0f1e8471755b02bbee [0,2,0,0,0,0|2,0,0]=4 2547 B12R1.1 N#CCOCc1ccc(cc1)I 7ea79044cc3e46de742244abd8688867 [0,2,0,0,0,0|2,0,0]=4 2548 B12R1.1 N#CCOCc1ccc(cc1)S 97e8a2da57b04188949e0042c6954af5 [0,2,0,0,0,0|2,0,0]=4 2549 B12R1.1 N#CNCCc1ccc(cc1)Br 5af6e1de133ac6c38132d9c2bb719737 [0,2,0,0,0,0|1,0,1]=4 2550 B12R1.1 N#CNCCc1ccc(cc1)Cl cbc80e9cb78aa388d33fe02e66366e8b [0,2,0,0,0,0|1,0,1]=4 2551 B12R1.1 N#CNCCc1ccc(cc1)F e895d9ad10cddcab11108a5f8ab4f2fe [0,2,0,0,0,0|1,0,1]=4 2552 B12R1.1 N#CNCCc1ccc(cc1)I cde595034f34d325dee902f9ed2025d5 [0,2,0,0,0,0|1,0,1]=4 2553 B12R1.1 NOCCNc1cc[n+](cc1)[O-] 14eb1e743871936eff584908f3932f7e [0,2,0,0,0,0|2,0,0]=4 2554 B12R1.1 NOCCNc1ccc(=O)oc1 440e1f5e13c4d32f107417bc0ceec919 [0,2,0,0,0,0|2,0,0]=4 2555 B12R1.1 NOCCNc1ccc(cc1)F caf25c2963581047ad41b7e88666963f [0,2,0,0,0,0|1,0,0]=3 2556 B12R1.1 NOCCNc1ccc(cc1)O b2930c85d84e10dbce5d42dfc999ba2b [0,2,0,0,0,0|1,0,0]=3 2557 B12R1.1 NOCCNc1ccc(cc1)S cb8034b8223cfa8a8dc946c642ad80f2 [0,2,0,0,0,0|1,0,0]=3 2558 B12R1.1 NOCCNc1ccc(cn1)F d893ebed037d683885807ce6ec55ee2e [0,2,0,0,0,0|2,0,0]=4 2559 B12R1.1 NOCCNc1ccc(cn1)O b75be59848970717b1d60d245135ef5a [0,2,0,0,0,0|2,0,0]=4 2560 B12R1.1 NOCCNc1ccc(cn1)S 6ae7213432f972b499d21580f1252f7f [0,2,0,0,0,0|2,0,0]=4 2561 B12R1.1 NOCCNc1ccc(nc1)F 100c4ca5f972d12f773915a8b38e9da9 [0,2,0,0,0,0|2,0,0]=4 2562 B12R1.1 NOCCNc1ccc(nc1)O 5e797834374302c92433dc4a99df3163 [0,2,0,0,0,0|2,0,0]=4 2563 B12R1.1 NOCCNc1ccc(nc1)S ef9bf8da7121785bde7b2b83bd8e2047 [0,2,0,0,0,0|2,0,0]=4 2564 B12R1.1 O=CCCNc1ccc(cc1)Br dde51ba57234caeb939990ef0fa7161a [0,2,0,0,0,0|2,0,0]=4 2565 B12R1.1 O=CCCNc1ccc(cc1)Cl 1c9e53317b67a8eb919529e73dd018eb [0,2,0,0,0,0|2,0,0]=4 2566 B12R1.1 O=CCCNc1ccc(cc1)F 6620206edb076ba4ccb0f83353882a47 [0,2,0,0,0,0|2,0,0]=4 2567 B12R1.1 O=CCCNc1ccc(cc1)I 2bb6676c2fba515a9f81ca8b31a18089 [0,2,0,0,0,0|2,0,0]=4 2568 B12R1.1 O=CCCNc1ccc(cc1)S 10e69c977dbd78c72025cda05b1b392c [0,2,0,0,0,0|2,0,0]=4 2569 B12R1.1 O=CCCOc1ccc(cc1)Br 168933e61687a136a2428b93ef5d5f2b [0,2,0,0,0,0|2,0,0]=4 2570 B12R1.1 O=CCCOc1ccc(cc1)Cl 14a2963beea9531edf89833e7b71e20f [0,2,0,0,0,0|2,0,0]=4 2571 B12R1.1 O=CCCOc1ccc(cc1)F faf7c88b14f0cba96a8f556c33150c7d [0,2,0,0,0,0|2,0,0]=4 2572 B12R1.1 O=CCCOc1ccc(cc1)I ae706f156765b9464e92af27efe68187 [0,2,0,0,0,0|2,0,0]=4 2573 B12R1.1 O=CCCOc1ccc(cc1)S e480416402ac6e5c711befb67984f120 [0,2,0,0,0,0|2,0,0]=4 2574 B12R1.1 O=CCNCc1ccc(cc1)Br aadd0aa04b6e1d822369956fc50e961e [0,2,0,0,0,0|2,0,0]=4 2575 B12R1.1 O=CCNCc1ccc(cc1)Cl 276c48c9807f7c2e40ffaa6215b95f81 [0,2,0,0,0,0|2,0,0]=4 2576 B12R1.1 O=CCNCc1ccc(cc1)F b854f00a436220abaed49b212476819d [0,2,0,0,0,0|2,0,0]=4 2577 B12R1.1 O=CCNCc1ccc(cc1)I 9e4b5bf2642437ac5117f4af035042d7 [0,2,0,0,0,0|2,0,0]=4 2578 B12R1.1 O=CCOCc1ccc(cc1)Br 964e9f0b16db215b339a5998e6b7fff0 [0,2,0,0,0,0|2,0,0]=4 2579 B12R1.1 O=CCOCc1ccc(cc1)Cl 454918d130496d6a30dd3a1e9377379b [0,2,0,0,0,0|2,0,0]=4 2580 B12R1.1 O=CCOCc1ccc(cc1)F f2796350cb71ee405156e809a8425ec3 [0,2,0,0,0,0|2,0,0]=4 2581 B12R1.1 O=CCOCc1ccc(cc1)I 822fe2084fbb4379dd51e0ae724552e3 [0,2,0,0,0,0|2,0,0]=4 2582 B12R1.1 O=CCOCc1ccc(cc1)S 3bec55209d86571d15544044e5a56622 [0,2,0,0,0,0|2,0,0]=4 2583 B12R1.1 O=CNCCc1ccc(cc1)Br a5a16a79ad0baaae73c660257a39d530 [0,2,0,0,0,0|1,0,1]=4 2584 B12R1.1 O=CNCCc1ccc(cc1)Cl be760cbfa8f8e9a7d79b547f1b10042e [0,2,0,0,0,0|1,0,1]=4 2585 B12R1.1 O=CNCCc1ccc(cc1)F ac9fa43783b7ac50441089746444e45f [0,2,0,0,0,0|1,0,1]=4 2586 B12R1.1 O=CNCCc1ccc(cc1)I d81b8242c0f14e904792d884acb27d54 [0,2,0,0,0,0|1,0,1]=4 2587 B12R1.1 O=CNCCc1ccc(cc1)O 106440dbcf54d08c4e629d45ea4fefe3 [0,2,0,0,0,0|1,0,1]=4 2588 B12R1.1 OCCCNc1ccc(cc1)Br c7951d3f685379f9502fe06476a8a338 [0,2,0,0,0,0|2,0,0]=4 2589 B12R1.1 OCCCNc1ccc(cc1)Cl daf88a5c918ec152659114da1e30ab3c [0,2,0,0,0,0|2,0,0]=4 2590 B12R1.1 OCCCNc1ccc(cc1)F f5c38cbd68e54fb5a6696dcdebb82fdd [0,2,0,0,0,0|2,0,0]=4 2591 B12R1.1 OCCCNc1ccc(cc1)I 4f547e26d083aba907ed147824b03f37 [0,2,0,0,0,0|2,0,0]=4 2592 B12R1.1 OCCCNc1ccc(cc1)S ed2c306a27bfa097af4b417d17f2c1d8 [0,2,0,0,0,0|2,0,0]=4 2593 B12R1.1 OCCNCc1ccc(cc1)Br ef6e3fa863da8b0ba7364e1e488bf0ff [0,2,0,0,0,0|2,0,0]=4 2594 B12R1.1 OCCNCc1ccc(cc1)Cl 6c37f4b1fbba8d005a13e10baf3e7b47 [0,2,0,0,0,0|2,0,0]=4 2595 B12R1.1 OCCNCc1ccc(cc1)F 50a3277b116202ff95f82e2866b4ac22 [0,2,0,0,0,0|2,0,0]=4 2596 B12R1.1 OCCNCc1ccc(cc1)I 458e55b24e97288bd9d15144f3597933 [0,2,0,0,0,0|2,0,0]=4 2597 B12R1.1 OCNCCc1ccc(cc1)Br 5002fae370904c851fcde267599347c5 [0,2,0,0,0,0|1,0,0]=3 2598 B12R1.1 OCNCCc1ccc(cc1)Cl b2f32d28efbf4a7328eb35278d7709ed [0,2,0,0,0,0|1,0,0]=3 2599 B12R1.1 OCNCCc1ccc(cc1)F acbd4fb4b98e7917bf59751c1a5767da [0,2,0,0,0,0|1,0,0]=3 2600 B12R1.1 OCNCCc1ccc(cc1)I 5ed81d2dff56905aa39a602a1ea05bf7 [0,2,0,0,0,0|1,0,0]=3 2601 B12R1.1 OCNCCc1ccc(cn1)Br 4d5386d701019a26c592831438abdd7d [0,2,0,0,0,0|2,0,0]=4 2602 B12R1.1 OCNCCc1ccc(nc1)Br 7131c524bb30ab06b3079194ab76d875 [0,2,0,0,0,0|2,0,0]=4 2603 B12R1.1 OCNCCc1ccc(nc1)Cl 62607623d9b116cff288a382eef9fedd [0,2,0,0,0,0|2,0,0]=4 2604 B12R1.1 SCCCNc1ccc(cc1)Br 673d1851b71367718c45adf05845ceaa [0,2,0,0,0,0|2,0,0]=4 2605 B12R1.1 SCCCNc1ccc(cc1)Cl 48cecf77a4174329c4700db38a4923fa [0,2,0,0,0,0|2,0,0]=4 2606 B12R1.1 SCCCNc1ccc(cc1)I fc13b5f65462ddc42440f3d14018bcf0 [0,2,0,0,0,0|2,0,0]=4 2607 B12R1.1 SCCCNc1ccc(cc1)S 77f3bacf148ffbd8fcb02f2c9febd22f [0,2,0,0,0,0|2,0,0]=4 2608 B12R1.1 SCCCOc1ccc(cc1)Br 7ca5bad08bfa0faf908f2dd33e57fbf2 [0,2,0,0,0,0|2,0,0]=4 2609 B12R1.1 SCCCOc1ccc(cc1)Cl e7e571903ae970359ea1c0b405e7c866 [0,2,0,0,0,0|2,0,0]=4 2610 B12R1.1 SCCCOc1ccc(cc1)I bb2c23c36e855dc46050222cfb9e48f6 [0,2,0,0,0,0|2,0,0]=4 2611 B12R1.1 SCCCOc1ccc(cc1)S 8bb8c6d061913fa2e38214e821fbd3fe [0,2,0,0,0,0|2,0,0]=4 2612 B12R1.1 SCCNCc1ccc(cc1)Br 824fa5cab6b3a6974481f539afbe2bf5 [0,2,0,0,0,0|2,0,0]=4 2613 B12R1.1 SCCNCc1ccc(cc1)Cl f3086d3f6a4f0ccf5a4881ad8509ed8c [0,2,0,0,0,0|2,0,0]=4 2614 B12R1.1 SCCNCc1ccc(cc1)I b9abcd8140e30ab1ff59b2cb841a7fd1 [0,2,0,0,0,0|2,0,0]=4 2615 B12R1.1 SCCOCc1ccc(cc1)Br 2cf76b2330f709226506aa2b36f077ca [0,2,0,0,0,0|2,0,0]=4 2616 B12R1.1 SCCOCc1ccc(cc1)Cl baca89a988859fc7b8aeb01fb3e1a1bf [0,2,0,0,0,0|2,0,0]=4 2617 B12R1.1 SCCOCc1ccc(cc1)I ab7879817cec768a48a5852d80ffb645 [0,2,0,0,0,0|2,0,0]=4 2618 B12R1.1 SCCOCc1ccc(cc1)S 5ec6089e109e3d3e513687503d2120da [0,2,0,0,0,0|2,0,0]=4 2619 B12R1.1 Sc1ccc(cc1)NCCCCl e2d433918759b3bb6ce75d96391dcab0 [0,2,0,0,0,0|2,0,0]=4 2620 B12R1.16 CCCN(C)c1ccc(cc1)Br e61bdd8a108f27231a2f1e4f464a0449 [0,2,0,0,0,0|2,0,0]=4 2621 B12R1.16 CCCN(C)c1ccc(cc1)Cl 8843e79cc118a8b39cb7a4677c22e893 [0,2,0,0,0,0|2,0,0]=4 2622 B12R1.16 CCCN(C)c1ccc(cc1)F b2f2c1c375300f70a9f9d3af7ea22019 [0,2,0,0,0,0|2,0,0]=4 2623 B12R1.16 CCCN(C)c1ccc(cc1)I b6bdb6a0f5c52c6e29ef784cbc5fe7ee [0,2,0,0,0,0|2,0,0]=4 2624 B12R1.16 CCCN(C)c1ccc(cc1)S ed9ea5c5681310eb4dd3a9ca34a4baf1 [0,2,0,0,0,0|2,0,0]=4 2625 B12R1.16 CCNC(C)c1ccc(cc1)C a50a292b0f9ab98a935a045bf6f5df18 [0,2,0,0,0,0|2,0,0]=4 2626 B12R1.16 CCNC(C)c1ccc(cc1)F 90b07bc2b2295f4c41db42242c518735 [0,2,0,0,0,0|2,0,0]=4 2627 B12R1.16 CCNC(C)c1ccc(cc1)I 08a361f82931829d0267b9a6741fe60a [0,2,0,0,0,0|2,0,0]=4 2628 B12R1.16 CCN[C@@H](C)c1ccc(cc1)C 0ed8e55d6183d258b51cdca6296060eb [0,2,0,0,0,0|2,0,0]=4 2629 B12R1.16 CCN[C@@H](C)c1ccc(cc1)F 1cdeff47614cd0408e972403b21ec1f4 [0,2,0,0,0,0|2,0,0]=4 2630 B12R1.16 CCN[C@@H](C)c1ccc(cc1)I d8251c0e8ba76150b133d569aa22ac48 [0,2,0,0,0,0|2,0,0]=4 2631 B12R1.16 CCN[C@H](C)c1ccc(cc1)C 156165d95a1b59d54961645431890c7a [0,2,0,0,0,0|2,0,0]=4 2632 B12R1.16 CCN[C@H](C)c1ccc(cc1)F ae87029077c5b327ded4690eccde6389 [0,2,0,0,0,0|2,0,0]=4 2633 B12R1.16 CCN[C@H](C)c1ccc(cc1)I 2a878af2411beb0b90eb41ee2af406ec [0,2,0,0,0,0|2,0,0]=4 2634 B12R1.16 CCOC(C)c1ccc(cc1)Br 982b0de4fe585ef0ed4de9a2ad175c76 [0,2,0,0,0,0|2,0,0]=4 2635 B12R1.16 CCOC(C)c1ccc(cc1)C 396c60b3d54a12f6e40154fa61bed9a2 [0,2,0,0,0,0|2,0,0]=4 2636 B12R1.16 CCOC(C)c1ccc(cc1)Cl f3e42c6226de75401fcbe78959e283b4 [0,2,0,0,0,0|2,0,0]=4 2637 B12R1.16 CCOC(C)c1ccc(cc1)F aa2360b399b3a087ca1f4c68307ca7f9 [0,2,0,0,0,0|2,0,0]=4 2638 B12R1.16 CCOC(C)c1ccc(cc1)I df7946fcea9073fd52039fd14b542186 [0,2,0,0,0,0|2,0,0]=4 2639 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Br baebd2a419f28b0a8d634bb2e1beabd2 [0,2,0,0,0,0|2,0,0]=4 2640 B12R1.16 CCO[C@@H](C)c1ccc(cc1)C 4b30f3a8366a8fb2f9c8e9aab05e6a26 [0,2,0,0,0,0|2,0,0]=4 2641 B12R1.16 CCO[C@@H](C)c1ccc(cc1)Cl b58e0ece298e7501aaf1b8b3f7a60aa4 [0,2,0,0,0,0|2,0,0]=4 2642 B12R1.16 CCO[C@@H](C)c1ccc(cc1)F 4ecc8dc42f537f03870cfcf5e10780d9 [0,2,0,0,0,0|2,0,0]=4 2643 B12R1.16 CCO[C@@H](C)c1ccc(cc1)I c1b200e42035110d73ed51b5e0160363 [0,2,0,0,0,0|2,0,0]=4 2644 B12R1.16 CCO[C@H](C)c1ccc(cc1)Br ad3a9b113cf467bd3633b78e4753cf67 [0,2,0,0,0,0|2,0,0]=4 2645 B12R1.16 CCO[C@H](C)c1ccc(cc1)C 2b0a96f73189e636184d743f74d1f9b2 [0,2,0,0,0,0|2,0,0]=4 2646 B12R1.16 CCO[C@H](C)c1ccc(cc1)Cl 733a1736cadd5d822b040a3bf9e6e663 [0,2,0,0,0,0|2,0,0]=4 2647 B12R1.16 CCO[C@H](C)c1ccc(cc1)F b784fadab1e81279e11581819d36414a [0,2,0,0,0,0|2,0,0]=4 2648 B12R1.16 CCO[C@H](C)c1ccc(cc1)I 1b18a984c01fe648b9af7b33a1359669 [0,2,0,0,0,0|2,0,0]=4 2649 B12R1.16 COCN(C)c1ccc(cc1)Br 5c3d79f8c883333efa3e489e535b8121 [0,2,0,0,0,0|1,0,0]=3 2650 B12R1.16 COCN(C)c1ccc(cc1)C 260a9b4be5f588be4c5cb528cb614c98 [0,2,0,0,0,0|1,0,0]=3 2651 B12R1.16 COCN(C)c1ccc(cc1)Cl 414d21cc2de4691930f611c0fc20992c [0,2,0,0,0,0|1,0,0]=3 2652 B12R1.16 COCN(C)c1ccc(cc1)F 1014ccace74e2a32c2b4daac55daf6ce [0,2,0,0,0,0|1,0,0]=3 2653 B12R1.16 COCN(C)c1ccc(cc1)I fa26c64233841ba8e1240eb81e88c955 [0,2,0,0,0,0|1,0,0]=3 2654 B12R1.16 COCN(C)c1ccc(cc1)S 780cd73c99e79417e165649842ab3742 [0,2,0,0,0,0|1,0,0]=3 2655 B12R1.16 COCN(C)c1ccc(cn1)Br 94272689f754c551672866a814ef9f99 [0,2,0,0,0,0|2,0,0]=4 2656 B12R1.16 COCN(C)c1ccc(cn1)C 9d407732ece2dfab1a2942ac0079db70 [0,2,0,0,0,0|2,0,0]=4 2657 B12R1.16 COCN(C)c1ccc(cn1)Cl aede7f840a6cf8270191dfd570f51644 [0,2,0,0,0,0|2,0,0]=4 2658 B12R1.16 COCN(C)c1ccc(cn1)F 7cf87fa7dc7bbdf0188fa7417925045e [0,2,0,0,0,0|2,0,0]=4 2659 B12R1.16 COCN(C)c1ccc(cn1)I 4e28bf41dfe01ac210ef9cba7e524575 [0,2,0,0,0,0|2,0,0]=4 2660 B12R1.16 COCN(C)c1ccc(nc1)Br 8ad2ad1276a4a3bd19f628b735f47ba8 [0,2,0,0,0,0|2,0,0]=4 2661 B12R1.16 COCN(C)c1ccc(nc1)C 93dcfe92f9520efbc8156c858be4f502 [0,2,0,0,0,0|2,0,0]=4 2662 B12R1.16 COCN(C)c1ccc(nc1)Cl ca87f2e0379b7ce69bfaea1483796874 [0,2,0,0,0,0|2,0,0]=4 2663 B12R1.16 COCN(C)c1ccc(nc1)F 85607aa29ddaf8bd52496f002e9f08b5 [0,2,0,0,0,0|2,0,0]=4 2664 B12R1.16 CSCN(C)c1ccc(cc1)Br bb70e9c062394c04a8b3a95ef61fd0f1 [0,2,0,0,0,0|1,1,0]=4 2665 B12R1.16 CSCN(C)c1ccc(cc1)C 4795340d58f6ab15f6b51f3965e940df [0,2,0,0,0,0|1,1,0]=4 2666 B12R1.16 CSCN(C)c1ccc(cc1)Cl ed7b121c4e32ac4e8ef90b5ef10dbf54 [0,2,0,0,0,0|1,1,0]=4 2667 B12R1.16 CSCN(C)c1ccc(cc1)F ac19d1d5c40a194c4232c5721c0b70f9 [0,2,0,0,0,0|1,1,0]=4 2668 B12R1.16 CSCN(C)c1ccc(cc1)I 17db1b2626f4f373d290e9cef040215c [0,2,0,0,0,0|1,1,0]=4 2669 B12R1.16 CSCN(C)c1ccc(cc1)S f36f517d4ebd372f801e64a425b8a1d3 [0,2,0,0,0,0|1,1,0]=4 2670 B12R1.21 C=C(C)CNc1ccc(cc1)Br 8dc7c710ab065447c48123f5bcedf0d7 [0,2,0,0,0,0|2,0,0]=4 2671 B12R1.21 C=C(C)CNc1ccc(cc1)C b9648f75e96e288122c1f1f52f17747f [0,2,0,0,0,0|2,0,0]=4 2672 B12R1.21 C=C(C)CNc1ccc(cc1)Cl 220d67265de58d61a8991b9e2785ee2d [0,2,0,0,0,0|2,0,0]=4 2673 B12R1.21 C=C(C)CNc1ccc(cc1)F 9baed94ab3d9e5ced3ce874d6c51416e [0,2,0,0,0,0|2,0,0]=4 2674 B12R1.21 C=C(C)CNc1ccc(cc1)I 06dfc038b0a9a5ffed5b770675a3f2a7 [0,2,0,0,0,0|2,0,0]=4 2675 B12R1.21 C=C(C)CNc1ccc(cc1)S 921d107d183b9a1bdcbc25be7b23a76d [0,2,0,0,0,0|2,0,0]=4 2676 B12R1.21 C=C(C)COc1ccc(cc1)Br a11895d937d3f2d9f08464f39279ebc3 [0,2,0,0,0,0|2,0,0]=4 2677 B12R1.21 C=C(C)COc1ccc(cc1)C 4b1d2a823038eb68fdc1b48cdf3bab5c [0,2,0,0,0,0|2,0,0]=4 2678 B12R1.21 C=C(C)COc1ccc(cc1)Cl ea127c52905a815dded5f13c6ffd1cfb [0,2,0,0,0,0|2,0,0]=4 2679 B12R1.21 C=C(C)COc1ccc(cc1)F 676a93816a9a29e23b5ed4b6963c19fe [0,2,0,0,0,0|2,0,0]=4 2680 B12R1.21 C=C(C)COc1ccc(cc1)I 5901a75df5ef921835413fe721bc19b6 [0,2,0,0,0,0|2,0,0]=4 2681 B12R1.21 C=C(C)COc1ccc(cc1)S e1438e91dbf00b53d040faf3c1a65953 [0,2,0,0,0,0|2,0,0]=4 2682 B12R1.21 CC(=O)CNc1ccc(cc1)C c6df41938fb73851720b8d504c48231e [0,2,0,0,0,0|2,0,0]=4 2683 B12R1.21 CC(=O)CNc1ccc(cc1)F 9780023b225d3200ffd10d583c37ffdb [0,2,0,0,0,0|2,0,0]=4 2684 B12R1.21 CC(=O)CNc1ccc(cc1)S 423de7376f76e98fc0bb1a5337720e0a [0,2,0,0,0,0|2,0,0]=4 2685 B12R1.21 CC(=O)NCc1ccc(cc1)Br d2cc47a2d2f5d0454a6ab6aa9be01b2e [0,2,0,0,0,0|2,0,0]=4 2686 B12R1.21 CC(=O)NCc1ccc(cc1)C 6d1c8fe2cbf40141f0ff7216820c0ba5 [0,2,0,0,0,0|2,0,0]=4 2687 B12R1.21 CC(=O)NCc1ccc(cc1)Cl 932ef7783d78c6800f8298437d4b88f9 [0,2,0,0,0,0|2,0,0]=4 2688 B12R1.21 CC(=O)NCc1ccc(cc1)F c15fb7f7daa1d8d13002cf39462c9e3a [0,2,0,0,0,0|2,0,0]=4 2689 B12R1.21 CC(=O)NCc1ccc(cc1)I 638cbc421d0f9cd22ecaa35e0d864cbc [0,2,0,0,0,0|2,0,0]=4 2690 B12R1.21 CC(=O)NCc1ccc(cc1)O 3eb259396d79ab6b5f53bb6ff52007c0 [0,2,0,0,0,0|2,0,0]=4 2691 B12R1.21 CC(C)CNc1ccc(cc1)Br aafc6d7f6bffefff521c174b2e36cf47 [0,2,0,0,0,0|2,0,0]=4 2692 B12R1.21 CC(C)CNc1ccc(cc1)Cl b590bea18aa2be2fe9530b5825b6b83d [0,2,0,0,0,0|2,0,0]=4 2693 B12R1.21 CC(C)CNc1ccc(cc1)F f869f8ebca9e23d7a314cca58e04355a [0,2,0,0,0,0|2,0,0]=4 2694 B12R1.21 CC(C)CNc1ccc(cc1)I f5ed240cfb530eb638c88433537d6bc6 [0,2,0,0,0,0|2,0,0]=4 2695 B12R1.21 CC(C)CNc1ccc(cc1)S 5aebae70a565a4395c9f06d404e49e19 [0,2,0,0,0,0|2,0,0]=4 2696 B12R1.21 CC(C)COc1ccc(cc1)Br 688e322571e772c33ef9f7f1b70011c4 [0,2,0,0,0,0|2,0,0]=4 2697 B12R1.21 CC(C)COc1ccc(cc1)Cl f021a9169c3057630072da40a25929d0 [0,2,0,0,0,0|2,0,0]=4 2698 B12R1.21 CC(C)COc1ccc(cc1)F 041d5d9f7bc26d03338ae74cc974acbe [0,2,0,0,0,0|2,0,0]=4 2699 B12R1.21 CC(C)COc1ccc(cc1)I c8700cb8e6ceb84be023f81a6b63abe0 [0,2,0,0,0,0|2,0,0]=4 2700 B12R1.21 CC(C)COc1ccc(cc1)S 93dc663c86ffdc9dd467a4fa1c50d8c7 [0,2,0,0,0,0|2,0,0]=4 2701 B12R1.21 CC(C)NCc1ccc(cc1)Br 37c09d76c90c7ae49ec6a65ce3a6a041 [0,2,0,0,0,0|2,0,0]=4 2702 B12R1.21 CC(C)NCc1ccc(cc1)Cl 19728114897127fa755988490a2025d5 [0,2,0,0,0,0|2,0,0]=4 2703 B12R1.21 CC(C)NCc1ccc(cc1)F 76a0754a7751d3d66ff80ab158c9f2b0 [0,2,0,0,0,0|2,0,0]=4 2704 B12R1.21 CC(C)NCc1ccc(cc1)I 49ceb1852914812d45311ac4b38b1f31 [0,2,0,0,0,0|2,0,0]=4 2705 B12R1.21 CC(C)OCc1ccc(cc1)Br bb4176ce0b9ad4d7fb8568832a43e29a [0,2,0,0,0,0|2,0,0]=4 2706 B12R1.21 CC(C)OCc1ccc(cc1)Cl abfc8ca1cd1171daf8ae63ae6bec02b0 [0,2,0,0,0,0|2,0,0]=4 2707 B12R1.21 CC(C)OCc1ccc(cc1)F ac9a18f3d487a18e76f77222965a393f [0,2,0,0,0,0|2,0,0]=4 2708 B12R1.21 CC(C)OCc1ccc(cc1)I a45cec946311a49c5890d06f9a04aef0 [0,2,0,0,0,0|2,0,0]=4 2709 B12R1.21 CC(C)OCc1ccc(cc1)S 8bebaeb2cc5402024d06e9416cbf6988 [0,2,0,0,0,0|2,0,0]=4 2710 B12R1.21 CC(O)CNc1ccc(cc1)Br 6cc2dd3906a998fe7a5d4e2a8d208d21 [0,2,0,0,0,0|2,0,0]=4 2711 B12R1.21 CC(O)CNc1ccc(cc1)Cl 30612ac8d45eff6171f59f16b2492f67 [0,2,0,0,0,0|2,0,0]=4 2712 B12R1.21 CC(O)CNc1ccc(cc1)F 44764ce23148993885c02e8cea63902c [0,2,0,0,0,0|2,0,0]=4 2713 B12R1.21 CC(O)CNc1ccc(cc1)I 8fb5974b6715edad9e8863320d6bae04 [0,2,0,0,0,0|2,0,0]=4 2714 B12R1.21 CC(O)CNc1ccc(cc1)S 6ef936aebb7976c5c92d176540ed67f0 [0,2,0,0,0,0|2,0,0]=4 2715 B12R1.21 CN(C)CNc1ccc(cc1)Br d70bd3e201d4e3984a2cbe371116b356 [0,2,0,0,0,0|2,0,0]=4 2716 B12R1.21 CN(C)CNc1ccc(cc1)Cl 84d82794d22fd2615e84d614fa4d76e4 [0,2,0,0,0,0|2,0,0]=4 2717 B12R1.21 CN(C)CNc1ccc(cc1)F c53489144a229a82a42fe108426a5611 [0,2,0,0,0,0|2,0,0]=4 2718 B12R1.21 CN(C)CNc1ccc(cc1)I 9ce69571ab45326b30512a54a577d9b1 [0,2,0,0,0,0|2,0,0]=4 2719 B12R1.21 CN(C)CNc1ccc(cc1)S 5aa5c6e46c584a58cd79277c7decaaf0 [0,2,0,0,0,0|2,0,0]=4 2720 B12R1.21 CN(C)COc1ccc(cc1)Br 1ae60d05f401b4677bf02579aec9f4e3 [0,2,0,0,0,0|2,0,0]=4 2721 B12R1.21 CN(C)COc1ccc(cc1)Cl 31a0679c78f3b12cc66bbe20f49b9a4e [0,2,0,0,0,0|2,0,0]=4 2722 B12R1.21 CN(C)COc1ccc(cc1)F 47f9c488aaff7ce417b7673dfdc64bd4 [0,2,0,0,0,0|2,0,0]=4 2723 B12R1.21 CN(C)COc1ccc(cc1)I 2c421eec61bc06e369712388216897f9 [0,2,0,0,0,0|2,0,0]=4 2724 B12R1.21 CN(C)COc1ccc(cc1)S 90858c38fd8e55792e84d69d8884b1c6 [0,2,0,0,0,0|2,0,0]=4 2725 B12R1.21 C[C@@H](O)CNc1ccc(cc1)Br 2ad4df23c69dfa44e26a216951079c17 [0,2,0,0,0,0|2,0,0]=4 2726 B12R1.21 C[C@@H](O)CNc1ccc(cc1)F d13032a00d782f9fd58bde9b7b7e5b40 [0,2,0,0,0,0|2,0,0]=4 2727 B12R1.21 C[C@@H](O)CNc1ccc(cc1)I fcafc0398c9f6631b1e264180519d9a5 [0,2,0,0,0,0|2,0,0]=4 2728 B12R1.21 C[C@@H](O)CNc1ccc(cc1)S c5036038618daf9d110f2837b38cc7f0 [0,2,0,0,0,0|2,0,0]=4 2729 B12R1.21 C[C@H](O)CNc1ccc(cc1)Br dfc814dc76baf36262caaec8d25f4215 [0,2,0,0,0,0|2,0,0]=4 2730 B12R1.21 C[C@H](O)CNc1ccc(cc1)Cl 8fb7f0b55d9fe9f1cdafd45ef42c2de4 [0,2,0,0,0,0|2,0,0]=4 2731 B12R1.21 C[C@H](O)CNc1ccc(cc1)F 4385cb997d0b526c90619c1645b8b1ad [0,2,0,0,0,0|2,0,0]=4 2732 B12R1.21 C[C@H](O)CNc1ccc(cc1)I 7222c72737ac92de3960850b939145d2 [0,2,0,0,0,0|2,0,0]=4 2733 B12R1.21 C[C@H](O)CNc1ccc(cc1)S 638aabe1512824e4dc38e2389b85f596 [0,2,0,0,0,0|2,0,0]=4 2734 B12R1.21 Cc1ccc(cc1)CNC(C)C 9f3293af5f5347150ac2434f1c0f5ea3 [0,2,0,0,0,0|2,0,0]=4 2735 B12R1.21 Cc1ccc(cc1)COC(C)C 7eda3a9e7a3c4601d0edf3097f1c1fb1 [0,2,0,0,0,0|2,0,0]=4 2736 B12R1.21 Cc1ccc(cc1)NCC(C)C d33fe3d6c1e672a348e9fedb377a9185 [0,2,0,0,0,0|2,0,0]=4 2737 B12R1.21 Cc1ccc(cc1)NCC(C)O 8379462492ffae9a9aea5a1dcd1f96eb [0,2,0,0,0,0|2,0,0]=4 2738 B12R1.21 Cc1ccc(cc1)NCN(C)C f410d4238a7fc65021317765c852db2f [0,2,0,0,0,0|2,0,0]=4 2739 B12R1.21 Cc1ccc(cc1)NC[C@@H](C)O a5239ddc3731748474623fb5c2811c3d [0,2,0,0,0,0|2,0,0]=4 2740 B12R1.21 Cc1ccc(cc1)NC[C@H](C)O 07456d37e9494f0c908a5c4ac8161df3 [0,2,0,0,0,0|2,0,0]=4 2741 B12R1.21 Cc1ccc(cc1)OCC(C)C c1aa096b3782800b4571efa5c0f498bc [0,2,0,0,0,0|2,0,0]=4 2742 B12R1.21 Cc1ccc(cc1)OCN(C)C 8df4da1e8ff5f1a2a333a699e01425b0 [0,2,0,0,0,0|2,0,0]=4 2743 B12R1.49 CCC(C)Nc1ccc(cc1)Br 4d1c483cf4afbfba9a2f8d3db94bec3f [0,2,0,0,0,0|2,0,0]=4 2744 B12R1.49 CCC(C)Nc1ccc(cc1)C 3b1fa0514d720f4b3db404292b778124 [0,2,0,0,0,0|2,0,0]=4 2745 B12R1.49 CCC(C)Nc1ccc(cc1)Cl 76d63efd5fc59378ea17379a47e7b19f [0,2,0,0,0,0|2,0,0]=4 2746 B12R1.49 CCC(C)Nc1ccc(cc1)F e00a92636e95efc27604581ea177b931 [0,2,0,0,0,0|2,0,0]=4 2747 B12R1.49 CCC(C)Nc1ccc(cc1)I 442f4ce893379ae3f70afc3980567446 [0,2,0,0,0,0|2,0,0]=4 2748 B12R1.49 CCC(C)Nc1ccc(cc1)S d4e426a89d91db8144c9fb2dff511b9d [0,2,0,0,0,0|2,0,0]=4 2749 B12R1.49 CCC(C)Oc1ccc(cc1)Br e9ac760eb966c46626ad8cc78ce8ab95 [0,2,0,0,0,0|2,0,0]=4 2750 B12R1.49 CCC(C)Oc1ccc(cc1)C 7e96b7f640ec60a64eac66e0769be3a7 [0,2,0,0,0,0|2,0,0]=4 2751 B12R1.49 CCC(C)Oc1ccc(cc1)Cl e4591e0baef7f8d77d4837bf4d9fdb37 [0,2,0,0,0,0|2,0,0]=4 2752 B12R1.49 CCC(C)Oc1ccc(cc1)F c16cd2d17d48a9601c3d676d21db62eb [0,2,0,0,0,0|2,0,0]=4 2753 B12R1.49 CCC(C)Oc1ccc(cc1)I 1f03b3dddba16cff63099651f2c3fd3b [0,2,0,0,0,0|2,0,0]=4 2754 B12R1.49 CCC(C)Oc1ccc(cc1)S d9f5a2f73690dbd57408915a8a39b443 [0,2,0,0,0,0|2,0,0]=4 2755 B12R1.49 CCN(C)Cc1ccc(cc1)Br 1cd45e4ca45fae9e98f9fb1c46e39cc6 [0,2,0,0,0,0|2,0,0]=4 2756 B12R1.49 CCN(C)Cc1ccc(cc1)C 055291017524f626e0726902d4240145 [0,2,0,0,0,0|2,0,0]=4 2757 B12R1.49 CCN(C)Cc1ccc(cc1)Cl 44a860069a7f680293c76e814fd41a95 [0,2,0,0,0,0|2,0,0]=4 2758 B12R1.49 CCN(C)Cc1ccc(cc1)F 54dace8f30df290c27637058b77ffe21 [0,2,0,0,0,0|2,0,0]=4 2759 B12R1.49 CCN(C)Cc1ccc(cc1)I 5d72761060d288ad1c94906cd08bd152 [0,2,0,0,0,0|2,0,0]=4 2760 B12R1.49 CC[C@@H](C)Nc1ccc(cc1)S cbd8e9c1c5acf2775569733e10999d98 [0,2,0,0,0,0|2,0,0]=4 2761 B12R1.49 CC[C@H](C)Nc1ccc(cc1)S fffd6af76aaef88a5e0ba51aece02cfc [0,2,0,0,0,0|2,0,0]=4 2762 B12R1.69 CCCNc1ccc(cc1Br)Cl 4ee485f21a6afce0a45dee0db6fcab2d [0,2,0,0,0,0|2,0,0]=4 2763 B12R1.69 CCCNc1ccc(cc1Br)I d907b7a022bb4534aee3df1688140927 [0,2,0,0,0,0|2,0,0]=4 2764 B12R1.69 CCCNc1ccc(cc1C)C 6185b042d87676c555d26832467ae984 [0,2,0,0,0,0|2,0,0]=4 2765 B12R1.69 CCCNc1ccc(cc1C)Cl 0de9c53625a1688a5e26d3a55f0307d1 [0,2,0,0,0,0|2,0,0]=4 2766 B12R1.69 CCCNc1ccc(cc1C)F 400ae990bdd403ef4fc25230bf9b7933 [0,2,0,0,0,0|2,0,0]=4 2767 B12R1.69 CCCNc1ccc(cc1C)I 4c61aae67a70f2be3332538a828bed69 [0,2,0,0,0,0|2,0,0]=4 2768 B12R1.69 CCCNc1ccc(cc1Cl)C 535df6daa6c1f64dfc0ffbfa7a0ccf56 [0,2,0,0,0,0|2,0,0]=4 2769 B12R1.69 CCCNc1ccc(cc1Cl)Cl 031e64bc7c2fe5f35d82d0cf25e58fc6 [0,2,0,0,0,0|2,0,0]=4 2770 B12R1.69 CCCNc1ccc(cc1Cl)F 4c47c14c78414719ffc9f05dcb083384 [0,2,0,0,0,0|2,0,0]=4 2771 B12R1.69 CCCNc1ccc(cc1Cl)I 1dab8c84d4ef835eb8564d91aafc3a2c [0,2,0,0,0,0|2,0,0]=4 2772 B12R1.69 CCCNc1ccc(cc1F)Cl 7219f73214cc1540d98449bc7971b5b2 [0,2,0,0,0,0|2,0,0]=4 2773 B12R1.69 CCCNc1ccc(cc1F)I 7d9d5b6be87874b93201b257629a706b [0,2,0,0,0,0|2,0,0]=4 2774 B12R1.69 CCCNc1ccc(cc1I)Br 6ac227d53689ca8535d3e24c6e7a6766 [0,2,0,0,0,0|2,0,0]=4 2775 B12R1.69 CCCNc1ccc(cc1I)C 85d439ba844dc901b2d03dd982fdb88c [0,2,0,0,0,0|2,0,0]=4 2776 B12R1.69 CCCNc1ccc(cc1I)Cl 9b79c3b80646442e88a1bf48010c3b01 [0,2,0,0,0,0|2,0,0]=4 2777 B12R1.69 CCCNc1ccc(cc1I)F bbcaffa7710329585ccd21e9e63f7e0b [0,2,0,0,0,0|2,0,0]=4 2778 B12R1.69 CCCNc1ccc(cc1I)I 65d473e81340fc7d9564a0a9ba1353b8 [0,2,0,0,0,0|2,0,0]=4 2779 B12R1.69 CCCNc1ccc(cc1N)N 18f5d5d646db97c2333feb2817856256 [0,2,0,0,0,0|2,0,0]=4 2780 B12R1.69 CCCNc1ccc(cc1S)Cl 9f02c6bb197664738d5aa90f242f529a [0,2,0,0,0,0|2,0,0]=4 2781 B12R1.69 CCCNc1ccc(cc1S)F 315398dd9ce06b01cb170707e15e8485 [0,2,0,0,0,0|2,0,0]=4 2782 B12R1.69 CCCOc1ccc(cc1Br)Br 550cd51562733edfd304e684ac003840 [0,2,0,0,0,0|2,0,0]=4 2783 B12R1.69 CCCOc1ccc(cc1Br)C 6a9536c279485b11f5ba701f7ed51747 [0,2,0,0,0,0|2,0,0]=4 2784 B12R1.69 CCCOc1ccc(cc1Br)Cl a26dfb1198e3c577fc66947b0ae827cb [0,2,0,0,0,0|2,0,0]=4 2785 B12R1.69 CCCOc1ccc(cc1Br)F 16a3610db87d182cfd6890b9787e1826 [0,2,0,0,0,0|2,0,0]=4 2786 B12R1.69 CCCOc1ccc(cc1Br)I efd522032821cc46341014910fd03e2e [0,2,0,0,0,0|2,0,0]=4 2787 B12R1.69 CCCOc1ccc(cc1C)Br 35b2fac262918c173c78367040b327d7 [0,2,0,0,0,0|2,0,0]=4 2788 B12R1.69 CCCOc1ccc(cc1C)C 6223b1cd5d3b24de7342e635ec882d84 [0,2,0,0,0,0|2,0,0]=4 2789 B12R1.69 CCCOc1ccc(cc1C)Cl 9090f04c61c0eae33fb3de56a1c844dd [0,2,0,0,0,0|2,0,0]=4 2790 B12R1.69 CCCOc1ccc(cc1C)F dd1b06eeeb1194a2f5c8c705ee561afc [0,2,0,0,0,0|2,0,0]=4 2791 B12R1.69 CCCOc1ccc(cc1C)I a73d8aefbcd710efdd4f2cec914dae37 [0,2,0,0,0,0|2,0,0]=4 2792 B12R1.69 CCCOc1ccc(cc1C)S 40524318ce1863894e2be322bf68a89a [0,2,0,0,0,0|2,0,0]=4 2793 B12R1.69 CCCOc1ccc(cc1Cl)Br d30fc6f5778500c90a467646f3e3de1c [0,2,0,0,0,0|2,0,0]=4 2794 B12R1.69 CCCOc1ccc(cc1Cl)C 67022b49be86eab10f361dd913c82e38 [0,2,0,0,0,0|2,0,0]=4 2795 B12R1.69 CCCOc1ccc(cc1Cl)Cl ad5542be8e2a6775eb00eec6785e1949 [0,2,0,0,0,0|2,0,0]=4 2796 B12R1.69 CCCOc1ccc(cc1Cl)F 4743ed312e67abdac7b50e22d1383555 [0,2,0,0,0,0|2,0,0]=4 2797 B12R1.69 CCCOc1ccc(cc1Cl)I aa20bebe4ebee9ffde8b745103d4e1bd [0,2,0,0,0,0|2,0,0]=4 2798 B12R1.69 CCCOc1ccc(cc1F)Br 0f6f48a955a66f733788839c111a70c9 [0,2,0,0,0,0|2,0,0]=4 2799 B12R1.69 CCCOc1ccc(cc1F)C a3351b0c7f934657f9072cc7cafa1598 [0,2,0,0,0,0|2,0,0]=4 2800 B12R1.69 CCCOc1ccc(cc1F)Cl 15f5252d8ea046a7220ff30a3d185db7 [0,2,0,0,0,0|2,0,0]=4 2801 B12R1.69 CCCOc1ccc(cc1F)F 9b2d939eda223f22c46c1592b41519e8 [0,2,0,0,0,0|2,0,0]=4 2802 B12R1.69 CCCOc1ccc(cc1F)I 1926a17dfee299d9eefd536f195159cd [0,2,0,0,0,0|2,0,0]=4 2803 B12R1.69 CCCOc1ccc(cc1I)Br c94cba9957b14abddb913dcaff104073 [0,2,0,0,0,0|2,0,0]=4 2804 B12R1.69 CCCOc1ccc(cc1I)C 0d4b3fd126cd8293051b6b6dbd6983e2 [0,2,0,0,0,0|2,0,0]=4 2805 B12R1.69 CCCOc1ccc(cc1I)Cl 4db3139ad959814ca4d6a21595e75068 [0,2,0,0,0,0|2,0,0]=4 2806 B12R1.69 CCCOc1ccc(cc1I)F 32ec535edf928e8df1f7cd9d67d7ea49 [0,2,0,0,0,0|2,0,0]=4 2807 B12R1.69 CCCOc1ccc(cc1I)I a19d56fdb9acf6dd7e602ba9b46da017 [0,2,0,0,0,0|2,0,0]=4 2808 B12R1.69 CCNCc1ccc(cc1Br)Cl 0c764a4df4cafc377d5dd81994fe17ba [0,2,0,0,0,0|2,0,0]=4 2809 B12R1.69 CCNCc1ccc(cc1C)Br f9969cbc383f5bfce93b11e3888f54d6 [0,2,0,0,0,0|2,0,0]=4 2810 B12R1.69 CCNCc1ccc(cc1C)C 75d8243d029d8d87a1b5c084f35292ec [0,2,0,0,0,0|2,0,0]=4 2811 B12R1.69 CCNCc1ccc(cc1C)Cl bfc053c35f83c31044da14a45e804e79 [0,2,0,0,0,0|2,0,0]=4 2812 B12R1.69 CCNCc1ccc(cc1C)F fb0b7340224415681f4ef75a8b4ecf45 [0,2,0,0,0,0|2,0,0]=4 2813 B12R1.69 CCNCc1ccc(cc1Cl)Br 6c76e4f1ad2a288c85abe91c03e5f7f3 [0,2,0,0,0,0|2,0,0]=4 2814 B12R1.69 CCNCc1ccc(cc1Cl)C 3411b6f786e66247ade84dec8eb3bca7 [0,2,0,0,0,0|2,0,0]=4 2815 B12R1.69 CCNCc1ccc(cc1Cl)Cl c4ebea3a8ec9d27215083f5b50726e9b [0,2,0,0,0,0|2,0,0]=4 2816 B12R1.69 CCNCc1ccc(cc1Cl)F 1b571ebe872ddd83d093932445679421 [0,2,0,0,0,0|2,0,0]=4 2817 B12R1.69 CCNCc1ccc(cc1F)Br 908278b31d0a2d5dbee866707025c903 [0,2,0,0,0,0|2,0,0]=4 2818 B12R1.69 CCNCc1ccc(cc1F)C 99a9f2ce72557e8769932b6d624310dd [0,2,0,0,0,0|2,0,0]=4 2819 B12R1.69 CCNCc1ccc(cc1F)Cl a6c4d922594fde11f20ab9f019b082aa [0,2,0,0,0,0|2,0,0]=4 2820 B12R1.69 CCNCc1ccc(cc1F)F 7b84487dcfdaf3f67ffb722edb655286 [0,2,0,0,0,0|2,0,0]=4 2821 B12R1.69 CCNCc1ccc(cc1F)I 95fa53dcac9fee5a0b47d0cd274031a8 [0,2,0,0,0,0|2,0,0]=4 2822 B12R1.69 CCNCc1ccc(cc1I)Br a294fa58de47f5a82e126116880bba94 [0,2,0,0,0,0|2,0,0]=4 2823 B12R1.69 CCOCc1ccc(cc1Br)Br 55e4ef5cc8bd83eda1d410c376250e83 [0,2,0,0,0,0|2,0,0]=4 2824 B12R1.69 CCOCc1ccc(cc1Br)Cl 72fbedbfe2a80344d88dbfbb02f74664 [0,2,0,0,0,0|2,0,0]=4 2825 B12R1.69 CCOCc1ccc(cc1Br)F 27b8948050f0c12aa82e0cf486f77996 [0,2,0,0,0,0|2,0,0]=4 2826 B12R1.69 CCOCc1ccc(cc1Br)I da4b1ca0f9051785fa1947e4964329f4 [0,2,0,0,0,0|2,0,0]=4 2827 B12R1.69 CCOCc1ccc(cc1C)Br 2b940635e1dc21019cb15af9e36fa41f [0,2,0,0,0,0|2,0,0]=4 2828 B12R1.69 CCOCc1ccc(cc1C)C 26057615b3cfbcb0235508f3c1a02952 [0,2,0,0,0,0|2,0,0]=4 2829 B12R1.69 CCOCc1ccc(cc1C)Cl 8be7d00242c6138a77a7f65ad46fba0c [0,2,0,0,0,0|2,0,0]=4 2830 B12R1.69 CCOCc1ccc(cc1C)F d961c30c3f83778b945b54441240bf67 [0,2,0,0,0,0|2,0,0]=4 2831 B12R1.69 CCOCc1ccc(cc1C)I 8c82a7f7ff9e1b4bfab11177fe051494 [0,2,0,0,0,0|2,0,0]=4 2832 B12R1.69 CCOCc1ccc(cc1Cl)Br fbe8f2d3c2cd1c09d995b95dbfee0f23 [0,2,0,0,0,0|2,0,0]=4 2833 B12R1.69 CCOCc1ccc(cc1Cl)C 18802c05ec5c527e8e1847ab843b79bd [0,2,0,0,0,0|2,0,0]=4 2834 B12R1.69 CCOCc1ccc(cc1Cl)Cl 06f2dda67f6c43b24dac1b61f3f19345 [0,2,0,0,0,0|2,0,0]=4 2835 B12R1.69 CCOCc1ccc(cc1Cl)F a6b421a80046f8e7a365ce0fd5b7e269 [0,2,0,0,0,0|2,0,0]=4 2836 B12R1.69 CCOCc1ccc(cc1Cl)I e76a820ec54eddc69fe3d36a21244709 [0,2,0,0,0,0|2,0,0]=4 2837 B12R1.69 CCOCc1ccc(cc1F)Br 23eb1f422b6157bed4a3dba9fd01a99e [0,2,0,0,0,0|2,0,0]=4 2838 B12R1.69 CCOCc1ccc(cc1F)C d7312b56e32975093a57824f56e19b1f [0,2,0,0,0,0|2,0,0]=4 2839 B12R1.69 CCOCc1ccc(cc1F)Cl 27029f1dc8dca0cc1d33dba1beb7ccef [0,2,0,0,0,0|2,0,0]=4 2840 B12R1.69 CCOCc1ccc(cc1F)F a6d37027a0ebf101ab371ab2fe59f5ac [0,2,0,0,0,0|2,0,0]=4 2841 B12R1.69 CCOCc1ccc(cc1F)I dda6d6d5ee7a40542508a26aedd92b31 [0,2,0,0,0,0|2,0,0]=4 2842 B12R1.69 CCOCc1ccc(cc1I)Br 5ed4ca7f69b2f5796e2d57f6f64a8892 [0,2,0,0,0,0|2,0,0]=4 2843 B12R1.69 CCOCc1ccc(cc1I)C 581696ef32cdc4c6897f02321dcc0a50 [0,2,0,0,0,0|2,0,0]=4 2844 B12R1.69 CCOCc1ccc(cc1I)Cl bc24ebd53bad8b1b73705a1fe51af87e [0,2,0,0,0,0|2,0,0]=4 2845 B12R1.69 CCOCc1ccc(cc1I)F 5348410945f4d992902f12eca19428f7 [0,2,0,0,0,0|2,0,0]=4 2846 B12R1.69 COCNc1ccc(=O)[nH]c1Cl 3eeae290d9cc546bb5961ede5e7749a3 [0,2,0,0,0,0|2,0,0]=4 2847 B12R1.69 COCNc1ccc([nH]c1=S)Cl d8a69efdcf552a67c55afb814a81d4bc [0,2,0,0,0,0|2,0,0]=4 2848 B12R1.69 COCNc1ccc(cc1Br)Cl d7356c5856292e0c084236af11d952d7 [0,2,0,0,0,0|1,0,0]=3 2849 B12R1.69 COCNc1ccc(cc1Br)I aef5373d9bf2e59ab468b1d8dd0be85b [0,2,0,0,0,0|1,0,0]=3 2850 B12R1.69 COCNc1ccc(cc1C)Br 03c72c6d956a1bc2bce620d5658cb01a [0,2,0,0,0,0|1,0,0]=3 2851 B12R1.69 COCNc1ccc(cc1C)C 494f3746e53b0f5e4bb7f8c8f6fe9e22 [0,2,0,0,0,0|1,0,0]=3 2852 B12R1.69 COCNc1ccc(cc1C)Cl 2d1a31388a1262fcffa75c77c9ae0fcc [0,2,0,0,0,0|1,0,0]=3 2853 B12R1.69 COCNc1ccc(cc1C)F 142fa3722139a33e93e9ced56573e44d [0,2,0,0,0,0|1,0,0]=3 2854 B12R1.69 COCNc1ccc(cc1C)I 20c67e64b42cd9a009ea7c42f5b00543 [0,2,0,0,0,0|1,0,0]=3 2855 B12R1.69 COCNc1ccc(cc1Cl)Br c96be233ab49baf2ce4484606997a017 [0,2,0,0,0,0|1,0,0]=3 2856 B12R1.69 COCNc1ccc(cc1Cl)C 731633de65abd2762f9894c895d583ef [0,2,0,0,0,0|1,0,0]=3 2857 B12R1.69 COCNc1ccc(cc1Cl)Cl f87a26ec3699189857b5838bfb7bbb1c [0,2,0,0,0,0|1,0,0]=3 2858 B12R1.69 COCNc1ccc(cc1Cl)F c16a318f8c95f0be9af3a2a3d4b55175 [0,2,0,0,0,0|1,0,0]=3 2859 B12R1.69 COCNc1ccc(cc1Cl)I 3d6dd70ab8413d8bf6ec7a82ceafafca [0,2,0,0,0,0|1,0,0]=3 2860 B12R1.69 COCNc1ccc(cc1F)Cl 6def22eb5719c1e0b1eee10cce3a1e78 [0,2,0,0,0,0|1,0,0]=3 2861 B12R1.69 COCNc1ccc(cc1F)I 2c67e9cca399080f8bdf122c11e518f3 [0,2,0,0,0,0|1,0,0]=3 2862 B12R1.69 COCNc1ccc(cc1F)S 095693d5bf05500609218fa91c764459 [0,2,0,0,0,0|1,0,0]=3 2863 B12R1.69 COCNc1ccc(cc1I)Br 25a14d8ce2ea763c1cc70d92f54d3696 [0,2,0,0,0,0|1,0,0]=3 2864 B12R1.69 COCNc1ccc(cc1I)C ff4208c3938a629877afc6bdf00b6dc2 [0,2,0,0,0,0|1,0,0]=3 2865 B12R1.69 COCNc1ccc(cc1I)Cl ae7ff75be1177407394835e4eccb8af9 [0,2,0,0,0,0|1,0,0]=3 2866 B12R1.69 COCNc1ccc(cc1I)F 1008a25b9752afd3dbb147214e2a0d40 [0,2,0,0,0,0|1,0,0]=3 2867 B12R1.69 COCNc1ccc(cc1I)I 191734a48c5b352cdc0f8c20998191dd [0,2,0,0,0,0|1,0,0]=3 2868 B12R1.69 COCNc1ccc(cc1S)Br 299e36008c8efa6fbcf391c714f5877c [0,2,0,0,0,0|1,0,0]=3 2869 B12R1.69 COCNc1ccc(cc1S)Cl 97d2a0712f60b10fb8609b6976e10dad [0,2,0,0,0,0|1,0,0]=3 2870 B12R1.69 COCNc1ccc(cc1S)F 2e4ee8a649e0f89b5545d7d2703d1a30 [0,2,0,0,0,0|1,0,0]=3 2871 B12R1.69 COCNc1ccc(nc1Br)Br 8da639182fcf204a480f10212c490b14 [0,2,0,0,0,0|2,0,0]=4 2872 B12R1.69 COCNc1ccc(nc1Br)C da2322867f4e85fbf286fbf8d1983e3c [0,2,0,0,0,0|2,0,0]=4 2873 B12R1.69 COCNc1ccc(nc1Br)Cl e27ec3449c9ca39aa6024e3c380bf6a1 [0,2,0,0,0,0|2,0,0]=4 2874 B12R1.69 COCNc1ccc(nc1Br)F f9d303d8e8f9aef2774458570c282168 [0,2,0,0,0,0|2,0,0]=4 2875 B12R1.69 COCNc1ccc(nc1C)Br 4e24a0c4d2ba156f6eb125bde20dd982 [0,2,0,0,0,0|2,0,0]=4 2876 B12R1.69 COCNc1ccc(nc1C)C cb2f2fcfad9a1158079e720d2aa3b695 [0,2,0,0,0,0|2,0,0]=4 2877 B12R1.69 COCNc1ccc(nc1C)Cl fe8363b21e1b3041ec8b7cb1250ae030 [0,2,0,0,0,0|2,0,0]=4 2878 B12R1.69 COCNc1ccc(nc1C)F 9c4299529f27da0b8beed499292b5bd8 [0,2,0,0,0,0|2,0,0]=4 2879 B12R1.69 COCNc1ccc(nc1Cl)Br 8c2a7fb9cff8f69273a7448e12b99a02 [0,2,0,0,0,0|2,0,0]=4 2880 B12R1.69 COCNc1ccc(nc1Cl)C 9def9b608acaded72525ef7ea536958c [0,2,0,0,0,0|2,0,0]=4 2881 B12R1.69 COCNc1ccc(nc1Cl)Cl 2fa05b29741109df8b92082726d91fed [0,2,0,0,0,0|2,0,0]=4 2882 B12R1.69 COCNc1ccc(nc1Cl)F 62cfc280490212bbbfd204f0dd8550d5 [0,2,0,0,0,0|2,0,0]=4 2883 B12R1.69 COCNc1ccc(nc1Cl)I 52d501a6e0b1be487a01d79d3bf074aa [0,2,0,0,0,0|2,0,0]=4 2884 B12R1.69 COCNc1ccc(nc1F)Br 50660d51f63bd6243e86397ce8cecd71 [0,2,0,0,0,0|2,0,0]=4 2885 B12R1.69 COCNc1ccc(nc1F)C 8cca659ea5eb1ea8783ca4a60f811037 [0,2,0,0,0,0|2,0,0]=4 2886 B12R1.69 COCNc1ccc(nc1F)Cl 325fdd2fd66a127e44b8dcffac29bb33 [0,2,0,0,0,0|2,0,0]=4 2887 B12R1.69 COCNc1ccc(nc1F)F 0415a822c967711c53d65c0d9cc82739 [0,2,0,0,0,0|2,0,0]=4 2888 B12R1.69 COCNc1ccc(nc1F)I 1832821bc562e934f93e79a9c1771b7e [0,2,0,0,0,0|2,0,0]=4 2889 B12R1.69 COCNc1ccc(nc1I)Br a0f55f402ae49b379d8f8f92f991cff3 [0,2,0,0,0,0|2,0,0]=4 2890 B12R1.69 COCNc1ccc(nc1I)C f1d281157bac7dd4881a1adc12d38c4c [0,2,0,0,0,0|2,0,0]=4 2891 B12R1.69 COCNc1ccc(nc1I)F 11621209860ba2ca3f2b69723fd09f4d [0,2,0,0,0,0|2,0,0]=4 2892 B12R1.69 COCNc1ccc(nc1I)I ff6e25a86b52d56a45e04a4558d2d74c [0,2,0,0,0,0|2,0,0]=4 2893 B12R1.69 COCNc1cnc(cc1Br)Br 21f29f6ac829c6a3d4bcc6e3fba44e6b [0,2,0,0,0,0|2,0,0]=4 2894 B12R1.69 COCNc1cnc(cc1Br)C 687d6578319260ddec790a28191fa563 [0,2,0,0,0,0|2,0,0]=4 2895 B12R1.69 COCNc1cnc(cc1Br)Cl 939348263ef8316b9bc66515b75195ed [0,2,0,0,0,0|2,0,0]=4 2896 B12R1.69 COCNc1cnc(cc1C)Br 999ad31c7399c1e5964eadc1e561bb8c [0,2,0,0,0,0|2,0,0]=4 2897 B12R1.69 COCNc1cnc(cc1C)C 6ba820fd8f65b2011d293d2146a11183 [0,2,0,0,0,0|2,0,0]=4 2898 B12R1.69 COCNc1cnc(cc1C)Cl d7c617423f9ce25536c482bdecf1826d [0,2,0,0,0,0|2,0,0]=4 2899 B12R1.69 COCNc1cnc(cc1C)F 4c2e1be0ffc316200b96a2650aedc8d3 [0,2,0,0,0,0|2,0,0]=4 2900 B12R1.69 COCNc1cnc(cc1Cl)Br 389828e860ad528924562d0ab4ee88e0 [0,2,0,0,0,0|2,0,0]=4 2901 B12R1.69 COCNc1cnc(cc1Cl)C bc72fb989cc42c81e117cab5029c3327 [0,2,0,0,0,0|2,0,0]=4 2902 B12R1.69 COCNc1cnc(cc1Cl)Cl efde60a8ca6bd367f933abe3935ded76 [0,2,0,0,0,0|2,0,0]=4 2903 B12R1.69 COCNc1cnc(cc1F)Cl 5e0b5850f6126e8f503e8eff596c6857 [0,2,0,0,0,0|2,0,0]=4 2904 B12R1.69 COCNc1cnc(cc1F)F dd52bf4e1a49c173e48d00d3a7dfbc01 [0,2,0,0,0,0|2,0,0]=4 2905 B12R1.69 COCNc1cnc(cc1I)Br 6c632e26834f45c7d07ca84710b293f8 [0,2,0,0,0,0|2,0,0]=4 2906 B12R1.69 COCNc1cnc(cc1I)Cl 08d7eb83146efdcf06d1a7f559162339 [0,2,0,0,0,0|2,0,0]=4 2907 B12R1.69 COCNc1ncc(cc1Br)Br 6541f054cf7b7e0a94a78a44743e6168 [0,2,0,0,0,0|2,0,0]=4 2908 B12R1.69 COCNc1ncc(cc1Br)C 953b9f246f575d79962732572c99359a [0,2,0,0,0,0|2,0,0]=4 2909 B12R1.69 COCNc1ncc(cc1Br)Cl 08afc2d9ae4579a08b13c6fff972f0d1 [0,2,0,0,0,0|2,0,0]=4 2910 B12R1.69 COCNc1ncc(cc1Br)F 8d65c786f63d0aed433fbb592f22c7bf [0,2,0,0,0,0|2,0,0]=4 2911 B12R1.69 COCNc1ncc(cc1Br)I f672ad3b8b6456efef6ba45a853e146c [0,2,0,0,0,0|2,0,0]=4 2912 B12R1.69 COCNc1ncc(cc1C)Br 1cc708d553d98b5296bd766702b6f762 [0,2,0,0,0,0|2,0,0]=4 2913 B12R1.69 COCNc1ncc(cc1C)C 75e94a94bdd6cd2594c0134941ed34a0 [0,2,0,0,0,0|2,0,0]=4 2914 B12R1.69 COCNc1ncc(cc1C)Cl f251047be1afeb65cae91fcb9aa15e4d [0,2,0,0,0,0|2,0,0]=4 2915 B12R1.69 COCNc1ncc(cc1C)F f1a82bb7f9f8a1958dbd5691c95911c1 [0,2,0,0,0,0|2,0,0]=4 2916 B12R1.69 COCNc1ncc(cc1C)I d4f5f235014e70a10357177a01cd2ade [0,2,0,0,0,0|2,0,0]=4 2917 B12R1.69 COCNc1ncc(cc1Cl)Br 371901b38c3212d9668da503cbbf1cb0 [0,2,0,0,0,0|2,0,0]=4 2918 B12R1.69 COCNc1ncc(cc1Cl)C f8b26261b4e391d54e2e4b202043ca1e [0,2,0,0,0,0|2,0,0]=4 2919 B12R1.69 COCNc1ncc(cc1Cl)Cl f69b7fb812235fd4b6b09d6938d53e86 [0,2,0,0,0,0|2,0,0]=4 2920 B12R1.69 COCNc1ncc(cc1Cl)F 6fbbfcf9f340367f40585dfc233cb73d [0,2,0,0,0,0|2,0,0]=4 2921 B12R1.69 COCNc1ncc(cc1Cl)I 79cc8159cb78b13ee69a707b006fae52 [0,2,0,0,0,0|2,0,0]=4 2922 B12R1.69 COCNc1ncc(cc1F)Br 1d450fe944c8830761495da387d1c8e2 [0,2,0,0,0,0|2,0,0]=4 2923 B12R1.69 COCNc1ncc(cc1F)C cf2a2a0cfe82cd954d6eeed5f1b4e1e4 [0,2,0,0,0,0|2,0,0]=4 2924 B12R1.69 COCNc1ncc(cc1F)Cl d7f1d09f58fae38eb8a84f9a6f57a3b1 [0,2,0,0,0,0|2,0,0]=4 2925 B12R1.69 COCNc1ncc(cc1F)F e5863b8202908eb308876d41e86f5d06 [0,2,0,0,0,0|2,0,0]=4 2926 B12R1.69 COCNc1ncc(cc1F)I 61e785fed517a25b4e41d358849383c7 [0,2,0,0,0,0|2,0,0]=4 2927 B12R1.69 COCNc1ncc(cc1I)Br 5d5d5dcea69982501dc74c42a5f76256 [0,2,0,0,0,0|2,0,0]=4 2928 B12R1.69 COCNc1ncc(cc1I)C 5ce858158bf2e6a98a1ef758f349195d [0,2,0,0,0,0|2,0,0]=4 2929 B12R1.69 COCNc1ncc(cc1I)Cl 26af9b4cf98b678e188384e3eb923ba1 [0,2,0,0,0,0|2,0,0]=4 2930 B12R1.69 COCNc1ncc(cc1I)F 1003cd8092d18e7a0b30deb7c7a792c0 [0,2,0,0,0,0|2,0,0]=4 2931 B12R1.69 COCNc1ncc(cc1I)I 28d1e8815263123e170c6eccde06a900 [0,2,0,0,0,0|2,0,0]=4 2932 B12R1.69 COCOc1ccc([nH]c1=O)Cl 83787ffdef7e93f67b7c96d7434b8daf [0,2,0,0,0,0|2,0,0]=4 2933 B12R1.69 COCOc1ccc(cc1Br)Cl f0773c0090613f12493a39d02e547f88 [0,2,0,0,0,0|1,0,0]=3 2934 B12R1.69 COCOc1ccc(cc1Br)I bc48ee9ef31bc12b94298aa3833729ca [0,2,0,0,0,0|1,0,0]=3 2935 B12R1.69 COCOc1ccc(cc1C)Br 82502c4928610d3e67ecca4a1be04403 [0,2,0,0,0,0|1,0,0]=3 2936 B12R1.69 COCOc1ccc(cc1C)C 690003b2eb0d7ae189c00d888853ae55 [0,2,0,0,0,0|1,0,0]=3 2937 B12R1.69 COCOc1ccc(cc1C)Cl 1732ab733fb1632750261a44073684c0 [0,2,0,0,0,0|1,0,0]=3 2938 B12R1.69 COCOc1ccc(cc1C)F 9e16033990faa5908e672c1d9936f826 [0,2,0,0,0,0|1,0,0]=3 2939 B12R1.69 COCOc1ccc(cc1C)I b093cb5c859fbe673fef02ad3e005e01 [0,2,0,0,0,0|1,0,0]=3 2940 B12R1.69 COCOc1ccc(cc1C)S 060ff03c7d9864ef3505e805f794468e [0,2,0,0,0,0|1,0,0]=3 2941 B12R1.69 COCOc1ccc(cc1Cl)Br 802d5953b254ed7a4ff9f4f8db3b2376 [0,2,0,0,0,0|1,0,0]=3 2942 B12R1.69 COCOc1ccc(cc1Cl)C 1d7683936392ec564cfaf1c829e031b1 [0,2,0,0,0,0|1,0,0]=3 2943 B12R1.69 COCOc1ccc(cc1Cl)Cl 71204e63ff1789070a66fe488a33a451 [0,2,0,0,0,0|1,0,0]=3 2944 B12R1.69 COCOc1ccc(cc1Cl)F 0023aad12fb259c2c91c48a78326f4f1 [0,2,0,0,0,0|1,0,0]=3 2945 B12R1.69 COCOc1ccc(cc1Cl)I a7531538554cd44d04bae2dc43e263be [0,2,0,0,0,0|1,0,0]=3 2946 B12R1.69 COCOc1ccc(cc1F)Br 53e221e1ff787620f9f23297394f2336 [0,2,0,0,0,0|1,0,0]=3 2947 B12R1.69 COCOc1ccc(cc1F)C 260099c3a58a81be4a11d0fc0edfd12c [0,2,0,0,0,0|1,0,0]=3 2948 B12R1.69 COCOc1ccc(cc1F)Cl 6260c1560fffd318d0f3cc0a736f2017 [0,2,0,0,0,0|1,0,0]=3 2949 B12R1.69 COCOc1ccc(cc1F)F d8c82bf05ddda9863444cf889550443e [0,2,0,0,0,0|1,0,0]=3 2950 B12R1.69 COCOc1ccc(cc1F)I 923e51c01b32873d26d9d9280ae3b51c [0,2,0,0,0,0|1,0,0]=3 2951 B12R1.69 COCOc1ccc(cc1I)Br ffcf4d0dac10bb225c43566f78e5f1a8 [0,2,0,0,0,0|1,0,0]=3 2952 B12R1.69 COCOc1ccc(cc1I)C 3f5283b26eadceebdb411248000fc666 [0,2,0,0,0,0|1,0,0]=3 2953 B12R1.69 COCOc1ccc(cc1I)Cl 51d31d044ff31035653ffd498e41356e [0,2,0,0,0,0|1,0,0]=3 2954 B12R1.69 COCOc1ccc(cc1I)F 233298a79100b169897a7519c60e323f [0,2,0,0,0,0|1,0,0]=3 2955 B12R1.69 COCOc1ccc(cc1I)I 189c78180458b1afbfa2c63fbb72a36a [0,2,0,0,0,0|1,0,0]=3 2956 B12R1.69 COCOc1ccc(nc1Br)Br b0f8359fc9f7e731cee307c5d5b07bd0 [0,2,0,0,0,0|2,0,0]=4 2957 B12R1.69 COCOc1ccc(nc1Br)C 2e303cc768f0590205acebedb17ab445 [0,2,0,0,0,0|2,0,0]=4 2958 B12R1.69 COCOc1ccc(nc1Br)Cl d59e69bbfba9998d1868eca27a64a1b3 [0,2,0,0,0,0|2,0,0]=4 2959 B12R1.69 COCOc1ccc(nc1Br)F 64293661fd76fbc5781cef5adecedb98 [0,2,0,0,0,0|2,0,0]=4 2960 B12R1.69 COCOc1ccc(nc1Br)I d3cfda1404c57f2133c7c80af69ce16b [0,2,0,0,0,0|2,0,0]=4 2961 B12R1.69 COCOc1ccc(nc1C)Br ba191a861d0f50be098dbbfd890e075c [0,2,0,0,0,0|2,0,0]=4 2962 B12R1.69 COCOc1ccc(nc1C)C 43006c5d59bc364cf9f51dd9cf0f06b2 [0,2,0,0,0,0|2,0,0]=4 2963 B12R1.69 COCOc1ccc(nc1C)Cl 48d57bd649d5296c3b4c767d3bcec5ea [0,2,0,0,0,0|2,0,0]=4 2964 B12R1.69 COCOc1ccc(nc1C)F 35995f67934339cb8dd57c7a39267cc5 [0,2,0,0,0,0|2,0,0]=4 2965 B12R1.69 COCOc1ccc(nc1C)I 08a618e4163766ed77a8d3745e1fff13 [0,2,0,0,0,0|2,0,0]=4 2966 B12R1.69 COCOc1ccc(nc1Cl)Br e56f0389437d56d9c791458be3b9bbdc [0,2,0,0,0,0|2,0,0]=4 2967 B12R1.69 COCOc1ccc(nc1Cl)C 76b44db4116a7196588e4366eec73104 [0,2,0,0,0,0|2,0,0]=4 2968 B12R1.69 COCOc1ccc(nc1Cl)Cl 0b2865d21c7ca60d7d7cbccd450b1767 [0,2,0,0,0,0|2,0,0]=4 2969 B12R1.69 COCOc1ccc(nc1Cl)I ac3e877f09cf0bbb98de702f67cb5060 [0,2,0,0,0,0|2,0,0]=4 2970 B12R1.69 COCOc1ccc(nc1F)Br 1758c05b4f5f08904e73a08ac806c79d [0,2,0,0,0,0|2,0,0]=4 2971 B12R1.69 COCOc1ccc(nc1F)C 0a097223d4bf8dec535f0dee20b0c248 [0,2,0,0,0,0|2,0,0]=4 2972 B12R1.69 COCOc1ccc(nc1F)Cl faae27ed6b141489dc88b4000122c6cf [0,2,0,0,0,0|2,0,0]=4 2973 B12R1.69 COCOc1ccc(nc1F)F 0cc57de3774b93d66e02cc7d209dafc4 [0,2,0,0,0,0|2,0,0]=4 2974 B12R1.69 COCOc1ccc(nc1F)I 3ea1f1194dfbcb4f4b35f2e593466fb8 [0,2,0,0,0,0|2,0,0]=4 2975 B12R1.69 COCOc1ccc(nc1I)Br 278d8b86a91be6a092e64d693f6c2a62 [0,2,0,0,0,0|2,0,0]=4 2976 B12R1.69 COCOc1ccc(nc1I)C e28f55585b0ecae0484800018005f101 [0,2,0,0,0,0|2,0,0]=4 2977 B12R1.69 COCOc1ccc(nc1I)Cl 376f4de8970e345cd8dad62811df6e6e [0,2,0,0,0,0|2,0,0]=4 2978 B12R1.69 COCOc1ccc(nc1I)F d62259825186a4db4f8e78c90b4f83f8 [0,2,0,0,0,0|2,0,0]=4 2979 B12R1.69 COCOc1ccc(nc1I)I e6e54e9da708006a093078fda79e78df [0,2,0,0,0,0|2,0,0]=4 2980 B12R1.69 COCOc1cnc(cc1Br)C 34efb21c3985f8fb2914f7282ebc7ca6 [0,2,0,0,0,0|2,0,0]=4 2981 B12R1.69 COCOc1cnc(cc1Br)Cl 5bb6593c459989185a08309b9db2a2b5 [0,2,0,0,0,0|2,0,0]=4 2982 B12R1.69 COCOc1cnc(cc1Br)F 0c5fbf4c78c861e5bfa775cf2ba8665d [0,2,0,0,0,0|2,0,0]=4 2983 B12R1.69 COCOc1cnc(cc1C)Br ad8a2d00da0820d69437520e6fd1d300 [0,2,0,0,0,0|2,0,0]=4 2984 B12R1.69 COCOc1cnc(cc1C)C ac3a1a192b313b74d18c88530f03dde6 [0,2,0,0,0,0|2,0,0]=4 2985 B12R1.69 COCOc1cnc(cc1C)Cl 4ae84c0e0f84b501ed238edb3e086d03 [0,2,0,0,0,0|2,0,0]=4 2986 B12R1.69 COCOc1cnc(cc1C)F 011496cb61654b59005846f2ad49018c [0,2,0,0,0,0|2,0,0]=4 2987 B12R1.69 COCOc1cnc(cc1Cl)Br 782965dfac3414c98097337903660328 [0,2,0,0,0,0|2,0,0]=4 2988 B12R1.69 COCOc1cnc(cc1Cl)Cl afe8ffd191ae5489886a7c37981c4b72 [0,2,0,0,0,0|2,0,0]=4 2989 B12R1.69 COCOc1cnc(cc1F)Br 6fbaf707ffa5b1a234d457b8509d3a2c [0,2,0,0,0,0|2,0,0]=4 2990 B12R1.69 COCOc1cnc(cc1F)Cl 80c2b934d883d0eea0f27cec3d1706a1 [0,2,0,0,0,0|2,0,0]=4 2991 B12R1.69 COCOc1cnc(cc1F)F 90a2bdf86e55b77ba94706a79b5d4342 [0,2,0,0,0,0|2,0,0]=4 2992 B12R1.69 COCOc1cnc(cc1I)Cl 076a34ec0eacd038674bb478ffc8b4e6 [0,2,0,0,0,0|2,0,0]=4 2993 B12R1.69 COCOc1cnc(cc1I)F b95db7f3fe543bd3bfc02c3bffe2b249 [0,2,0,0,0,0|2,0,0]=4 2994 B12R1.69 COCOc1coc(cc1=O)C 401eda10d7ff9eb77142afac778d2241 [0,2,0,0,0,0|2,0,0]=4 2995 B12R1.69 COCOc1ncc(cc1Br)Br 476bf33401b2589b8ccbd45f098e2f01 [0,2,0,0,0,0|2,0,0]=4 2996 B12R1.69 COCOc1ncc(cc1Br)C 2393e94841a5eb5cc988ae8a7d30e9d2 [0,2,0,0,0,0|2,0,0]=4 2997 B12R1.69 COCOc1ncc(cc1Br)Cl 6fbffdf311529e59c1687c0c4f830f86 [0,2,0,0,0,0|2,0,0]=4 2998 B12R1.69 COCOc1ncc(cc1Br)F 2d07d3be389997be626b672a2b3c8f45 [0,2,0,0,0,0|2,0,0]=4 2999 B12R1.69 COCOc1ncc(cc1Br)I 4a66dfe5ca1a75cd618aab1cdfe23db3 [0,2,0,0,0,0|2,0,0]=4 3000 B12R1.69 COCOc1ncc(cc1C)Br 665960d5a430980b501a6514d5d73739 [0,2,0,0,0,0|2,0,0]=4 3001 B12R1.69 COCOc1ncc(cc1C)Cl 8590cf57ce80a24845e267bdcdc6224e [0,2,0,0,0,0|2,0,0]=4 3002 B12R1.69 COCOc1ncc(cc1C)F 9851654a974244151c328aa9d62aee9a [0,2,0,0,0,0|2,0,0]=4 3003 B12R1.69 COCOc1ncc(cc1C)I aeed7c6d14fbf50708845e4bc81a1f0f [0,2,0,0,0,0|2,0,0]=4 3004 B12R1.69 COCOc1ncc(cc1Cl)Cl 5731865b5e1fa04f356a2ce8c8da23c2 [0,2,0,0,0,0|2,0,0]=4 3005 B12R1.69 COCOc1ncc(cc1Cl)F 7ad0e4bd38c1286188a36cc250896194 [0,2,0,0,0,0|2,0,0]=4 3006 B12R1.69 COCOc1ncc(cc1Cl)I 40dd8f038710ec293cc1465771d9ee19 [0,2,0,0,0,0|2,0,0]=4 3007 B12R1.69 COCOc1ncc(cc1F)F 9d7309c817c9c7c0a96f5b7dde03f6f0 [0,2,0,0,0,0|2,0,0]=4 3008 B12R1.69 COCOc1ncc(cc1I)Br 5c0a61ad597c9aad1c5e553199bcf9fc [0,2,0,0,0,0|2,0,0]=4 3009 B12R1.69 COCOc1ncc(cc1I)C f672e3fb9fb720b99beb2f8f348fb648 [0,2,0,0,0,0|2,0,0]=4 3010 B12R1.69 COCOc1ncc(cc1I)Cl a82104afcc31f4d3cc43b6e0b277c9d8 [0,2,0,0,0,0|2,0,0]=4 3011 B12R1.69 COCOc1ncc(cc1I)F ccc5b1b0ad8bff2034c3bd4713daedf9 [0,2,0,0,0,0|2,0,0]=4 3012 B12R1.69 COCOc1ncc(cc1I)I ccf1aecc2cc086c2cd50f3bedf1cf485 [0,2,0,0,0,0|2,0,0]=4 3013 B12R1.69 COCOn1ccc(cc1=S)C 6002e4d824867a9f158b1d02540e3ef3 [0,2,0,0,0,0|2,0,0]=4 3014 B12R1.69 CSCNc1ccc(cc1C)C 1d989d485aa84dc7a65eb66daec4c05e [0,2,0,0,0,0|1,1,0]=4 3015 B12R1.69 CSCNc1ccc(cc1C)Cl d38d6eaf7f929accf654e5fcf3383d14 [0,2,0,0,0,0|1,1,0]=4 3016 B12R1.69 CSCNc1ccc(cc1C)F 80c53d52eb851e78291fc5269e9de01e [0,2,0,0,0,0|1,1,0]=4 3017 B12R1.69 CSCNc1ccc(cc1C)I 5e29cc54f9d312b174dcb47430668dab [0,2,0,0,0,0|1,1,0]=4 3018 B12R1.69 CSCNc1ccc(cc1Cl)C 029837d943fc1d2f2324cac09f86e725 [0,2,0,0,0,0|1,1,0]=4 3019 B12R1.69 CSCNc1ccc(cc1Cl)Cl c2b297e8ec465ee36d96ccbe50b58c99 [0,2,0,0,0,0|1,1,0]=4 3020 B12R1.69 CSCNc1ccc(cc1Cl)F 57102534c6d1543a59fb348ba0cece4d [0,2,0,0,0,0|1,1,0]=4 3021 B12R1.69 CSCNc1ccc(cc1Cl)I 6e9ebe8dc990c81fe8a24975f04891f6 [0,2,0,0,0,0|1,1,0]=4 3022 B12R1.69 CSCNc1ccc(cc1F)C 55d8125da3742a0bbcbfbd91f7f65b7c [0,2,0,0,0,0|1,1,0]=4 3023 B12R1.69 CSCNc1ccc(cc1F)Cl 2f2804de8752d7ccb7f218d9a651c770 [0,2,0,0,0,0|1,1,0]=4 3024 B12R1.69 CSCNc1ccc(cc1F)I 9400ff0afe30a6f0bd070589c2634481 [0,2,0,0,0,0|1,1,0]=4 3025 B12R1.69 CSCNc1ccc(cc1I)Br 4bd4b5642c40a895a52359a7078cffa3 [0,2,0,0,0,0|1,1,0]=4 3026 B12R1.69 CSCNc1ccc(cc1I)C 31a2694fad7de3cf9703636c6fef7a64 [0,2,0,0,0,0|1,1,0]=4 3027 B12R1.69 CSCNc1ccc(cc1I)Cl 4241c771913a28c09c2ddba4a0ca3f51 [0,2,0,0,0,0|1,1,0]=4 3028 B12R1.69 CSCNc1ccc(cc1I)F fe65db144892fd0b34a14ff3dd6875e9 [0,2,0,0,0,0|1,1,0]=4 3029 B12R1.69 CSCNc1ccc(cc1I)I 1ea8f493d976fba9be3b33b980ee0b64 [0,2,0,0,0,0|1,1,0]=4 3030 B12R1.69 CSCOc1ccc(cc1Br)Br f39040616f622dde23650b539c4cf9ad [0,2,0,0,0,0|1,1,0]=4 3031 B12R1.69 CSCOc1ccc(cc1Br)C d17ca857d316afa72e5a652702b90fb3 [0,2,0,0,0,0|1,1,0]=4 3032 B12R1.69 CSCOc1ccc(cc1Br)Cl 17e20274a0b18e16a8927b3bf254121a [0,2,0,0,0,0|1,1,0]=4 3033 B12R1.69 CSCOc1ccc(cc1Br)F f7f5bd75ed757c623c5e76d5978a7a4b [0,2,0,0,0,0|1,1,0]=4 3034 B12R1.69 CSCOc1ccc(cc1Br)I 92a309755180c0e0af660ad65b729fab [0,2,0,0,0,0|1,1,0]=4 3035 B12R1.69 CSCOc1ccc(cc1C)Br c329eee3189be815b37f1d6b4c87c5e2 [0,2,0,0,0,0|1,1,0]=4 3036 B12R1.69 CSCOc1ccc(cc1C)C fd010f917a1497d0754a43933ef2d334 [0,2,0,0,0,0|1,1,0]=4 3037 B12R1.69 CSCOc1ccc(cc1C)Cl 13944f29e347b706b132f0acb1929983 [0,2,0,0,0,0|1,1,0]=4 3038 B12R1.69 CSCOc1ccc(cc1C)F b7a2bf41d1fed51c10e3ad86b3af29bd [0,2,0,0,0,0|1,1,0]=4 3039 B12R1.69 CSCOc1ccc(cc1C)I 1a5ea1c1538999175a8b75c06a7d89b2 [0,2,0,0,0,0|1,1,0]=4 3040 B12R1.69 CSCOc1ccc(cc1C)S 3dbc52a2f38b4e93377354561792e108 [0,2,0,0,0,0|1,1,0]=4 3041 B12R1.69 CSCOc1ccc(cc1Cl)Br e76e7b78b9387323cea8cd4f74e21de1 [0,2,0,0,0,0|1,1,0]=4 3042 B12R1.69 CSCOc1ccc(cc1Cl)C acf7274f10f8fdf928c2e95ce0a3f739 [0,2,0,0,0,0|1,1,0]=4 3043 B12R1.69 CSCOc1ccc(cc1Cl)Cl dc6075eba34e8d2267bf4bb5e823a569 [0,2,0,0,0,0|1,1,0]=4 3044 B12R1.69 CSCOc1ccc(cc1Cl)F 778d9e27882775dd74dda16f03427d25 [0,2,0,0,0,0|1,1,0]=4 3045 B12R1.69 CSCOc1ccc(cc1Cl)I 7fe3cf33382429fcddbe6021d88ce8fa [0,2,0,0,0,0|1,1,0]=4 3046 B12R1.69 CSCOc1ccc(cc1F)Br 357569cfdfa33809628de0ffe3837818 [0,2,0,0,0,0|1,1,0]=4 3047 B12R1.69 CSCOc1ccc(cc1F)C c8c15c5a2389e5c3dbb05b7c2dd90f44 [0,2,0,0,0,0|1,1,0]=4 3048 B12R1.69 CSCOc1ccc(cc1F)Cl 778ede09744e8ccef69490783ad0e267 [0,2,0,0,0,0|1,1,0]=4 3049 B12R1.69 CSCOc1ccc(cc1F)F cae54361d0f342f00f0637497b214ca5 [0,2,0,0,0,0|1,1,0]=4 3050 B12R1.69 CSCOc1ccc(cc1F)I 475c0a1e038c598fa76ad0a11c9cd2e3 [0,2,0,0,0,0|1,1,0]=4 3051 B12R1.69 CSCOc1ccc(cc1I)Br 45c88bb03afdf152f5fd5baec9fba34f [0,2,0,0,0,0|1,1,0]=4 3052 B12R1.69 CSCOc1ccc(cc1I)C 6ededa294cbbe9f3a27f4b28acc1419a [0,2,0,0,0,0|1,1,0]=4 3053 B12R1.69 CSCOc1ccc(cc1I)Cl 778a47b80c8ea2d4b401ddbf321ee432 [0,2,0,0,0,0|1,1,0]=4 3054 B12R1.69 CSCOc1ccc(cc1I)F ae7879bc74fd500e50452529a6e14f91 [0,2,0,0,0,0|1,1,0]=4 3055 B12R1.69 CSCOc1ccc(cc1I)I 7d09b8df7e240492419be003e3108d3a [0,2,0,0,0,0|1,1,0]=4 3056 B12R1.71 C#Cc1ccc(cc1)CNCC acc607984157ec81c8ea429f261669f7 [0,2,0,0,0,0|2,0,0]=4 3057 B12R1.71 C#Cc1ccc(cc1)COCC 6230cf57368c1296ff15e77e9a34441e [0,2,0,0,0,0|2,0,0]=4 3058 B12R1.71 C#Cc1ccc(cc1)NCCC fc9cf895565fa4232c2247830c975af6 [0,2,0,0,0,0|2,0,0]=4 3059 B12R1.71 C#Cc1ccc(cc1)NCOC 8ca9ce20d0ea96738b25a8aa9280d05b [0,2,0,0,0,0|1,0,0]=3 3060 B12R1.71 C#Cc1ccc(cc1)NCSC 25e5b187fef384a688991cda8ab8283e [0,2,0,0,0,0|1,1,0]=4 3061 B12R1.71 C#Cc1ccc(cc1)OCCC 729d9bda0f3fb9c155366dcf1c6fe091 [0,2,0,0,0,0|2,0,0]=4 3062 B12R1.71 C#Cc1ccc(cc1)OCOC 6ac80003833690c064283fc202bca712 [0,2,0,0,0,0|1,0,0]=3 3063 B12R1.71 C#Cc1ccc(cc1)OCSC 79344a320c6f31b10317f66c8bcbd703 [0,2,0,0,0,0|1,1,0]=4 3064 B12R1.71 C#Cc1ccc(cn1)NCOC 24b58af5535b4493347032d05c368fd9 [0,2,0,0,0,0|2,0,0]=4 3065 B12R1.71 C#Cc1ccc(nc1)NCOC e8c057d9dda9c385b62d57117f8e16fd [0,2,0,0,0,0|2,0,0]=4 3066 B12R1.71 C#Cc1ccc(nc1)OCOC 3845ae1c5f5eb0c5393670fad50f1862 [0,2,0,0,0,0|2,0,0]=4 3067 B12R1.71 C=Cc1ccc(cc1)CNCC 8d26f36a09ed6bc1769933ec92c07439 [0,2,0,0,0,0|2,0,0]=4 3068 B12R1.71 C=Cc1ccc(cc1)COCC 753e5692cf814e398fcce6513d26c7c7 [0,2,0,0,0,0|2,0,0]=4 3069 B12R1.71 C=Cc1ccc(cc1)NCCC bea20e9a07d5c53108eb0f03c06182e1 [0,2,0,0,0,0|2,0,0]=4 3070 B12R1.71 C=Cc1ccc(cc1)NCOC 97cdddad96634b53cdafcb6e0644b48d [0,2,0,0,0,0|1,0,0]=3 3071 B12R1.71 C=Cc1ccc(cc1)NCSC a71fd47777b9c428d068a5902116384d [0,2,0,0,0,0|1,1,0]=4 3072 B12R1.71 C=Cc1ccc(cc1)OCCC 9289590995132c233aa3a872f79777ec [0,2,0,0,0,0|2,0,0]=4 3073 B12R1.71 C=Cc1ccc(cc1)OCOC ac690c43d845204f0339230a58bbab80 [0,2,0,0,0,0|1,0,0]=3 3074 B12R1.71 C=Cc1ccc(cc1)OCSC ec6c542e460d54358d81ca15a8632d0b [0,2,0,0,0,0|1,1,0]=4 3075 B12R1.71 C=Cc1ccc(nc1)NCOC 90054c1465c4589afc4caf33569e4b20 [0,2,0,0,0,0|2,0,0]=4 3076 B12R1.71 CCCNc1ccc(cc1)C#N c413f0c8235d8b24b660a942fae94e8f [0,2,0,0,0,0|2,0,0]=4 3077 B12R1.71 CCCNc1ccc(cc1)C=O 9dbf29157f416c2cfd25aa5f07560af2 [0,2,0,0,0,0|2,0,0]=4 3078 B12R1.71 CCCNc1ccc(cc1)CC 18681bd5a077639e070315f9c5ead6bc [0,2,0,0,0,0|2,0,0]=4 3079 B12R1.71 CCCNc1ccc(cc1)CO ceb468625b15ce9adcfaf637f5d6e68b [0,2,0,0,0,0|2,0,0]=4 3080 B12R1.71 CCCNc1ccc(cc1)NO 3dd6caa0f914c4ac2accf62bc38f2152 [0,2,0,0,0,0|2,0,0]=4 3081 B12R1.71 CCCNc1ccc(cc1)OC 5ef38f04471b6d41619c77104109b7a1 [0,2,0,0,0,0|2,0,0]=4 3082 B12R1.71 CCCNc1ccc(cc1)SC 5c3d3acd85641d2bc8849fea33561964 [0,2,0,0,0,0|2,0,0]=4 3083 B12R1.71 CCCOc1ccc(cc1)C#N 9ef65dc47341dcbe9f84aab2fa134c88 [0,2,0,0,0,0|2,0,0]=4 3084 B12R1.71 CCCOc1ccc(cc1)C=O 4e37ed969b2e2dc144113d7cf8381fcd [0,2,0,0,0,0|2,0,0]=4 3085 B12R1.71 CCCOc1ccc(cc1)CC 96cca871d75f432ff4ca383a1c75e964 [0,2,0,0,0,0|2,0,0]=4 3086 B12R1.71 CCCOc1ccc(cc1)N=O e5113a838ca97c8bc7158f76255bd3fe [0,2,0,0,0,0|2,0,0]=4 3087 B12R1.71 CCCOc1ccc(cc1)OC 0b61816165283f1506ed44c74ecbaebe [0,2,0,0,0,0|2,0,0]=4 3088 B12R1.71 CCCOc1ccc(cc1)SC 479b0a3cc96ea63a2a5a2a1f41d91b56 [0,2,0,0,0,0|2,0,0]=4 3089 B12R1.71 CCNCc1ccc(cc1)C#N f12d5ea6f09c7c059e4c3dbf14cb481a [0,2,0,0,0,0|2,0,0]=4 3090 B12R1.71 CCNCc1ccc(cc1)CBr becc461d015ad0df61a5c76d19f314f5 [0,2,0,0,0,0|2,0,0]=4 3091 B12R1.71 CCNCc1ccc(cc1)CC 3e2fb788aa7dc44753168a8243395fdd [0,2,0,0,0,0|2,0,0]=4 3092 B12R1.71 CCNCc1ccc(cc1)CO dcae13b21c0d781c4ec79c5c7375f026 [0,2,0,0,0,0|2,0,0]=4 3093 B12R1.71 CCNCc1ccc(cc1)OC 590310c69085c3b6b7de5eeac9230511 [0,2,0,0,0,0|2,0,0]=4 3094 B12R1.71 CCNCc1ccc(cc1)SC 00ccf471bad170335d0bab0647cf5701 [0,2,0,0,0,0|2,0,0]=4 3095 B12R1.71 CCOCc1ccc(cc1)C#N 3373887eb6a965dda8a3f3e05b72ab37 [0,2,0,0,0,0|2,0,0]=4 3096 B12R1.71 CCOCc1ccc(cc1)C=O 63f61c534301d2fb19296914e9ec3a98 [0,2,0,0,0,0|2,0,0]=4 3097 B12R1.71 CCOCc1ccc(cc1)CC 45f72f0a0f8fb8243e54c5aac869cd85 [0,2,0,0,0,0|2,0,0]=4 3098 B12R1.71 CCOCc1ccc(cc1)OC d60caff2ba93c5dc9ab4d399fa52aa3c [0,2,0,0,0,0|2,0,0]=4 3099 B12R1.71 CCOCc1ccc(cc1)SC 5e8be0892a30f0c5353894e85ab5ba9b [0,2,0,0,0,0|2,0,0]=4 3100 B12R1.71 CCc1ccc(cc1)NCOC 058ee6c7ecc6d51d387abed1e4de0f1d [0,2,0,0,0,0|1,0,0]=3 3101 B12R1.71 CCc1ccc(cc1)NCSC 959018a16e5d1e7d1e8c5671bac2a437 [0,2,0,0,0,0|1,1,0]=4 3102 B12R1.71 CCc1ccc(cc1)OCSC 862e8a105f4320dbd38b1167597d6d09 [0,2,0,0,0,0|1,1,0]=4 3103 B12R1.71 CCc1ccc(cn1)NCOC e2e9f3d6f8ba788f31da381a2525d12f [0,2,0,0,0,0|2,0,0]=4 3104 B12R1.71 CCc1ccc(nc1)NCOC a4714d7b7487ea0fe5045f0b10f3912f [0,2,0,0,0,0|2,0,0]=4 3105 B12R1.71 CCc1ccc(nc1)OCOC ca1356ea7703634def2c0ee6c89112aa [0,2,0,0,0,0|2,0,0]=4 3106 B12R1.71 COCNc1ccc(cc1)C#N 65cf5d2ce99f60392e8ee371934a1d55 [0,2,0,0,0,0|1,0,0]=3 3107 B12R1.71 COCNc1ccc(cc1)C=O f7ab2f429f29a899fd97c425aa102629 [0,2,0,0,0,0|1,0,0]=3 3108 B12R1.71 COCNc1ccc(cc1)CO 1f77983716297ec2a82dbea03424b9c6 [0,2,0,0,0,0|1,0,0]=3 3109 B12R1.71 COCNc1ccc(cc1)OC f08bb6381e49f57d218c6141b71431a4 [0,2,0,0,0,0|1,0,0]=3 3110 B12R1.71 COCNc1ccc(cc1)SC ae4247a861e0d9221250c21ef2ea1170 [0,2,0,0,0,0|1,0,0]=3 3111 B12R1.71 COCNc1ccc(cn1)C#N a35140df30ba53f57a6302a9a31bee86 [0,2,0,0,0,0|2,0,0]=4 3112 B12R1.71 COCNc1ccc(cn1)C=O 35aa94459e6a81ad86a4eac62f959fc0 [0,2,0,0,0,0|2,0,0]=4 3113 B12R1.71 COCNc1ccc(cn1)CCl 0bdda2bb6ea0512fc3c9d64672d5307c [0,2,0,0,0,0|2,0,0]=4 3114 B12R1.71 COCNc1ccc(cn1)CO 6bd45e64b2655fa1595f06426e8647b3 [0,2,0,0,0,0|2,0,0]=4 3115 B12R1.71 COCNc1ccc(cn1)OC 6c7ee979a662b0a3fb5102b512653225 [0,2,0,0,0,0|2,0,0]=4 3116 B12R1.71 COCNc1ccc(cn1)SC 4be7e232245a4a5c8532a3a106dedcd2 [0,2,0,0,0,0|2,0,0]=4 3117 B12R1.71 COCNc1ccc(nc1)C#N 11bb80a78ea57c80826ea853394dd193 [0,2,0,0,0,0|2,0,0]=4 3118 B12R1.71 COCNc1ccc(nc1)C=O 8dc5d0abec0d4f4ac1755ab931315e4f [0,2,0,0,0,0|2,0,0]=4 3119 B12R1.71 COCNc1ccc(nc1)CO 228fbf560fdaed1a318ff491fd702711 [0,2,0,0,0,0|2,0,0]=4 3120 B12R1.71 COCNc1ccc(nc1)OC 3565c5e98d086131e44b3abd33644232 [0,2,0,0,0,0|2,0,0]=4 3121 B12R1.71 COCNc1ccc(nc1)SC 56365ee05e6555e82365b25ae70cb253 [0,2,0,0,0,0|2,0,0]=4 3122 B12R1.71 COCOc1ccc(cc1)C#N 753b0a267902f42d2517abe4e40b8f43 [0,2,0,0,0,0|1,0,0]=3 3123 B12R1.71 COCOc1ccc(cc1)C=O c6331fde3edc7b39ecba2c825a6ab487 [0,2,0,0,0,0|1,0,0]=3 3124 B12R1.71 COCOc1ccc(cc1)N=O 6efbc9c18cc7576f4ef181c98474af2a [0,2,0,0,0,0|1,0,0]=3 3125 B12R1.71 COCOc1ccc(cc1)OC 2dd59a1a703d28b02af40dd932f195cf [0,2,0,0,0,0|1,0,0]=3 3126 B12R1.71 COCOc1ccc(cc1)SC dd10472e8dd3da73df07a634244d412a [0,2,0,0,0,0|1,0,0]=3 3127 B12R1.71 COCOc1ccc(cn1)C#N 567269394feb3f36e2610b73cbd4e0de [0,2,0,0,0,0|2,0,0]=4 3128 B12R1.71 COCOc1ccc(cn1)C=O 8550233a44ec200389c3dd4b6e73584f [0,2,0,0,0,0|2,0,0]=4 3129 B12R1.71 COCOc1ccc(cn1)OC a9f59c1f05a8d56817e6089403218a57 [0,2,0,0,0,0|2,0,0]=4 3130 B12R1.71 COCOc1ccc(nc1)C#N 27e011df5316af40ef205879429e33db [0,2,0,0,0,0|2,0,0]=4 3131 B12R1.71 COCOc1ccc(nc1)C=O 293b7ba018007cdb81de45cb4e6d1014 [0,2,0,0,0,0|2,0,0]=4 3132 B12R1.71 COCOc1ccc(nc1)OC 27d7a5a672ac2572da8133139cdbd266 [0,2,0,0,0,0|2,0,0]=4 3133 B12R1.71 COCOc1ccc(nc1)SC 4ef9a56ba011d5bcb94fd8a917208af6 [0,2,0,0,0,0|2,0,0]=4 3134 B12R1.71 COc1ccc(cc1)NCSC b208afa1c3c9a9c83b84843e5243cb08 [0,2,0,0,0,0|1,1,0]=4 3135 B12R1.71 COc1ccc(cc1)OCSC 60de989f1c896fefabcc4586edfbc7be [0,2,0,0,0,0|1,1,0]=4 3136 B12R1.71 CSCNc1ccc(cc1)C#N 825281cf57456f832c535ba86141c604 [0,2,0,0,0,0|1,1,0]=4 3137 B12R1.71 CSCNc1ccc(cc1)C=O 1daa2cba3e106138a755dfb5a7bd2022 [0,2,0,0,0,0|1,1,0]=4 3138 B12R1.71 CSCNc1ccc(cc1)CO 7903cc30cfbce6acd80446c98bf25bf5 [0,2,0,0,0,0|1,1,0]=4 3139 B12R1.71 CSCNc1ccc(cc1)SC 7f3e9c64e5b0cb0a769b4cbf02d56244 [0,2,0,0,0,0|1,1,0]=4 3140 B12R1.71 CSCOc1ccc(cc1)C#N 88704291ff3e9ccc65270b2d61a35752 [0,2,0,0,0,0|1,1,0]=4 3141 B12R1.71 CSCOc1ccc(cc1)C=O dd0170a06c13ae6b1c7e812c8823f315 [0,2,0,0,0,0|1,1,0]=4 3142 B12R1.71 CSCOc1ccc(cc1)N=O 2aa07bd1c35cdc285133b1c459404b8b [0,2,0,0,0,0|1,1,0]=4 3143 B12R1.71 CSCOc1ccc(cc1)SC ff7b85f950f9c942c1ec9071a16fe926 [0,2,0,0,0,0|1,1,0]=4 3144 B12R1.385 CCCNc1ccc(c(c1)Br)Br 1a4ee9ed75f664dee16cd0fa089b3e9d [0,2,0,0,0,0|2,0,0]=4 3145 B12R1.385 CCCNc1ccc(c(c1)Br)C f5cef5bbce7741574f6d264160f19bf3 [0,2,0,0,0,0|2,0,0]=4 3146 B12R1.385 CCCNc1ccc(c(c1)Br)Cl 359854cb6bc7fcf1a71435cbd26f68a6 [0,2,0,0,0,0|2,0,0]=4 3147 B12R1.385 CCCNc1ccc(c(c1)Br)F fd5dd849171e756d6fbcaae51f0a18b0 [0,2,0,0,0,0|2,0,0]=4 3148 B12R1.385 CCCNc1ccc(c(c1)Br)I 7e979608bfec13c33a47cc100b5ea102 [0,2,0,0,0,0|2,0,0]=4 3149 B12R1.385 CCCNc1ccc(c(c1)C)Br 416afcc27d6f89759014bfddb3edfe3c [0,2,0,0,0,0|2,0,0]=4 3150 B12R1.385 CCCNc1ccc(c(c1)C)C cec942672950516060b338813754df20 [0,2,0,0,0,0|2,0,0]=4 3151 B12R1.385 CCCNc1ccc(c(c1)C)Cl c24d8bbc56f0114859be0f25291c33b1 [0,2,0,0,0,0|2,0,0]=4 3152 B12R1.385 CCCNc1ccc(c(c1)C)F 4474b6199931ce368b2bf4c0b3a9e619 [0,2,0,0,0,0|2,0,0]=4 3153 B12R1.385 CCCNc1ccc(c(c1)C)I d137f961cc596c336745487eb576e657 [0,2,0,0,0,0|2,0,0]=4 3154 B12R1.385 CCCNc1ccc(c(c1)Cl)Br 07aabe1889e189164cf90997a54b4836 [0,2,0,0,0,0|2,0,0]=4 3155 B12R1.385 CCCNc1ccc(c(c1)Cl)C 385aa6a8d853448d9f684c8d5c0a9116 [0,2,0,0,0,0|2,0,0]=4 3156 B12R1.385 CCCNc1ccc(c(c1)Cl)Cl e8fcea03364941e8e857eb7dae153919 [0,2,0,0,0,0|2,0,0]=4 3157 B12R1.385 CCCNc1ccc(c(c1)Cl)F 7e49251e191721132349250269c1b385 [0,2,0,0,0,0|2,0,0]=4 3158 B12R1.385 CCCNc1ccc(c(c1)Cl)I 29173c3aa2121edbdab39b9ab0f989db [0,2,0,0,0,0|2,0,0]=4 3159 B12R1.385 CCCNc1ccc(c(c1)F)C 95de3a1c33a4039f6ab8a25f2eb5277d [0,2,0,0,0,0|2,0,0]=4 3160 B12R1.385 CCCNc1ccc(c(c1)F)Cl 3f67b5b4e0bc541e84bde18070fe9c39 [0,2,0,0,0,0|2,0,0]=4 3161 B12R1.385 CCCNc1ccc(c(c1)F)F 0b299ff8ea313b46748a7675bf902d3d [0,2,0,0,0,0|2,0,0]=4 3162 B12R1.385 CCCNc1ccc(c(c1)F)I e5c040675d8d2491498e53b7af2cc940 [0,2,0,0,0,0|2,0,0]=4 3163 B12R1.385 CCCNc1ccc(c(c1)I)Br e877e9a527e2c6376cf5fc14abd22923 [0,2,0,0,0,0|2,0,0]=4 3164 B12R1.385 CCCNc1ccc(c(c1)I)C e6e3e0bcaa6413beb50618a232f76e81 [0,2,0,0,0,0|2,0,0]=4 3165 B12R1.385 CCCNc1ccc(c(c1)I)Cl 6333ac0ab64ecd70b850f94e5120ca4e [0,2,0,0,0,0|2,0,0]=4 3166 B12R1.385 CCCNc1ccc(c(c1)I)F 535a7e9678cd57d2c780784655d1eb95 [0,2,0,0,0,0|2,0,0]=4 3167 B12R1.385 CCCNc1ccc(c(c1)N)N 78c496fd68f7d812e56242785df61ef5 [0,2,0,0,0,0|2,0,0]=4 3168 B12R1.385 CCCOc1ccc(c(c1)Br)Br f4e0aa3b423c865a929a6b3ad04fba3e [0,2,0,0,0,0|2,0,0]=4 3169 B12R1.385 CCCOc1ccc(c(c1)Br)C be90cf996cef55d0bbb403ba954dd4d6 [0,2,0,0,0,0|2,0,0]=4 3170 B12R1.385 CCCOc1ccc(c(c1)Br)Cl 61e2266f03e1b774767c6d6026ba3b38 [0,2,0,0,0,0|2,0,0]=4 3171 B12R1.385 CCCOc1ccc(c(c1)Br)F 470ed444a142e8f47db2de4e663e77f6 [0,2,0,0,0,0|2,0,0]=4 3172 B12R1.385 CCCOc1ccc(c(c1)Br)I 0246363f83b6eed718493abc1eee1aaf [0,2,0,0,0,0|2,0,0]=4 3173 B12R1.385 CCCOc1ccc(c(c1)C)Br ecee43cd74262f462ba66c530d2e1be9 [0,2,0,0,0,0|2,0,0]=4 3174 B12R1.385 CCCOc1ccc(c(c1)C)C 10021d0a5534b8943356fbce88dd5580 [0,2,0,0,0,0|2,0,0]=4 3175 B12R1.385 CCCOc1ccc(c(c1)C)Cl eff83e2f6d2672cd80d67354a9af8888 [0,2,0,0,0,0|2,0,0]=4 3176 B12R1.385 CCCOc1ccc(c(c1)C)F c98d6d8e17f4250f9c94c14cee04c6b2 [0,2,0,0,0,0|2,0,0]=4 3177 B12R1.385 CCCOc1ccc(c(c1)C)I 7a7bf0a71e92ec66cb613f5b68bf3248 [0,2,0,0,0,0|2,0,0]=4 3178 B12R1.385 CCCOc1ccc(c(c1)Cl)Br 20a940d163f93b56807228b3c3416f3a [0,2,0,0,0,0|2,0,0]=4 3179 B12R1.385 CCCOc1ccc(c(c1)Cl)C 09e61306feb104e3321b52c3889f3471 [0,2,0,0,0,0|2,0,0]=4 3180 B12R1.385 CCCOc1ccc(c(c1)Cl)Cl c225c8010e58d036b820222263085d13 [0,2,0,0,0,0|2,0,0]=4 3181 B12R1.385 CCCOc1ccc(c(c1)Cl)F 482951cf136a5fa72f6e2331e3236776 [0,2,0,0,0,0|2,0,0]=4 3182 B12R1.385 CCCOc1ccc(c(c1)Cl)I ef5e0efa10184270af8943aa1f85071c [0,2,0,0,0,0|2,0,0]=4 3183 B12R1.385 CCCOc1ccc(c(c1)F)Br 52d993acadab42d07d3b1c728228a29b [0,2,0,0,0,0|2,0,0]=4 3184 B12R1.385 CCCOc1ccc(c(c1)F)C 7f9ead5d0c09eb6f7f3968fafba6cc12 [0,2,0,0,0,0|2,0,0]=4 3185 B12R1.385 CCCOc1ccc(c(c1)F)Cl eaa49bed7f845885ed5854c9187356d1 [0,2,0,0,0,0|2,0,0]=4 3186 B12R1.385 CCCOc1ccc(c(c1)F)F a6504705dbe2c4ae585d33bf16ec4112 [0,2,0,0,0,0|2,0,0]=4 3187 B12R1.385 CCCOc1ccc(c(c1)F)I e32cecc5819db314871fae2cce5c238a [0,2,0,0,0,0|2,0,0]=4 3188 B12R1.385 CCCOc1ccc(c(c1)I)Br 0e40a2d7758738c345b91622f547f0fa [0,2,0,0,0,0|2,0,0]=4 3189 B12R1.385 CCCOc1ccc(c(c1)I)C 03181646ca332185444a2803a4bd42b0 [0,2,0,0,0,0|2,0,0]=4 3190 B12R1.385 CCCOc1ccc(c(c1)I)Cl 1c01553ed4fd55b6ba75ec356a56d204 [0,2,0,0,0,0|2,0,0]=4 3191 B12R1.385 CCCOc1ccc(c(c1)I)F 588804843c1a498252cd620d8c8fc051 [0,2,0,0,0,0|2,0,0]=4 3192 B12R1.385 CCNCc1ccc(c(c1)Br)Br 972dcb5774ca4924c11baecb7b188183 [0,2,0,0,0,0|2,0,0]=4 3193 B12R1.385 CCNCc1ccc(c(c1)Br)C 75d3aff8bf63d78887cfad263b3d6a40 [0,2,0,0,0,0|2,0,0]=4 3194 B12R1.385 CCNCc1ccc(c(c1)Br)Cl 6a879cbf59489e1f836ea07896f20266 [0,2,0,0,0,0|2,0,0]=4 3195 B12R1.385 CCNCc1ccc(c(c1)Br)F e9d19485f41d7f9fdcca53d7e78b5015 [0,2,0,0,0,0|2,0,0]=4 3196 B12R1.385 CCNCc1ccc(c(c1)C)Br 006bf53c6c0cafaa0d46b253c151eaa0 [0,2,0,0,0,0|2,0,0]=4 3197 B12R1.385 CCNCc1ccc(c(c1)C)C 92885f004ab5a01647443af529f8cf2c [0,2,0,0,0,0|2,0,0]=4 3198 B12R1.385 CCNCc1ccc(c(c1)C)F 92dcbc54e71d2ef33d15c8b580eb2c43 [0,2,0,0,0,0|2,0,0]=4 3199 B12R1.385 CCNCc1ccc(c(c1)C)I 6aa6cd1c63d64345f6a9fa616cc4bca6 [0,2,0,0,0,0|2,0,0]=4 3200 B12R1.385 CCNCc1ccc(c(c1)Cl)Br 65486e0dd3c30482aab9c223e40cf382 [0,2,0,0,0,0|2,0,0]=4 3201 B12R1.385 CCNCc1ccc(c(c1)Cl)C e89cbb4ef5eca53bc8abbc8a579c7f4c [0,2,0,0,0,0|2,0,0]=4 3202 B12R1.385 CCNCc1ccc(c(c1)Cl)Cl 4dffb7183027bf42c4477d5bafb60af5 [0,2,0,0,0,0|2,0,0]=4 3203 B12R1.385 CCNCc1ccc(c(c1)Cl)F 0c5b603732ff5fa7ede3322c70d703c4 [0,2,0,0,0,0|2,0,0]=4 3204 B12R1.385 CCNCc1ccc(c(c1)F)Br 2aab14d703f165e654330c3cdcdbebe0 [0,2,0,0,0,0|2,0,0]=4 3205 B12R1.385 CCNCc1ccc(c(c1)F)C 38a44b9883b5f623c0199b254f568405 [0,2,0,0,0,0|2,0,0]=4 3206 B12R1.385 CCNCc1ccc(c(c1)F)Cl de518cb82ddb52a142986117aea14d16 [0,2,0,0,0,0|2,0,0]=4 3207 B12R1.385 CCNCc1ccc(c(c1)F)F 1a351b0d2da700a9dac72937f9a9030e [0,2,0,0,0,0|2,0,0]=4 3208 B12R1.385 CCNCc1ccc(c(c1)F)I 5aa794ca67f25d271f178b93dee861a6 [0,2,0,0,0,0|2,0,0]=4 3209 B12R1.385 CCOCc1ccc(c(c1)Br)Br 8fafbb377efb885871aed9a1878361ba [0,2,0,0,0,0|2,0,0]=4 3210 B12R1.385 CCOCc1ccc(c(c1)Br)C 3a2436bcef26745e4d84463180cf2453 [0,2,0,0,0,0|2,0,0]=4 3211 B12R1.385 CCOCc1ccc(c(c1)Br)Cl 7652e0e65cdcfff64b8cf1e8b20a39a6 [0,2,0,0,0,0|2,0,0]=4 3212 B12R1.385 CCOCc1ccc(c(c1)Br)F 50e94df7c8847b4ed3f7414d40b7f30b [0,2,0,0,0,0|2,0,0]=4 3213 B12R1.385 CCOCc1ccc(c(c1)Br)I 35764e8d82232dfaed396e9ac3cb2609 [0,2,0,0,0,0|2,0,0]=4 3214 B12R1.385 CCOCc1ccc(c(c1)C)Br d09b301ca35df40bd8476cf66c9eaaea [0,2,0,0,0,0|2,0,0]=4 3215 B12R1.385 CCOCc1ccc(c(c1)C)C f319fcec7cf829a7102e6b2360504093 [0,2,0,0,0,0|2,0,0]=4 3216 B12R1.385 CCOCc1ccc(c(c1)C)Cl 92fb642f96cc2d174fe3cdba94912e70 [0,2,0,0,0,0|2,0,0]=4 3217 B12R1.385 CCOCc1ccc(c(c1)C)F d9545567324624cfffdcbfe571115ad0 [0,2,0,0,0,0|2,0,0]=4 3218 B12R1.385 CCOCc1ccc(c(c1)C)I 10ef4d7f37666fb6387d237ce186ee7f [0,2,0,0,0,0|2,0,0]=4 3219 B12R1.385 CCOCc1ccc(c(c1)Cl)Br 462d30b296aa19e82df398aca78c1565 [0,2,0,0,0,0|2,0,0]=4 3220 B12R1.385 CCOCc1ccc(c(c1)Cl)C 094a35726aaae717e4be998e3fa1d769 [0,2,0,0,0,0|2,0,0]=4 3221 B12R1.385 CCOCc1ccc(c(c1)Cl)Cl 205057310a46a0067ab02b1a96e32191 [0,2,0,0,0,0|2,0,0]=4 3222 B12R1.385 CCOCc1ccc(c(c1)Cl)F 37bc59b627ed89ca2916404c2096c425 [0,2,0,0,0,0|2,0,0]=4 3223 B12R1.385 CCOCc1ccc(c(c1)Cl)I 7af14f8592e632be25b911954a052f42 [0,2,0,0,0,0|2,0,0]=4 3224 B12R1.385 CCOCc1ccc(c(c1)F)Br 1d8dcd69d13121bdbfd4460e036908fe [0,2,0,0,0,0|2,0,0]=4 3225 B12R1.385 CCOCc1ccc(c(c1)F)C 0d45680218bcadba2bc3c68912f74396 [0,2,0,0,0,0|2,0,0]=4 3226 B12R1.385 CCOCc1ccc(c(c1)F)Cl 91591a5fa9834be1c0357da98b69a380 [0,2,0,0,0,0|2,0,0]=4 3227 B12R1.385 CCOCc1ccc(c(c1)F)F 487684497e6070d9191e67c2afeb535f [0,2,0,0,0,0|2,0,0]=4 3228 B12R1.385 CCOCc1ccc(c(c1)F)I a6bc92799c5a81ca3192b3bc36de5fd5 [0,2,0,0,0,0|2,0,0]=4 3229 B12R1.385 CCOCc1ccc(c(c1)I)Br 95e3ce34f16943756363f9b9de0d1c3b [0,2,0,0,0,0|2,0,0]=4 3230 B12R1.385 CCOCc1ccc(c(c1)I)C d2e8bd32757940c3fad8a6b5bc31e230 [0,2,0,0,0,0|2,0,0]=4 3231 B12R1.385 CCOCc1ccc(c(c1)I)Cl af1e080ad8c6c1d00c5d0713156fe8ef [0,2,0,0,0,0|2,0,0]=4 3232 B12R1.385 CCOCc1ccc(c(c1)I)F 6260e7416a8464170c802cfaf8cb5039 [0,2,0,0,0,0|2,0,0]=4 3233 B12R1.385 COCNc1cc(c(cn1)Br)Br b4b6da969ad0ec6ff5f35d7de80a156d [0,2,0,0,0,0|2,0,0]=4 3234 B12R1.385 COCNc1cc(c(cn1)Br)C f372d6a47442109c920decd0fbf9175a [0,2,0,0,0,0|2,0,0]=4 3235 B12R1.385 COCNc1cc(c(cn1)Br)Cl 47c68e73de71e0847e2a643220e5786c [0,2,0,0,0,0|2,0,0]=4 3236 B12R1.385 COCNc1cc(c(cn1)Br)F 4669b8a8238e16aedd61dfe648f63129 [0,2,0,0,0,0|2,0,0]=4 3237 B12R1.385 COCNc1cc(c(cn1)C)Br 0af89d5c7c8320a475ab744181bdff6b [0,2,0,0,0,0|2,0,0]=4 3238 B12R1.385 COCNc1cc(c(cn1)C)C fd1601e5c4871bf7284354846d595e81 [0,2,0,0,0,0|2,0,0]=4 3239 B12R1.385 COCNc1cc(c(cn1)C)Cl b5959022dbe56161d58ec2fd5824f455 [0,2,0,0,0,0|2,0,0]=4 3240 B12R1.385 COCNc1cc(c(cn1)C)F dd063a0fd077b9357474d1d3f8a392f1 [0,2,0,0,0,0|2,0,0]=4 3241 B12R1.385 COCNc1cc(c(cn1)C)I 07adc39314fb8ca745e068012d334d76 [0,2,0,0,0,0|2,0,0]=4 3242 B12R1.385 COCNc1cc(c(cn1)Cl)Br f07f29dbe0cb7a4d8dc2fbc15e80772f [0,2,0,0,0,0|2,0,0]=4 3243 B12R1.385 COCNc1cc(c(cn1)Cl)C 69fe87004a3e6afa2225718c25193777 [0,2,0,0,0,0|2,0,0]=4 3244 B12R1.385 COCNc1cc(c(cn1)Cl)Cl 4762459db3703eb4afd48641d09f71fa [0,2,0,0,0,0|2,0,0]=4 3245 B12R1.385 COCNc1cc(c(cn1)Cl)F ff1e017707c5e5247fa8cb425513e67f [0,2,0,0,0,0|2,0,0]=4 3246 B12R1.385 COCNc1cc(c(cn1)Cl)I 2dc0e5db60c9675b94f8a23398f27273 [0,2,0,0,0,0|2,0,0]=4 3247 B12R1.385 COCNc1cc(c(cn1)F)Br 20025fa55f5ef168dc7a3eff7d350623 [0,2,0,0,0,0|2,0,0]=4 3248 B12R1.385 COCNc1cc(c(cn1)F)C 11fb27d2d027af403801563f190328dc [0,2,0,0,0,0|2,0,0]=4 3249 B12R1.385 COCNc1cc(c(cn1)F)Cl f2b759a3480966a2e3c6b6966a10a7a5 [0,2,0,0,0,0|2,0,0]=4 3250 B12R1.385 COCNc1cc(c(cn1)F)F e810224d6387b87c3a31a848433fc3ff [0,2,0,0,0,0|2,0,0]=4 3251 B12R1.385 COCNc1cc(c(cn1)F)I 8f05617582f1ca9cb59ebefb019deeeb [0,2,0,0,0,0|2,0,0]=4 3252 B12R1.385 COCNc1cc(c(cn1)I)Br c6ffd9557b2c2054b9b94de8ab7450a8 [0,2,0,0,0,0|2,0,0]=4 3253 B12R1.385 COCNc1cc(c(cn1)I)C 8d538a535755a3f3fcbc38e73f55bf75 [0,2,0,0,0,0|2,0,0]=4 3254 B12R1.385 COCNc1cc(c(cn1)I)Cl 691ac339d28d16a3cbbbab18444e8e76 [0,2,0,0,0,0|2,0,0]=4 3255 B12R1.385 COCNc1cc(c(cn1)I)F bb840a46e7947989fc3b06550df91990 [0,2,0,0,0,0|2,0,0]=4 3256 B12R1.385 COCNc1ccc(=O)n(c1)C 1cf6d06e561bc57e473eeb0de105a54f [0,2,0,0,0,0|2,0,0]=4 3257 B12R1.385 COCNc1ccc(c(c1)Br)Br 73956a2e95e422c967ea707396f19668 [0,2,0,0,0,0|1,0,0]=3 3258 B12R1.385 COCNc1ccc(c(c1)Br)C b360ec8002ab927721f6f5e3e7ec0684 [0,2,0,0,0,0|1,0,0]=3 3259 B12R1.385 COCNc1ccc(c(c1)Br)Cl af293c390a26e203bcbe23ead55f1c21 [0,2,0,0,0,0|1,0,0]=3 3260 B12R1.385 COCNc1ccc(c(c1)Br)F de5d9b35e9263c1b2b367fdb23efc578 [0,2,0,0,0,0|1,0,0]=3 3261 B12R1.385 COCNc1ccc(c(c1)Br)I 2bc732384c4192afff75d7e4fa09bb7b [0,2,0,0,0,0|1,0,0]=3 3262 B12R1.385 COCNc1ccc(c(c1)C)Br 2663989a725796a2f3198be1ce358da0 [0,2,0,0,0,0|1,0,0]=3 3263 B12R1.385 COCNc1ccc(c(c1)C)C 3d572118f8e5f9922ae93f5ac0860dac [0,2,0,0,0,0|1,0,0]=3 3264 B12R1.385 COCNc1ccc(c(c1)C)Cl 442b3dd6a0080298f03a2cfb1636b883 [0,2,0,0,0,0|1,0,0]=3 3265 B12R1.385 COCNc1ccc(c(c1)C)F 8fcb00731a2f7ffc94cac62cf0e755bb [0,2,0,0,0,0|1,0,0]=3 3266 B12R1.385 COCNc1ccc(c(c1)C)I 9f0311da7201a5d2fecf2cce0171e1a8 [0,2,0,0,0,0|1,0,0]=3 3267 B12R1.385 COCNc1ccc(c(c1)Cl)Br b791a7a3e02c3057b6b35d0c5c91ffcd [0,2,0,0,0,0|1,0,0]=3 3268 B12R1.385 COCNc1ccc(c(c1)Cl)C a303498a3736624541233784ed7de227 [0,2,0,0,0,0|1,0,0]=3 3269 B12R1.385 COCNc1ccc(c(c1)Cl)Cl abb2b4d41a11aa72834e7a2383a0a3c5 [0,2,0,0,0,0|1,0,0]=3 3270 B12R1.385 COCNc1ccc(c(c1)Cl)F 68c8f33a38ab80ab1e82a9070fda2dd0 [0,2,0,0,0,0|1,0,0]=3 3271 B12R1.385 COCNc1ccc(c(c1)Cl)I 44318770d64631078eeef832adde2f2a [0,2,0,0,0,0|1,0,0]=3 3272 B12R1.385 COCNc1ccc(c(c1)F)Br 3825345dc3bb2b01bfd5f2cae4f417e6 [0,2,0,0,0,0|1,0,0]=3 3273 B12R1.385 COCNc1ccc(c(c1)F)C 681f2f7baf4a2ade4325f1ffcfdaeddd [0,2,0,0,0,0|1,0,0]=3 3274 B12R1.385 COCNc1ccc(c(c1)F)Cl 7693fb82ad7233b2c6870ac93c0975ff [0,2,0,0,0,0|1,0,0]=3 3275 B12R1.385 COCNc1ccc(c(c1)F)F c956699ce95ac76d01ad776aa8b1d9e8 [0,2,0,0,0,0|1,0,0]=3 3276 B12R1.385 COCNc1ccc(c(c1)F)I 79a374431b7ca2f9b89cf43e25a245b6 [0,2,0,0,0,0|1,0,0]=3 3277 B12R1.385 COCNc1ccc(c(c1)I)Br d0968a5bd5fd8da33a7c7864eb36d9a3 [0,2,0,0,0,0|1,0,0]=3 3278 B12R1.385 COCNc1ccc(c(c1)I)C f465e0a7cca4d622d2f19a48f499030c [0,2,0,0,0,0|1,0,0]=3 3279 B12R1.385 COCNc1ccc(c(c1)I)Cl 1a8ddd75db934d653c1ea74610c7cfde [0,2,0,0,0,0|1,0,0]=3 3280 B12R1.385 COCNc1ccc(c(c1)I)F d77dafde08b52bc97b9be651e2c5134d [0,2,0,0,0,0|1,0,0]=3 3281 B12R1.385 COCNc1ccc(c(n1)Br)Br 7b5f1300c1353d2720d03a8822dc60c2 [0,2,0,0,0,0|2,0,0]=4 3282 B12R1.385 COCNc1ccc(c(n1)Br)C 0e6a2ee24a378201471b3cf65bb7c03e [0,2,0,0,0,0|2,0,0]=4 3283 B12R1.385 COCNc1ccc(c(n1)Br)Cl fd811108ddb2c8b646954983bd763061 [0,2,0,0,0,0|2,0,0]=4 3284 B12R1.385 COCNc1ccc(c(n1)Br)F ac9a22d2960f4021aff1def55db3571b [0,2,0,0,0,0|2,0,0]=4 3285 B12R1.385 COCNc1ccc(c(n1)Br)I 9c9e549d42e712981b44ee730ae24419 [0,2,0,0,0,0|2,0,0]=4 3286 B12R1.385 COCNc1ccc(c(n1)C)Br 3180028ebba1090e606c83bb29206bb3 [0,2,0,0,0,0|2,0,0]=4 3287 B12R1.385 COCNc1ccc(c(n1)C)C b14a4331d066087bd81fd1fa42f71d41 [0,2,0,0,0,0|2,0,0]=4 3288 B12R1.385 COCNc1ccc(c(n1)C)Cl 2b3030783399794403eb9d17b89c3d13 [0,2,0,0,0,0|2,0,0]=4 3289 B12R1.385 COCNc1ccc(c(n1)C)F cccbbac01ec2c596f8bd93589f519f37 [0,2,0,0,0,0|2,0,0]=4 3290 B12R1.385 COCNc1ccc(c(n1)C)I cd6dc11bd598ce1dfdf0c21533a49643 [0,2,0,0,0,0|2,0,0]=4 3291 B12R1.385 COCNc1ccc(c(n1)Cl)Br efef149cbf2aa6080b79de0b612204b5 [0,2,0,0,0,0|2,0,0]=4 3292 B12R1.385 COCNc1ccc(c(n1)Cl)C be88a32757b71e917294969f13afff52 [0,2,0,0,0,0|2,0,0]=4 3293 B12R1.385 COCNc1ccc(c(n1)Cl)Cl 6a164d7b276511e779707ba942fe00fe [0,2,0,0,0,0|2,0,0]=4 3294 B12R1.385 COCNc1ccc(c(n1)Cl)F 9feb03bc8d155df3a018dd729f8e9430 [0,2,0,0,0,0|2,0,0]=4 3295 B12R1.385 COCNc1ccc(c(n1)Cl)I 42b5f1b06e21e9d2e76f2f8c872add93 [0,2,0,0,0,0|2,0,0]=4 3296 B12R1.385 COCNc1ccc(c(n1)F)Br 212b474a4648bb511b610726760d1f1c [0,2,0,0,0,0|2,0,0]=4 3297 B12R1.385 COCNc1ccc(c(n1)F)C b0cd1e026ff856c05aa118e06af31a5d [0,2,0,0,0,0|2,0,0]=4 3298 B12R1.385 COCNc1ccc(c(n1)F)Cl 04bf07e4d7b2efd3314a925d7ce24f4f [0,2,0,0,0,0|2,0,0]=4 3299 B12R1.385 COCNc1ccc(c(n1)F)F 886a57989b3f128492a97375dbff63c0 [0,2,0,0,0,0|2,0,0]=4 3300 B12R1.385 COCNc1ccc(c(n1)F)I 46c7f5b4ec8d55d2ffb2032b1fd194de [0,2,0,0,0,0|2,0,0]=4 3301 B12R1.385 COCNc1ccc(c(n1)I)Br b04f8f173f796fa94780f6a2b66b5064 [0,2,0,0,0,0|2,0,0]=4 3302 B12R1.385 COCNc1ccc(c(n1)I)F b91f0517f3a6a2f8253a86d7b6c62918 [0,2,0,0,0,0|2,0,0]=4 3303 B12R1.385 COCNc1ccn(c(=O)c1)C 7168e7698c6a3f748f0bad58266b5f9e [0,2,0,0,0,0|2,0,0]=4 3304 B12R1.385 COCNc1cnc(c(c1)Br)Br 5b0a98370600f861365b111d82bccd11 [0,2,0,0,0,0|2,0,0]=4 3305 B12R1.385 COCNc1cnc(c(c1)Br)C c99341bf4d400041910756e48e52cc44 [0,2,0,0,0,0|2,0,0]=4 3306 B12R1.385 COCNc1cnc(c(c1)Br)Cl 6cf147c95327bcf3c2c2b708c3bf71b9 [0,2,0,0,0,0|2,0,0]=4 3307 B12R1.385 COCNc1cnc(c(c1)Br)F 438a860b84abf9d27cb660d2b23da825 [0,2,0,0,0,0|2,0,0]=4 3308 B12R1.385 COCNc1cnc(c(c1)Br)I b80d05bbd96b5b528ec0ad78a37ca3af [0,2,0,0,0,0|2,0,0]=4 3309 B12R1.385 COCNc1cnc(c(c1)C)Br 1384d0a0309857b2c58bba77128a6105 [0,2,0,0,0,0|2,0,0]=4 3310 B12R1.385 COCNc1cnc(c(c1)C)C 94f2e95a0c279b9eef5737a324f4ab3f [0,2,0,0,0,0|2,0,0]=4 3311 B12R1.385 COCNc1cnc(c(c1)C)Cl eec800d3a3a7eb6fdf000a1e6277d6fa [0,2,0,0,0,0|2,0,0]=4 3312 B12R1.385 COCNc1cnc(c(c1)C)F 0a2e210d83dd2512ed682760244189a8 [0,2,0,0,0,0|2,0,0]=4 3313 B12R1.385 COCNc1cnc(c(c1)Cl)Br 109cbd93be0589b7fa2e83321289d50c [0,2,0,0,0,0|2,0,0]=4 3314 B12R1.385 COCNc1cnc(c(c1)Cl)C f8d59a8c3eae6eeec351d63c784798bf [0,2,0,0,0,0|2,0,0]=4 3315 B12R1.385 COCNc1cnc(c(c1)Cl)Cl d9ccb853bd8921fac7716613b9a51f1d [0,2,0,0,0,0|2,0,0]=4 3316 B12R1.385 COCNc1cnc(c(c1)Cl)F 86e494ca9629caf9014e6e6a9695e8c8 [0,2,0,0,0,0|2,0,0]=4 3317 B12R1.385 COCNc1cnc(c(c1)Cl)I bd7e20040a7bd7bd3850dd51b75778c3 [0,2,0,0,0,0|2,0,0]=4 3318 B12R1.385 COCNc1cnc(c(c1)F)Br 07ef899ac60f746f1ab7109e8c1e41be [0,2,0,0,0,0|2,0,0]=4 3319 B12R1.385 COCNc1cnc(c(c1)F)C 3beb6154bb25f3aff5b038c514fdf403 [0,2,0,0,0,0|2,0,0]=4 3320 B12R1.385 COCNc1cnc(c(c1)F)Cl a2b5ab884ddc04d5aba6d57525e41a88 [0,2,0,0,0,0|2,0,0]=4 3321 B12R1.385 COCNc1cnc(c(c1)F)F 279ed639fc9fe2917c29ffb2a2b4429b [0,2,0,0,0,0|2,0,0]=4 3322 B12R1.385 COCNc1cnc(c(c1)F)I d0d7adc45ee6bc9df87a95797ccb0093 [0,2,0,0,0,0|2,0,0]=4 3323 B12R1.385 COCNc1cnc(c(c1)I)Br 373a296376cd5696f5f06bd1c38a5ec0 [0,2,0,0,0,0|2,0,0]=4 3324 B12R1.385 COCNc1cnc(c(c1)I)Cl e558fafff5be8e4168a50f00e472e6a1 [0,2,0,0,0,0|2,0,0]=4 3325 B12R1.385 COCOc1cc(c(cn1)Br)Br af1bb67531f8ff99b9ca1947d3a86b11 [0,2,0,0,0,0|2,0,0]=4 3326 B12R1.385 COCOc1cc(c(cn1)Br)C c4077441c0c3f2ca03690b6b2c03b4f3 [0,2,0,0,0,0|2,0,0]=4 3327 B12R1.385 COCOc1cc(c(cn1)Br)Cl c0be1ab75b151d29a390bf5354b84501 [0,2,0,0,0,0|2,0,0]=4 3328 B12R1.385 COCOc1cc(c(cn1)Br)F fd1b02f2de62e36375224e1aaa00c579 [0,2,0,0,0,0|2,0,0]=4 3329 B12R1.385 COCOc1cc(c(cn1)C)Br 6c400e039a78457ce0e16c9972cde6ac [0,2,0,0,0,0|2,0,0]=4 3330 B12R1.385 COCOc1cc(c(cn1)C)C 44d3b47dc33929146d557f6a521947b6 [0,2,0,0,0,0|2,0,0]=4 3331 B12R1.385 COCOc1cc(c(cn1)C)I a8532da624e2ad4fa1b80a3f0c9f8357 [0,2,0,0,0,0|2,0,0]=4 3332 B12R1.385 COCOc1cc(c(cn1)Cl)Br c8e72acf4d6475b8d6cf7db41bbefa24 [0,2,0,0,0,0|2,0,0]=4 3333 B12R1.385 COCOc1cc(c(cn1)Cl)C c82946fc7a8c6128bf73f642626c086a [0,2,0,0,0,0|2,0,0]=4 3334 B12R1.385 COCOc1cc(c(cn1)F)Br 65ff68f79d7bf7483a566d4692443733 [0,2,0,0,0,0|2,0,0]=4 3335 B12R1.385 COCOc1cc(c(cn1)F)C 72ecf10fab466998a3074f16a9c2874e [0,2,0,0,0,0|2,0,0]=4 3336 B12R1.385 COCOc1cc(c(cn1)F)I dfcfcbf528720a131c4bbc2aade3fe5b [0,2,0,0,0,0|2,0,0]=4 3337 B12R1.385 COCOc1cc(c(cn1)I)C d5f1141abf2e910c626131899239e951 [0,2,0,0,0,0|2,0,0]=4 3338 B12R1.385 COCOc1cc(c(cn1)I)Cl 404205463a83e32527418424aeb4171e [0,2,0,0,0,0|2,0,0]=4 3339 B12R1.385 COCOc1ccc(=O)n(c1)C b6aaa9481be66adb68e2daa851b39511 [0,2,0,0,0,0|2,0,0]=4 3340 B12R1.385 COCOc1ccc(c(c1)Br)Br 206cbbc5eebde8a4eb9aecb93dd79f58 [0,2,0,0,0,0|1,0,0]=3 3341 B12R1.385 COCOc1ccc(c(c1)Br)C e3f4c6b5a7f93db3705537dbc3d57aa3 [0,2,0,0,0,0|1,0,0]=3 3342 B12R1.385 COCOc1ccc(c(c1)Br)Cl 393973a325ed0560e3b7c6a58f0ce437 [0,2,0,0,0,0|1,0,0]=3 3343 B12R1.385 COCOc1ccc(c(c1)Br)F 830d7f40d8fe38ab93557b30992f6ee3 [0,2,0,0,0,0|1,0,0]=3 3344 B12R1.385 COCOc1ccc(c(c1)Br)I e2893303be02e39d1de9c33b8e502411 [0,2,0,0,0,0|1,0,0]=3 3345 B12R1.385 COCOc1ccc(c(c1)C)Br f15c6cceed8ce167aaa57a9dade32f8f [0,2,0,0,0,0|1,0,0]=3 3346 B12R1.385 COCOc1ccc(c(c1)C)C bc2a23339ce3134c112194b77f6167fd [0,2,0,0,0,0|1,0,0]=3 3347 B12R1.385 COCOc1ccc(c(c1)C)Cl a4260945b13b9ba2c6cd0b8687ac0338 [0,2,0,0,0,0|1,0,0]=3 3348 B12R1.385 COCOc1ccc(c(c1)C)F 784e8c0b835286036bd14798f85afce9 [0,2,0,0,0,0|1,0,0]=3 3349 B12R1.385 COCOc1ccc(c(c1)C)I 3ecf013c221981d84a541223195d6d5a [0,2,0,0,0,0|1,0,0]=3 3350 B12R1.385 COCOc1ccc(c(c1)Cl)Br 5b3140e8a1c21dbc210962638bb96276 [0,2,0,0,0,0|1,0,0]=3 3351 B12R1.385 COCOc1ccc(c(c1)Cl)C 4283bbda14ed8dd1f5d4f458f7bc9d8d [0,2,0,0,0,0|1,0,0]=3 3352 B12R1.385 COCOc1ccc(c(c1)Cl)Cl a0b2ecc48bd36286c713b0cdb87581b9 [0,2,0,0,0,0|1,0,0]=3 3353 B12R1.385 COCOc1ccc(c(c1)Cl)F 5e079f363722a7ef97ed0097775e2375 [0,2,0,0,0,0|1,0,0]=3 3354 B12R1.385 COCOc1ccc(c(c1)Cl)I 93587f4b0747d68f09a6318762be37e0 [0,2,0,0,0,0|1,0,0]=3 3355 B12R1.385 COCOc1ccc(c(c1)F)Br c4b540f3e43d9c8f92d8a809fe9ff951 [0,2,0,0,0,0|1,0,0]=3 3356 B12R1.385 COCOc1ccc(c(c1)F)C 395e74d472621a04f14d3d3a9e920f90 [0,2,0,0,0,0|1,0,0]=3 3357 B12R1.385 COCOc1ccc(c(c1)F)Cl 4165711a7fdc6490060ef2787040af44 [0,2,0,0,0,0|1,0,0]=3 3358 B12R1.385 COCOc1ccc(c(c1)F)F 85607d17a85cc562173c31411c4e4f2f [0,2,0,0,0,0|1,0,0]=3 3359 B12R1.385 COCOc1ccc(c(c1)F)I 6bff5bc07a5a6060fb9b57a5167cfd81 [0,2,0,0,0,0|1,0,0]=3 3360 B12R1.385 COCOc1ccc(c(c1)I)Br d2691f93e0ff4b1063844136dac5b3cd [0,2,0,0,0,0|1,0,0]=3 3361 B12R1.385 COCOc1ccc(c(c1)I)C 247d88137598341e4512d53be3ce8550 [0,2,0,0,0,0|1,0,0]=3 3362 B12R1.385 COCOc1ccc(c(c1)I)Cl 2e9a69b7b97775e74ee64c39bd146d94 [0,2,0,0,0,0|1,0,0]=3 3363 B12R1.385 COCOc1ccc(c(c1)I)F 088f45de2d8a006369acf3aeef860d2d [0,2,0,0,0,0|1,0,0]=3 3364 B12R1.385 COCOc1ccc(c(n1)Br)Br 38a13a8a42969c0ee00472804f1497c2 [0,2,0,0,0,0|2,0,0]=4 3365 B12R1.385 COCOc1ccc(c(n1)Br)C 3d83119d4ff9ee5959458c60dac470b4 [0,2,0,0,0,0|2,0,0]=4 3366 B12R1.385 COCOc1ccc(c(n1)Br)Cl ba9dea973ba0ee5042a9d7fa72fffe1e [0,2,0,0,0,0|2,0,0]=4 3367 B12R1.385 COCOc1ccc(c(n1)Br)F 0e185332c02374042a9701299273c127 [0,2,0,0,0,0|2,0,0]=4 3368 B12R1.385 COCOc1ccc(c(n1)C)Br 38dfe679d4a2bb774a7e00a466de8ec4 [0,2,0,0,0,0|2,0,0]=4 3369 B12R1.385 COCOc1ccc(c(n1)C)Cl 981d778ecf1da98ce163710e70bc734a [0,2,0,0,0,0|2,0,0]=4 3370 B12R1.385 COCOc1ccc(c(n1)Cl)Br 3cdaff5ca60bd6180bb6362ffb0b83e4 [0,2,0,0,0,0|2,0,0]=4 3371 B12R1.385 COCOc1ccc(c(n1)Cl)Cl 5ed88f41b56606edde86c722ebf62218 [0,2,0,0,0,0|2,0,0]=4 3372 B12R1.385 COCOc1ccc(c(n1)F)Br 4bd1f53e8dcbe5cfd0d53b83dfdefb83 [0,2,0,0,0,0|2,0,0]=4 3373 B12R1.385 COCOc1ccc(c(n1)F)I 0fceaa10385ca33ba782017fd3453b60 [0,2,0,0,0,0|2,0,0]=4 3374 B12R1.385 COCOc1ccn(c(=O)c1)C 848aa5fd9c826844d55a4ecc85ecc96e [0,2,0,0,0,0|2,0,0]=4 3375 B12R1.385 COCOc1cnc(c(c1)Br)C 3af9d586157c2dbed246696292ccf659 [0,2,0,0,0,0|2,0,0]=4 3376 B12R1.385 COCOc1cnc(c(c1)Br)Cl cfa16eb95d4cbf0056c2584a3ef7a667 [0,2,0,0,0,0|2,0,0]=4 3377 B12R1.385 COCOc1cnc(c(c1)Br)F 05ea5fb3b264fb0559794577c151efae [0,2,0,0,0,0|2,0,0]=4 3378 B12R1.385 COCOc1cnc(c(c1)C)Br 8251fadfbbcaed0725d1732f5533ab29 [0,2,0,0,0,0|2,0,0]=4 3379 B12R1.385 COCOc1cnc(c(c1)C)C 6c93e4ff51c9d21d7cf27a3636176921 [0,2,0,0,0,0|2,0,0]=4 3380 B12R1.385 COCOc1cnc(c(c1)C)Cl 51d270c73f83e5874e8147b7f48179fd [0,2,0,0,0,0|2,0,0]=4 3381 B12R1.385 COCOc1cnc(c(c1)C)F bbfa74252957e317cf98f0251b26721b [0,2,0,0,0,0|2,0,0]=4 3382 B12R1.385 COCOc1cnc(c(c1)Cl)Br a06fb26052fc6a06d0bc8684673c0343 [0,2,0,0,0,0|2,0,0]=4 3383 B12R1.385 COCOc1cnc(c(c1)Cl)C 64a4e59600dbc72554a79be3477bba84 [0,2,0,0,0,0|2,0,0]=4 3384 B12R1.385 COCOc1cnc(c(c1)Cl)Cl 4150ee9100c76de7bc8b87ab90883ad0 [0,2,0,0,0,0|2,0,0]=4 3385 B12R1.385 COCOc1cnc(c(c1)Cl)F 33d00bc576e26639dbda76a422be0fc5 [0,2,0,0,0,0|2,0,0]=4 3386 B12R1.385 COCOc1cnc(c(c1)F)Br dbd9de372a507fd78b4697a6e24b26b3 [0,2,0,0,0,0|2,0,0]=4 3387 B12R1.385 COCOc1cnc(c(c1)F)Cl 3c248a0cf6796dc45facaaca9f92f471 [0,2,0,0,0,0|2,0,0]=4 3388 B12R1.385 COCOc1cnc(c(c1)F)F 72997a250f5d8a42ba377c8d3791db61 [0,2,0,0,0,0|2,0,0]=4 3389 B12R1.385 COCOc1cnc(c(c1)I)Br 8815dba43dc08cf84892b24aa9361a92 [0,2,0,0,0,0|2,0,0]=4 3390 B12R1.385 CSCNc1ccc(c(c1)Br)C c4c320a58c428d28aa23b50b67300fb5 [0,2,0,0,0,0|1,1,0]=4 3391 B12R1.385 CSCNc1ccc(c(c1)Br)Cl 0e3f61623528dd5ca94fa5966a81d539 [0,2,0,0,0,0|1,1,0]=4 3392 B12R1.385 CSCNc1ccc(c(c1)Br)F 024c5c8394bc2fdfda3919c8d3625b52 [0,2,0,0,0,0|1,1,0]=4 3393 B12R1.385 CSCNc1ccc(c(c1)Br)I dd2ebda1683b5b785f615ea1644287cb [0,2,0,0,0,0|1,1,0]=4 3394 B12R1.385 CSCNc1ccc(c(c1)C)Br c05ebfc262a19e2d73eb7636260bc113 [0,2,0,0,0,0|1,1,0]=4 3395 B12R1.385 CSCNc1ccc(c(c1)C)C a879772e968408e2939e9e39583fa567 [0,2,0,0,0,0|1,1,0]=4 3396 B12R1.385 CSCNc1ccc(c(c1)C)Cl 7ceb2be18224f9e5262d70afadb76e09 [0,2,0,0,0,0|1,1,0]=4 3397 B12R1.385 CSCNc1ccc(c(c1)C)F 170663dde285f59d811fa748f29af047 [0,2,0,0,0,0|1,1,0]=4 3398 B12R1.385 CSCNc1ccc(c(c1)C)I df8fba019528f29ee4149f40a1a46677 [0,2,0,0,0,0|1,1,0]=4 3399 B12R1.385 CSCNc1ccc(c(c1)Cl)Br e3f2c847f5be4cdfc8c4d4c0988762cb [0,2,0,0,0,0|1,1,0]=4 3400 B12R1.385 CSCNc1ccc(c(c1)Cl)C 2a0fd54b2d6522fb5172edcd3aa9b611 [0,2,0,0,0,0|1,1,0]=4 3401 B12R1.385 CSCNc1ccc(c(c1)Cl)Cl 134ce6721c5a23d25b4578e4a5099946 [0,2,0,0,0,0|1,1,0]=4 3402 B12R1.385 CSCNc1ccc(c(c1)Cl)F db0fcce408a3c6d90dd8d9def4b52566 [0,2,0,0,0,0|1,1,0]=4 3403 B12R1.385 CSCNc1ccc(c(c1)Cl)I 5d86768c5e838616c39766d1e2fdae3d [0,2,0,0,0,0|1,1,0]=4 3404 B12R1.385 CSCNc1ccc(c(c1)F)C afd5a1a51eb79147224247740b8bf805 [0,2,0,0,0,0|1,1,0]=4 3405 B12R1.385 CSCNc1ccc(c(c1)F)Cl 146b143b099143359be4fa5c9356a48a [0,2,0,0,0,0|1,1,0]=4 3406 B12R1.385 CSCNc1ccc(c(c1)F)F 11e777285876f1020bade957f5350550 [0,2,0,0,0,0|1,1,0]=4 3407 B12R1.385 CSCNc1ccc(c(c1)I)C 881577738a672d87dd6fb06e252a9ca0 [0,2,0,0,0,0|1,1,0]=4 3408 B12R1.385 CSCNc1ccc(c(c1)I)Cl 977fd837cf1ab0f64cedb9eaf37865dc [0,2,0,0,0,0|1,1,0]=4 3409 B12R1.385 CSCNc1ccc(c(c1)I)F 131f86563941ca144c3f2ffff4edf7de [0,2,0,0,0,0|1,1,0]=4 3410 B12R1.385 CSCOc1ccc(c(c1)Br)Br 3d8ca72ac9b119fdb293aa9c18fcfdda [0,2,0,0,0,0|1,1,0]=4 3411 B12R1.385 CSCOc1ccc(c(c1)Br)C d032cdc360b6faf0a3ea470ac4122d39 [0,2,0,0,0,0|1,1,0]=4 3412 B12R1.385 CSCOc1ccc(c(c1)Br)Cl efef51869c6276ac05029844676fc3e7 [0,2,0,0,0,0|1,1,0]=4 3413 B12R1.385 CSCOc1ccc(c(c1)Br)F cd7d670bb458b227d8be80f90074415b [0,2,0,0,0,0|1,1,0]=4 3414 B12R1.385 CSCOc1ccc(c(c1)Br)I fd24b78ce34b9b4bf7c936437f4b0021 [0,2,0,0,0,0|1,1,0]=4 3415 B12R1.385 CSCOc1ccc(c(c1)C)Br 19c8eb5d163e4401385354fedcc25207 [0,2,0,0,0,0|1,1,0]=4 3416 B12R1.385 CSCOc1ccc(c(c1)C)C a65dd6e83af0ed2e05b0ea0f023c4e17 [0,2,0,0,0,0|1,1,0]=4 3417 B12R1.385 CSCOc1ccc(c(c1)C)Cl f173aca9a801179c6f49306e04d66cea [0,2,0,0,0,0|1,1,0]=4 3418 B12R1.385 CSCOc1ccc(c(c1)C)F 531a860c05a7ba47324955862d6816e0 [0,2,0,0,0,0|1,1,0]=4 3419 B12R1.385 CSCOc1ccc(c(c1)C)I 2f7c34ddf9abbbe92adf4ccad8cbffb0 [0,2,0,0,0,0|1,1,0]=4 3420 B12R1.385 CSCOc1ccc(c(c1)Cl)Br 6eefe70ea9211fddb6d86cfd58279808 [0,2,0,0,0,0|1,1,0]=4 3421 B12R1.385 CSCOc1ccc(c(c1)Cl)C e638b439f83ca1050877fbb55e3667e1 [0,2,0,0,0,0|1,1,0]=4 3422 B12R1.385 CSCOc1ccc(c(c1)Cl)Cl 07593a1d77b7982fa59601bcfc203dbd [0,2,0,0,0,0|1,1,0]=4 3423 B12R1.385 CSCOc1ccc(c(c1)Cl)F 36c9b76495a30c0679480cfce348e7c8 [0,2,0,0,0,0|1,1,0]=4 3424 B12R1.385 CSCOc1ccc(c(c1)Cl)I 467ddde8e806867d19d8605c84aa5332 [0,2,0,0,0,0|1,1,0]=4 3425 B12R1.385 CSCOc1ccc(c(c1)F)Br 53b44f7d8eac0d800f133619144a498d [0,2,0,0,0,0|1,1,0]=4 3426 B12R1.385 CSCOc1ccc(c(c1)F)C 582a7668a30693a159ad9eb51caaedb5 [0,2,0,0,0,0|1,1,0]=4 3427 B12R1.385 CSCOc1ccc(c(c1)F)Cl 97ac836b4cc4d22a6a3fda8d3c053c4e [0,2,0,0,0,0|1,1,0]=4 3428 B12R1.385 CSCOc1ccc(c(c1)F)F b3964546ffed4a715840de1a3f5f8c4a [0,2,0,0,0,0|1,1,0]=4 3429 B12R1.385 CSCOc1ccc(c(c1)F)I f3c256d2f84714910fd0d2d86d141fd8 [0,2,0,0,0,0|1,1,0]=4 3430 B12R1.385 CSCOc1ccc(c(c1)I)Br 3dbacc33a76447b5364b6cab507a76f4 [0,2,0,0,0,0|1,1,0]=4 3431 B12R1.385 CSCOc1ccc(c(c1)I)C 256f9aeaf9b03e9da22b8e45ff0b29a3 [0,2,0,0,0,0|1,1,0]=4 3432 B12R1.385 CSCOc1ccc(c(c1)I)Cl 64085c6beda5c929723d38c4922440a2 [0,2,0,0,0,0|1,1,0]=4 3433 B12R1.385 CSCOc1ccc(c(c1)I)F cc64d7768fd614bbf862c94ffd9e6b0a [0,2,0,0,0,0|1,1,0]=4 3434 B12R1.3 C#CC(OCC)c1ccccc1 c9e222a07b1334c71e039de024517831 [0,2,0,0,0,0|2,0,0]=4 3435 B12R1.3 C#C[C@@H](OCC)c1ccccc1 ab36c1d59184fd317cb3013d853a5671 [0,2,0,0,0,0|2,0,0]=4 3436 B12R1.3 C#C[C@H](OCC)c1ccccc1 1101319a2e49d14a6eed62e76a43a592 [0,2,0,0,0,0|2,0,0]=4 3437 B12R1.3 C=CC(NCC)c1ccccc1 7683e9d7b82c3281238f04ed1a75e97e [0,2,0,0,0,0|2,0,0]=4 3438 B12R1.3 C=CC(OCC)c1ccccc1 6bde42162b5d4c427a68bf4a10c8d095 [0,2,0,0,0,0|2,0,0]=4 3439 B12R1.3 C=C[C@@H](NCC)c1ccccc1 ce0bccab84f78d550cd5d29e0af99881 [0,2,0,0,0,0|2,0,0]=4 3440 B12R1.3 C=C[C@H](NCC)c1ccccc1 378688aa1f70c0c46a994c0dd710e214 [0,2,0,0,0,0|2,0,0]=4 3441 B12R1.3 CCCN(C#N)c1ccccc1 cfc28cb4e183f808746da0f8e7595ff2 [0,2,0,0,0,0|2,0,0]=4 3442 B12R1.3 CCCN(C=O)c1ccccc1 dd84a45c645f807d0c332ade8b13b5fc [0,2,0,0,0,0|2,0,0]=4 3443 B12R1.3 CCCN(CC)c1ccccc1 5ea19e4bc735ea7f3069a2089b17f98f [0,2,0,0,0,0|2,0,0]=4 3444 B12R1.3 CCCN(CF)c1ccccc1 09c2a5c50e06a77cf23cd7a11292cbb8 [0,2,0,0,0,0|2,0,0]=4 3445 B12R1.3 CCCN(CO)c1ccccc1 332945179d143a8b0cba1e51c0b9da9c [0,2,0,0,0,0|2,0,0]=4 3446 B12R1.3 CCN(COC)c1ccccn1 0b1b78db80afb2e10943f7ad289f1450 [0,2,0,0,0,0|2,0,0]=4 3447 B12R1.3 CCN(COC)c1cccnc1 799190509faf878a529d2c7126b2c660 [0,2,0,0,0,0|2,0,0]=4 3448 B12R1.3 CCN(COC)c1ccncc1 dd09e0c2e668bd33e2c11f3e62f92252 [0,2,0,0,0,0|2,0,0]=4 3449 B12R1.3 CCNC(C#N)c1ccccc1 9c3c1340c48a32c7b7c4df075ca3e927 [0,2,0,0,0,0|2,0,0]=4 3450 B12R1.3 CCNC(CC)c1ccccc1 545af735d01bd949c3ac8c0f705df1c5 [0,2,0,0,0,0|2,0,0]=4 3451 B12R1.3 CCNC(CO)c1ccccc1 614d7335d28e1b76b7f75c607857ca9e [0,2,0,0,0,0|2,0,0]=4 3452 B12R1.3 CCN[C@@H](CC)c1ccccc1 04d3b6bff3d1780d8e4393fe160a01a5 [0,2,0,0,0,0|2,0,0]=4 3453 B12R1.3 CCN[C@@H](CF)c1ccccc1 ab49fd1b2fc91a1fdd527edfe33c19df [0,2,0,0,0,0|2,0,0]=4 3454 B12R1.3 CCN[C@@H](CO)c1ccccc1 9d47715e51326d3f123529a31c888612 [0,2,0,0,0,0|2,0,0]=4 3455 B12R1.3 CCN[C@H](CC)c1ccccc1 caae78d6c102af5eac580f83fa54bc70 [0,2,0,0,0,0|2,0,0]=4 3456 B12R1.3 CCN[C@H](CO)c1ccccc1 73c9e00984005addb2e89adfbc35e5fb [0,2,0,0,0,0|2,0,0]=4 3457 B12R1.3 CCOC(C#N)c1ccccc1 805d27e9f4caf999dbaee63bd249473f [0,2,0,0,0,0|2,0,0]=4 3458 B12R1.3 CCOC(CC)c1ccccc1 1d12b3cd8d8b35a196d78ca3c83b16b1 [0,2,0,0,0,0|2,0,0]=4 3459 B12R1.3 CCOC(CF)c1ccccc1 bb8f7d948231fd3c336c5958e3d5f3d1 [0,2,0,0,0,0|2,0,0]=4 3460 B12R1.3 CCO[C@@H](C#N)c1ccccc1 f112c502298ec98341142ef676ad95e1 [0,2,0,0,0,0|2,0,0]=4 3461 B12R1.3 CCO[C@@H](CC)c1ccccc1 ff776a615b7682f9fc21ac29a916a75c [0,2,0,0,0,0|2,0,0]=4 3462 B12R1.3 CCO[C@H](CC)c1ccccc1 126bf67ce7412ce4ee019181c066a374 [0,2,0,0,0,0|2,0,0]=4 3463 B12R1.3 CCO[C@H](CF)c1ccccc1 7dd160e9e223f7bf78a48ff1b17e143c [0,2,0,0,0,0|2,0,0]=4 3464 B12R1.3 COCN(C#N)c1ccccc1 87a980f08102a0f2b1726c41ff2f41d9 [0,2,0,0,0,0|1,0,0]=3 3465 B12R1.3 CSCN(C#N)c1ccccc1 843e8ab28433f114a5d4f97acc57bead [0,2,0,0,0,0|1,1,0]=4 3466 B12R1.17 CCCN(C)c1cccc(c1)Br 7eb75a8250f95c9697df4917ec6489ae [0,2,0,0,0,0|2,0,0]=4 3467 B12R1.17 CCCN(C)c1cccc(c1)Cl 07e726c51710591c3cf839ae947b1a42 [0,2,0,0,0,0|2,0,0]=4 3468 B12R1.17 CCCN(C)c1cccc(c1)F af9295ec07040c2649b20d250b5d0681 [0,2,0,0,0,0|2,0,0]=4 3469 B12R1.17 CCCN(C)c1cccc(c1)I 91e551f84de58d84b25877bbf8b8f4e6 [0,2,0,0,0,0|2,0,0]=4 3470 B12R1.17 CCNC(C)c1cccc(c1)Br e6c9fd584e7feb4e758a650f51e22ccc [0,2,0,0,0,0|2,0,0]=4 3471 B12R1.17 CCNC(C)c1cccc(c1)C db8e6428335d8b366ee39d6e277943db [0,2,0,0,0,0|2,0,0]=4 3472 B12R1.17 CCNC(C)c1cccc(c1)Cl 51c25d2dceca4ad868198756d2f3ea90 [0,2,0,0,0,0|2,0,0]=4 3473 B12R1.17 CCNC(C)c1cccc(c1)F 6a89435cbf3436c2764f23c876d831b5 [0,2,0,0,0,0|2,0,0]=4 3474 B12R1.17 CCN[C@@H](C)c1cccc(c1)Br 6882c062be643e6f1479c43382a1f97e [0,2,0,0,0,0|2,0,0]=4 3475 B12R1.17 CCN[C@@H](C)c1cccc(c1)C ad1678c586d84563b274dd5bcfd4c65b [0,2,0,0,0,0|2,0,0]=4 3476 B12R1.17 CCN[C@@H](C)c1cccc(c1)Cl 85c185ae290690f3266862442a2473d8 [0,2,0,0,0,0|2,0,0]=4 3477 B12R1.17 CCN[C@@H](C)c1cccc(c1)F 0dedb0b66bba28f84038e5ae70474542 [0,2,0,0,0,0|2,0,0]=4 3478 B12R1.17 CCN[C@@H](C)c1cccc(c1)I e0c90057fd046352ca9827408e1c3425 [0,2,0,0,0,0|2,0,0]=4 3479 B12R1.17 CCN[C@H](C)c1cccc(c1)Br 5c6dbc44b6f3f8ec6a8c3fa96245bb1d [0,2,0,0,0,0|2,0,0]=4 3480 B12R1.17 CCN[C@H](C)c1cccc(c1)C bb6f09b8be3dec841bef80f5325226bf [0,2,0,0,0,0|2,0,0]=4 3481 B12R1.17 CCN[C@H](C)c1cccc(c1)Cl 07473dd26a362400745fd7b6b88adc2a [0,2,0,0,0,0|2,0,0]=4 3482 B12R1.17 CCN[C@H](C)c1cccc(c1)F e235faf6f177090ebbe131406ad51bf5 [0,2,0,0,0,0|2,0,0]=4 3483 B12R1.17 CCOC(C)c1cccc(c1)Br 42ca494baf4aa0a38e9fb3366b773268 [0,2,0,0,0,0|2,0,0]=4 3484 B12R1.17 CCOC(C)c1cccc(c1)C 77489ca20b0c159fdffd29d1744d738a [0,2,0,0,0,0|2,0,0]=4 3485 B12R1.17 CCOC(C)c1cccc(c1)Cl d76065522f99861b8f31d7f88c32d628 [0,2,0,0,0,0|2,0,0]=4 3486 B12R1.17 CCOC(C)c1cccc(c1)F 724570a61f9c9797e61dce1db0386846 [0,2,0,0,0,0|2,0,0]=4 3487 B12R1.17 CCOC(C)c1cccc(c1)I d454d6b1d8844d9b454c0363645bbb70 [0,2,0,0,0,0|2,0,0]=4 3488 B12R1.17 CCO[C@@H](C)c1cccc(c1)Br a6bcaa4e35963ce1794b8e13e8f20ac9 [0,2,0,0,0,0|2,0,0]=4 3489 B12R1.17 CCO[C@@H](C)c1cccc(c1)C 33dd0e36ecc47e9d30382124af23bb72 [0,2,0,0,0,0|2,0,0]=4 3490 B12R1.17 CCO[C@@H](C)c1cccc(c1)Cl a0cb09592617352d4e52595d42a99fc5 [0,2,0,0,0,0|2,0,0]=4 3491 B12R1.17 CCO[C@@H](C)c1cccc(c1)F dc0d46b451aae28446975dff011877bb [0,2,0,0,0,0|2,0,0]=4 3492 B12R1.17 CCO[C@H](C)c1cccc(c1)Br b1e5cf473b6a64a7764f8f222a9041d3 [0,2,0,0,0,0|2,0,0]=4 3493 B12R1.17 CCO[C@H](C)c1cccc(c1)C f495253381fbba7e8b85f8c69e274296 [0,2,0,0,0,0|2,0,0]=4 3494 B12R1.17 CCO[C@H](C)c1cccc(c1)Cl 0ea8aa6694bd99a0876fd9dc9ea2a396 [0,2,0,0,0,0|2,0,0]=4 3495 B12R1.17 CCO[C@H](C)c1cccc(c1)F e6c9bbadd74036f7f872059480f0031e [0,2,0,0,0,0|2,0,0]=4 3496 B12R1.17 COCN(C)c1cc(ccn1)Br 04ebe4ecf90f6035e3d2880f82c7a2fc [0,2,0,0,0,0|2,0,0]=4 3497 B12R1.17 COCN(C)c1cc(ccn1)C d9f1cfa58b98aeb359f00fb9e00480f4 [0,2,0,0,0,0|2,0,0]=4 3498 B12R1.17 COCN(C)c1cc(ccn1)Cl 214b3f05cff11c38113457fda3ba8164 [0,2,0,0,0,0|2,0,0]=4 3499 B12R1.17 COCN(C)c1cc(ccn1)F 444217ccb8dce47764ca258ea1ceb43a [0,2,0,0,0,0|2,0,0]=4 3500 B12R1.17 COCN(C)c1cc(ccn1)I 7fdce2f1e2936cec5ec335f82b86aa21 [0,2,0,0,0,0|2,0,0]=4 3501 B12R1.17 COCN(C)c1cccc(c1)Br a0b6a01e8a8e903112d08a0ad1b791c6 [0,2,0,0,0,0|1,0,0]=3 3502 B12R1.17 COCN(C)c1cccc(c1)C 2630b7af0f24b4920d1bb44ad2a618b8 [0,2,0,0,0,0|1,0,0]=3 3503 B12R1.17 COCN(C)c1cccc(c1)Cl c412e0aedf878ea54434f0cf1a2ff9d0 [0,2,0,0,0,0|1,0,0]=3 3504 B12R1.17 COCN(C)c1cccc(c1)F 1625ecf140c7f5483d83bb16cd4a78c2 [0,2,0,0,0,0|1,0,0]=3 3505 B12R1.17 COCN(C)c1cccc(c1)I 783d0176762cb36e227b85f37b36850b [0,2,0,0,0,0|1,0,0]=3 3506 B12R1.17 COCN(C)c1cccc(n1)Br 278d12b263aa9d459278a243b1ea3e46 [0,2,0,0,0,0|2,0,0]=4 3507 B12R1.17 COCN(C)c1cccc(n1)C 2e91dba0e9a7c21bc23f9641d59194d2 [0,2,0,0,0,0|2,0,0]=4 3508 B12R1.17 COCN(C)c1cccc(n1)Cl af13fb8cb7e6a1914c00187d954deb8d [0,2,0,0,0,0|2,0,0]=4 3509 B12R1.17 COCN(C)c1cccc(n1)F e4cfa65c28f75fb7d507d37ed3be7987 [0,2,0,0,0,0|2,0,0]=4 3510 B12R1.17 COCN(C)c1ccnc(c1)Br c6eef8c9341f963111762ad68c233b73 [0,2,0,0,0,0|2,0,0]=4 3511 B12R1.17 COCN(C)c1ccnc(c1)Cl 7fc210a7cbbd4a5b50331d1424892086 [0,2,0,0,0,0|2,0,0]=4 3512 B12R1.17 COCN(C)c1ccnc(c1)F c5d1ff38fb26f67b9ff4438b83b18ae3 [0,2,0,0,0,0|2,0,0]=4 3513 B12R1.17 COCN(C)c1cncc(c1)Br 8476a83d9fff04603d45f8e47629ce09 [0,2,0,0,0,0|2,0,0]=4 3514 B12R1.17 COCN(C)c1cncc(c1)C 2c3e1b8b45ceae4976d2893256e39ee8 [0,2,0,0,0,0|2,0,0]=4 3515 B12R1.17 CSCN(C)c1cccc(c1)Br 795a330043d197d455a0dbb4dd1faaeb [0,2,0,0,0,0|1,1,0]=4 3516 B12R1.17 CSCN(C)c1cccc(c1)C 188b9968f6619e59b627ae3886714e8c [0,2,0,0,0,0|1,1,0]=4 3517 B12R1.17 CSCN(C)c1cccc(c1)Cl efd04b0516ef59374bbc13602c9800ea [0,2,0,0,0,0|1,1,0]=4 3518 B12R1.17 CSCN(C)c1cccc(c1)F e8614a48c46dd0af03a86d07738bdaa7 [0,2,0,0,0,0|1,1,0]=4 3519 B12R1.17 CSCN(C)c1cccc(c1)I 255d6996cb175d8309fe361d85d8aa1e [0,2,0,0,0,0|1,1,0]=4 3520 B12R1.30 C#CCCN(C)c1ccccc1 26c0497305b10abd73ca8cb441cc00c7 [0,2,0,0,0,0|1,0,1]=4 3521 B12R1.30 C#CCNC(C)c1ccccc1 8ed5828c2e258c30367c2a46a0344f1e [0,2,0,0,0,0|1,0,1]=4 3522 B12R1.30 C#CCN[C@@H](C)c1ccccc1 c2e57a43b39094fb9cc8c5d89eda2aec [0,2,0,0,0,0|1,0,1]=4 3523 B12R1.30 C#CCN[C@H](C)c1ccccc1 0027d86dcd1350148f8559798567d252 [0,2,0,0,0,0|1,0,1]=4 3524 B12R1.30 C#CCOC(C)c1ccccc1 29a457d91187748bd9fba937b2dce22a [0,2,0,0,0,0|1,0,1]=4 3525 B12R1.30 C#CCO[C@@H](C)c1ccccc1 a17750258d0bbb03a82d71c12a4ef66f [0,2,0,0,0,0|1,0,1]=4 3526 B12R1.30 C#CCO[C@H](C)c1ccccc1 daa23676a75f018b9eb1a615337c3d8a [0,2,0,0,0,0|1,0,1]=4 3527 B12R1.30 C/C=C/CN(C)c1ccccc1 6aca716f56cd50a3277e1a725da6237c [0,2,0,0,0,0|1,0,1]=4 3528 B12R1.30 C/C=C\CN(C)c1ccccc1 bf0cb6abe4ab1c9a8756fb864f282d12 [0,2,0,0,0,0|1,0,1]=4 3529 B12R1.30 C=C(COCC)c1ccccc1 e1174170fb735530ed2c07509ad0f64f [0,2,0,0,0,0|0,0,1]=3 3530 B12R1.30 C=C(COCC)c1ccccn1 f40de5671b29d2ee57d19787ac098e3c [0,2,0,0,0,0|1,0,1]=4 3531 B12R1.30 C=C(COCF)c1ccccc1 7f9b3146156f36d50e79417005ca927c [0,2,0,0,0,0|0,0,1]=3 3532 B12R1.30 C=C(COCF)c1ccccn1 a1e2e7eaefd33d18b03307c74614060f [0,2,0,0,0,0|1,0,1]=4 3533 B12R1.30 C=CCCN(C)c1ccccc1 a374f5bd2d62273d4657e1e6ebbd42ca [0,2,0,0,0,0|1,0,1]=4 3534 B12R1.30 C=CCNC(C)c1ccccc1 fa2a8c61f42c61d4674c5e223d49122c [0,2,0,0,0,0|1,0,1]=4 3535 B12R1.30 C=CCN[C@@H](C)c1ccccc1 600f83b5cdc08e60e339b69a1a0c1bbe [0,2,0,0,0,0|1,0,1]=4 3536 B12R1.30 C=CCN[C@H](C)c1ccccc1 d607bf8a84d857931725e26673643b18 [0,2,0,0,0,0|1,0,1]=4 3537 B12R1.30 C=CCOC(C)c1ccccc1 8044d3406b23fdabe4ad5833cf2a8d4b [0,2,0,0,0,0|1,0,1]=4 3538 B12R1.30 C=CCO[C@@H](C)c1ccccc1 a727c5edd06769bc0527d3d68934d138 [0,2,0,0,0,0|1,0,1]=4 3539 B12R1.30 C=CCO[C@H](C)c1ccccc1 ff3f82ad85551dde7fcd068107420df1 [0,2,0,0,0,0|1,0,1]=4 3540 B12R1.30 CC(CNC#N)c1ccccc1 d5f4eb607db5752f9711ebcab25281e7 [0,2,0,0,0,0|1,0,1]=4 3541 B12R1.30 CC(CNC=O)c1ccccc1 383885393da95737b5a43ceb7230b818 [0,2,0,0,0,0|1,0,1]=4 3542 B12R1.30 CC(CNCF)c1ccccc1 5f1d9fd84074424c65197fad8c2e5513 [0,2,0,0,0,0|1,0,0]=3 3543 B12R1.30 CC(CNCO)c1ccccc1 462ae9832b5de19cce882c0427ce8c7b [0,2,0,0,0,0|1,0,0]=3 3544 B12R1.30 CC(COCF)c1ccccc1 c129742ad0b3dcb07ba4c78eb9851e3b [0,2,0,0,0,0|0,0,0]=2 3545 B12R1.30 CC(COCF)c1ccccn1 cadf5699bf3656449a20b6c87901461e [0,2,0,0,0,0|1,0,0]=3 3546 B12R1.30 CC(NCC#N)c1ccccc1 85ca8869c6ae0debccfd66d74dfbe1ee [0,2,0,0,0,0|2,0,0]=4 3547 B12R1.30 CC(NCC=O)c1ccccc1 d9b90894b15660347d656ab520d55286 [0,2,0,0,0,0|2,0,0]=4 3548 B12R1.30 CC(NCCF)c1ccccc1 a4890edd7f21677f225a27bfc036a9e4 [0,2,0,0,0,0|2,0,0]=4 3549 B12R1.30 CC(NCCO)c1ccccc1 15ebe2893003a0c55ecacb3da2e2c5b8 [0,2,0,0,0,0|2,0,0]=4 3550 B12R1.30 CC(NCCS)c1ccccc1 c90c5f78811b5a3e744fa24aabe1d478 [0,2,0,0,0,0|2,0,0]=4 3551 B12R1.30 CC(OCC#N)c1ccccc1 1ec1dc9da1f2b2c8e841a4b7ee7f537f [0,2,0,0,0,0|2,0,0]=4 3552 B12R1.30 CC(OCC=O)c1ccccc1 5c4b88cbd6ba661cea0ad67f126d3e82 [0,2,0,0,0,0|2,0,0]=4 3553 B12R1.30 CC(OCCF)c1ccccc1 296004c8a3c297153de64ff701a708ab [0,2,0,0,0,0|2,0,0]=4 3554 B12R1.30 CC(OCCS)c1ccccc1 8a2d25daddbc7e25b5ea41349af0bdcf [0,2,0,0,0,0|2,0,0]=4 3555 B12R1.30 CCCCN(C)c1ccccc1 5138c426816999d109cc4a6b536acc57 [0,2,0,0,0,0|1,0,0]=3 3556 B12R1.30 CCCCN(C)c1ccccn1 28cd8015bdaf9aae9f5fc252e8d2111d [0,2,0,0,0,0|2,0,0]=4 3557 B12R1.30 CCCCN(C)c1cccnc1 088893a35ea97628d677bdb560c104b8 [0,2,0,0,0,0|2,0,0]=4 3558 B12R1.30 CCCCN(C)c1ccncc1 75414bf2a6ccb411945f0546844c595b [0,2,0,0,0,0|2,0,0]=4 3559 B12R1.30 CCCNC(=O)c1ccccc1 17d55bfe3f14492436164da3d0c80e57 [0,2,0,0,0,0|1,0,1]=4 3560 B12R1.30 CCCNC(C)c1ccccc1 37d48536a03c5d64ae70e596dd73ed85 [0,2,0,0,0,0|1,0,0]=3 3561 B12R1.30 CCCNC(C)c1ccccn1 cc14fd04410800b4bd6435a8ddd3bb22 [0,2,0,0,0,0|2,0,0]=4 3562 B12R1.30 CCCNC(C)c1cccnc1 ad711bb62eeb1aee43dc7dd8f93d36ef [0,2,0,0,0,0|2,0,0]=4 3563 B12R1.30 CCCNC(C)c1ccncc1 5bbf0ec17de63181b9f984c6ee459099 [0,2,0,0,0,0|2,0,0]=4 3564 B12R1.30 CCCN[C@@H](C)c1ccccc1 604408ade040f4a9c55069b166a57921 [0,2,0,0,0,0|1,0,0]=3 3565 B12R1.30 CCCN[C@@H](C)c1ccccn1 03c5378eb87bcbab461643e14036da7b [0,2,0,0,0,0|2,0,0]=4 3566 B12R1.30 CCCN[C@@H](C)c1cccnc1 ebfd88cd08246c9c4c8dd5665a36e4de [0,2,0,0,0,0|2,0,0]=4 3567 B12R1.30 CCCN[C@@H](C)c1ccncc1 247a85b98e9473b8ba80ebe1aa76666d [0,2,0,0,0,0|2,0,0]=4 3568 B12R1.30 CCCN[C@H](C)c1ccccc1 b93dc36e1ac43b4dfb18fc821dba383a [0,2,0,0,0,0|1,0,0]=3 3569 B12R1.30 CCCN[C@H](C)c1ccccn1 b254cf125be5ff667ba0c27b98f7399e [0,2,0,0,0,0|2,0,0]=4 3570 B12R1.30 CCCN[C@H](C)c1cccnc1 336ef7d0edfb76e914cc3e6724738449 [0,2,0,0,0,0|2,0,0]=4 3571 B12R1.30 CCCN[C@H](C)c1ccncc1 c38d0e044de489d76af7664dba013771 [0,2,0,0,0,0|2,0,0]=4 3572 B12R1.30 CCCOC(C)c1ccccc1 b3e8a20aaf9fee6fd90ba3c942d17cbb [0,2,0,0,0,0|1,0,0]=3 3573 B12R1.30 CCCOC(C)c1ccccn1 b39d3fe2e04295201526414ffb8b346f [0,2,0,0,0,0|2,0,0]=4 3574 B12R1.30 CCCOC(C)c1cccnc1 b4a5c4f0d8d2d6a3dec1c8ec47f4f20f [0,2,0,0,0,0|2,0,0]=4 3575 B12R1.30 CCCOC(C)c1ccncc1 23b85e46df5ec55325d031745f8d75b2 [0,2,0,0,0,0|2,0,0]=4 3576 B12R1.30 CCCO[C@@H](C)c1ccccc1 b5a89a5e2269c078fad9874c053ef84d [0,2,0,0,0,0|1,0,0]=3 3577 B12R1.30 CCCO[C@@H](C)c1ccccn1 180a656c513628a596211eb51193e51c [0,2,0,0,0,0|2,0,0]=4 3578 B12R1.30 CCCO[C@@H](C)c1cccnc1 a6442581c5df29535d93cb8f5fa5694f [0,2,0,0,0,0|2,0,0]=4 3579 B12R1.30 CCCO[C@@H](C)c1ccncc1 f346339788fa1f3b54ec1b08208e6598 [0,2,0,0,0,0|2,0,0]=4 3580 B12R1.30 CCCO[C@H](C)c1ccccc1 ae53c06444379dfac4167ac84138cfb9 [0,2,0,0,0,0|1,0,0]=3 3581 B12R1.30 CCCO[C@H](C)c1ccccn1 59ae42f1d2cbb8cb8fe36530c47f41d1 [0,2,0,0,0,0|2,0,0]=4 3582 B12R1.30 CCCO[C@H](C)c1cccnc1 fec7058011aa3e2c96cfd1d3b525aa6e [0,2,0,0,0,0|2,0,0]=4 3583 B12R1.30 CCCO[C@H](C)c1ccncc1 cb8ccc8bc89fedd96f0e6231288da52e [0,2,0,0,0,0|2,0,0]=4 3584 B12R1.30 CCNCC(=O)c1ccccc1 120782ba76f814e86bdef32896186f08 [0,2,0,0,0,0|1,0,1]=4 3585 B12R1.30 CCNCC(C)c1ccccc1 9cbf919020878038d0809e43f1be15bb [0,2,0,0,0,0|1,0,0]=3 3586 B12R1.30 CCNCC(O)c1ccccc1 2c7684bc90e6b6f2eb9cc788b34e49e9 [0,2,0,0,0,0|1,0,0]=3 3587 B12R1.30 CCNCC(O)c1ccccn1 6b1c434bb8a1b8b261ec43b19c8a9bde [0,2,0,0,0,0|2,0,0]=4 3588 B12R1.30 CCNCC(O)c1cccnc1 855e09cd2dd0a891326c5d3074b7ce5d [0,2,0,0,0,0|2,0,0]=4 3589 B12R1.30 CCNCC(O)c1ccncc1 3f7210030fe9a0f2bae5b80e88f85abe [0,2,0,0,0,0|2,0,0]=4 3590 B12R1.30 CCNC[C@@H](C)c1ccccc1 6865a599cc7f5b285bd8c007b28c9b34 [0,2,0,0,0,0|1,0,0]=3 3591 B12R1.30 CCNC[C@@H](O)c1ccccc1 1fa8d71540df38b9b8cbd54368ff1949 [0,2,0,0,0,0|1,0,0]=3 3592 B12R1.30 CCNC[C@H](C)c1ccccc1 ff4ae3e1c0acb37fe8ab1f33c54ee87a [0,2,0,0,0,0|1,0,0]=3 3593 B12R1.30 CCNC[C@H](O)c1ccccc1 a3ad7a2afde7d6051248f34aaf7ade1e [0,2,0,0,0,0|1,0,0]=3 3594 B12R1.30 CCOCC(=O)c1ccccc1 d10a1656db1ce15c4b0e7531fc2ce741 [0,2,0,0,0,0|0,0,1]=3 3595 B12R1.30 CCOCC(=O)c1ccccn1 dca3a90de36d6da1383fefa302a94393 [0,2,0,0,0,0|1,0,1]=4 3596 B12R1.30 CCOCC(=O)c1cccnc1 aef6d38b572782e69bfe5e03089f6e74 [0,2,0,0,0,0|1,0,1]=4 3597 B12R1.30 CCOCC(C)c1ccccc1 7d0863132e6f64e2e8f3b829c1ba4213 [0,2,0,0,0,0|0,0,0]=2 3598 B12R1.30 CCOCC(C)c1ccccn1 2d50cc0927617393348c2ce87012ad45 [0,2,0,0,0,0|1,0,0]=3 3599 B12R1.30 CCOCN(C)c1ccccn1 8340951be42ff358eb4cbbdc08f4ab4f [0,2,0,0,0,0|2,0,0]=4 3600 B12R1.30 CCOCN(C)c1cccnc1 a5ca197575fc4d53980fc1191aefb32b [0,2,0,0,0,0|2,0,0]=4 3601 B12R1.30 CCOC[C@@H](C)c1ccccc1 5d4adf02715a7dc88fd8e9ed1c1ccac0 [0,2,0,0,0,0|0,0,0]=2 3602 B12R1.30 CCOC[C@H](C)c1ccccc1 71da89b37784dc3a33c9c6970d6f6435 [0,2,0,0,0,0|0,0,0]=2 3603 B12R1.30 CN(CCC#N)c1ccccc1 23b443fbe6fd49c306bece79b166b6d1 [0,2,0,0,0,0|2,0,0]=4 3604 B12R1.30 CN(CCC=O)c1ccccc1 9715602a2b8ce4ca6f6ceb5c71eca01f [0,2,0,0,0,0|2,0,0]=4 3605 B12R1.30 CN(CCCF)c1ccccc1 721389a2fe3a1bc3a7ab8adcc61dc5ff [0,2,0,0,0,0|2,0,0]=4 3606 B12R1.30 CN(CCCO)c1ccccc1 99b9f18cd67ae7ad12fedc7e34599859 [0,2,0,0,0,0|2,0,0]=4 3607 B12R1.30 CN(CCON)c1ccccc1 94cf645c4c77140e45852773a65b7658 [0,2,0,0,0,0|1,0,0]=3 3608 B12R1.30 CN(CCON)c1ccccn1 4ad2f65b6bf22319240009e381b63f09 [0,2,0,0,0,0|2,0,0]=4 3609 B12R1.30 CN(CCON)c1cccnc1 1082a358885b552922d4f121324f5d81 [0,2,0,0,0,0|2,0,0]=4 3610 B12R1.30 COCCN(C)c1ccccc1 f88ab3abd109b8d6e952f5ff5bda6892 [0,2,0,0,0,0|0,0,0]=2 3611 B12R1.30 COCCN(C)c1ccccn1 376e5b72ea9a7dbdd5aeb5f5bc5cf452 [0,2,0,0,0,0|1,0,0]=3 3612 B12R1.30 COCCN(C)c1cccnc1 4f9df4b065d1c9e4a8e6fa505ba3f2dd [0,2,0,0,0,0|1,0,0]=3 3613 B12R1.30 COCCN(C)c1cccnn1 936beb091401ab8dd25dcb2b91b6bc6a [0,2,0,0,0,0|2,0,0]=4 3614 B12R1.30 COCCN(C)c1ccncc1 8402b9e1bce48d226db34206d45462c3 [0,2,0,0,0,0|1,0,0]=3 3615 B12R1.30 COCCN(C)c1ccncn1 480e6f1619029fc08e1141863e98f792 [0,2,0,0,0,0|2,0,0]=4 3616 B12R1.30 COCCN(C)c1ccnnc1 aa09d9449651d2aafe42a6d958522a3d [0,2,0,0,0,0|2,0,0]=4 3617 B12R1.30 COCCN(C)c1cnccn1 d842e1e462c76605dbc52f08501ed99c [0,2,0,0,0,0|2,0,0]=4 3618 B12R1.30 COCCN(C)c1cncnc1 c7a6002b00e3f6cd0d7f6a45b33f9987 [0,2,0,0,0,0|2,0,0]=4 3619 B12R1.30 COCCN(C)c1ncccn1 6b4cf3c01ecd7492b1166cf813593ffb [0,2,0,0,0,0|2,0,0]=4 3620 B12R1.30 COCNC(C)c1ccccc1 da3a97833b329d52bf380d21525de137 [0,2,0,0,0,0|0,0,0]=2 3621 B12R1.30 COCNC(C)c1ccccn1 22800b3ec5673e703cef9baf9917e3d2 [0,2,0,0,0,0|1,0,0]=3 3622 B12R1.30 COCNC(C)c1cccnc1 3b8f3215bb671696fda56e94e8674604 [0,2,0,0,0,0|1,0,0]=3 3623 B12R1.30 COCNC(C)c1cccnn1 cf1e0f025ae1123ccfd253eda86c8b19 [0,2,0,0,0,0|2,0,0]=4 3624 B12R1.30 COCNC(C)c1ccncc1 557d89b6b89aa64ab92cee16216fefd4 [0,2,0,0,0,0|1,0,0]=3 3625 B12R1.30 COCNC(C)c1ccncn1 35622b06ce15fedb4e01839c51c495ae [0,2,0,0,0,0|2,0,0]=4 3626 B12R1.30 COCNC(C)c1ccnnc1 a0653a3f05e57ae0c3f2670713394058 [0,2,0,0,0,0|2,0,0]=4 3627 B12R1.30 COCNC(C)c1cnccn1 44f734383c1cb52ec567bd57782cbe4a [0,2,0,0,0,0|2,0,0]=4 3628 B12R1.30 COCNC(C)c1cncnc1 6d075a2e78ce5083d38fc36493f9c285 [0,2,0,0,0,0|2,0,0]=4 3629 B12R1.30 COCNC(C)c1ncccn1 bf3b7d2d23f9f00fcaaf50b0a692dab9 [0,2,0,0,0,0|2,0,0]=4 3630 B12R1.30 COCN[C@@H](C)c1ccccc1 b0afc671726e2aa3bbf25811f588d87b [0,2,0,0,0,0|0,0,0]=2 3631 B12R1.30 COCN[C@@H](C)c1ccccn1 4145c37cf98927207d4b903c5b8dd837 [0,2,0,0,0,0|1,0,0]=3 3632 B12R1.30 COCN[C@@H](C)c1cccnc1 00ed3ee3fdd3eacbaf23a145cc56829b [0,2,0,0,0,0|1,0,0]=3 3633 B12R1.30 COCN[C@@H](C)c1ccncc1 e5771889fddafddb835b8e40a4924887 [0,2,0,0,0,0|1,0,0]=3 3634 B12R1.30 COCN[C@@H](C)c1cncnc1 a03d8f3a183baf2f9c4b921bdcfbfd49 [0,2,0,0,0,0|2,0,0]=4 3635 B12R1.30 COCN[C@H](C)c1ccccc1 9e08f5d5391d04ef9dca8846d7c418b1 [0,2,0,0,0,0|0,0,0]=2 3636 B12R1.30 COCN[C@H](C)c1ccccn1 2342d53c6195e8ed5385640c40678800 [0,2,0,0,0,0|1,0,0]=3 3637 B12R1.30 COCN[C@H](C)c1cccnc1 221f90621b3face8d5ddf0399a64c75b [0,2,0,0,0,0|1,0,0]=3 3638 B12R1.30 COCN[C@H](C)c1ccncc1 e601f1926d8106e5694f3b267e229bd9 [0,2,0,0,0,0|1,0,0]=3 3639 B12R1.30 COCN[C@H](C)c1cncnc1 b809637cdff44e5858651f9223683843 [0,2,0,0,0,0|2,0,0]=4 3640 B12R1.30 COCOC(C)c1ccccc1 0b1f9c9cdb2cc63a37919c47ba14afe7 [0,2,0,0,0,0|0,0,0]=2 3641 B12R1.30 COCOC(C)c1ccccn1 96e3f8673063db846b1328064926b8e5 [0,2,0,0,0,0|1,0,0]=3 3642 B12R1.30 COCOC(C)c1cccnc1 643684e61fedf53617fedae92fa75424 [0,2,0,0,0,0|1,0,0]=3 3643 B12R1.30 COCOC(C)c1cccnn1 89333483d765b95bcfbc5e106c5827d1 [0,2,0,0,0,0|2,0,0]=4 3644 B12R1.30 COCOC(C)c1ccncc1 e713cf3a963edba7c0b8cf8e46dda145 [0,2,0,0,0,0|1,0,0]=3 3645 B12R1.30 COCOC(C)c1cnccn1 47d60ede0006ef61790aec4973a16141 [0,2,0,0,0,0|2,0,0]=4 3646 B12R1.30 COCOC(C)c1ncccn1 32791ad8683b8f75865b5523726823c9 [0,2,0,0,0,0|2,0,0]=4 3647 B12R1.30 COCO[C@@H](C)c1ccccc1 4f223b91f36fa3bfe971e90568b0e3b0 [0,2,0,0,0,0|0,0,0]=2 3648 B12R1.30 COCO[C@@H](C)c1ccccn1 2377670b88698f2edbc70d4e18de68ac [0,2,0,0,0,0|1,0,0]=3 3649 B12R1.30 COCO[C@@H](C)c1cccnc1 17fd6c5b51edf6fabed3ef2792222607 [0,2,0,0,0,0|1,0,0]=3 3650 B12R1.30 COCO[C@@H](C)c1ccncc1 1238319c035b42c93f1000c64c766fa2 [0,2,0,0,0,0|1,0,0]=3 3651 B12R1.30 COCO[C@@H](C)c1ccncn1 f9a9c5e84a35074d721101d05d41bdfc [0,2,0,0,0,0|2,0,0]=4 3652 B12R1.30 COCO[C@@H](C)c1cnccn1 d5e8aec4add367d6f8e96a15fb75e361 [0,2,0,0,0,0|2,0,0]=4 3653 B12R1.30 COCO[C@@H](C)c1ncccn1 50c1ecb7bb0fca8a53007fb6c43357ce [0,2,0,0,0,0|2,0,0]=4 3654 B12R1.30 COCO[C@H](C)c1ccccc1 ba83963d37e25f49896a3a9bad50ab4f [0,2,0,0,0,0|0,0,0]=2 3655 B12R1.30 COCO[C@H](C)c1ccccn1 458a21f21c67e992b19f7c56288b02ea [0,2,0,0,0,0|1,0,0]=3 3656 B12R1.30 COCO[C@H](C)c1cccnc1 34e6426da9f6f855e9b1fb3a0535c51c [0,2,0,0,0,0|1,0,0]=3 3657 B12R1.30 COCO[C@H](C)c1cccnn1 3240b94cd89f6c142441eafe5286d587 [0,2,0,0,0,0|2,0,0]=4 3658 B12R1.30 COCO[C@H](C)c1ccncc1 c5dbb60f43a9a1932fd8194dbc2609ff [0,2,0,0,0,0|1,0,0]=3 3659 B12R1.30 COCO[C@H](C)c1cnccn1 aefda3de9ef6b4cf2de0abaf33ce3914 [0,2,0,0,0,0|2,0,0]=4 3660 B12R1.30 COCO[C@H](C)c1ncccn1 4feb3ad7c352f77a2adec633800331a0 [0,2,0,0,0,0|2,0,0]=4 3661 B12R1.30 CSCCN(C)c1ccccc1 e519282dbdf6c8d213fc611d45219205 [0,2,0,0,0,0|0,1,0]=3 3662 B12R1.30 CSCCN(C)c1ccccn1 f4859c90f775cbf4c83f0a7f2a89568d [0,2,0,0,0,0|1,1,0]=4 3663 B12R1.30 CSCCN(C)c1cccnc1 cd9e9f9b668cb7bbad34bd6ab3219b63 [0,2,0,0,0,0|1,1,0]=4 3664 B12R1.30 CSCCN(C)c1ccncc1 d5fd66858d1115cc9e2971b79e55744b [0,2,0,0,0,0|1,1,0]=4 3665 B12R1.30 CSCNC(C)c1ccccc1 6f92386efe5ddba474bf8f6e5b5463ff [0,2,0,0,0,0|0,1,0]=3 3666 B12R1.30 CSCNC(C)c1ccccn1 ddb2d3f894b38cfc3c20828a85d8aeba [0,2,0,0,0,0|1,1,0]=4 3667 B12R1.30 CSCNC(C)c1cccnc1 2e0743aa860df3163cd3f12a82516611 [0,2,0,0,0,0|1,1,0]=4 3668 B12R1.30 CSCNC(C)c1ccncc1 bfc882e0574003d357950d811bfc98b0 [0,2,0,0,0,0|1,1,0]=4 3669 B12R1.30 CSCN[C@@H](C)c1ccccc1 845e66030d932d6618c275454e4a088a [0,2,0,0,0,0|0,1,0]=3 3670 B12R1.30 CSCN[C@@H](C)c1ccccn1 4dfba9ca9a55cc8822f57f2605ede0af [0,2,0,0,0,0|1,1,0]=4 3671 B12R1.30 CSCN[C@@H](C)c1cccnc1 729bc01cb93be8b0ea771ba31754f9b1 [0,2,0,0,0,0|1,1,0]=4 3672 B12R1.30 CSCN[C@@H](C)c1ccncc1 3bcd404ccd396fcd1d4069a1e2a00eaf [0,2,0,0,0,0|1,1,0]=4 3673 B12R1.30 CSCN[C@H](C)c1ccccc1 30f91454a02398d41f15145ae4807b21 [0,2,0,0,0,0|0,1,0]=3 3674 B12R1.30 CSCN[C@H](C)c1ccccn1 b34c76b9aa83c7d60db5d09418063e93 [0,2,0,0,0,0|1,1,0]=4 3675 B12R1.30 CSCN[C@H](C)c1cccnc1 b29cfc0205d006d4bc36dce8931937fb [0,2,0,0,0,0|1,1,0]=4 3676 B12R1.30 CSCN[C@H](C)c1ccncc1 9076c4b90e14f3ba1dffc47b940741d0 [0,2,0,0,0,0|1,1,0]=4 3677 B12R1.30 CSCOC(C)c1ccccc1 641ae777302bb1952ab6a4af8532f275 [0,2,0,0,0,0|0,1,0]=3 3678 B12R1.30 CSCOC(C)c1ccccn1 3962a04da2204a1cf7830ac87133888a [0,2,0,0,0,0|1,1,0]=4 3679 B12R1.30 CSCOC(C)c1cccnc1 506088ce45beb9c36ff46608da654d32 [0,2,0,0,0,0|1,1,0]=4 3680 B12R1.30 CSCOC(C)c1ccncc1 7ce593b87d9d6445cabbd9c7e4a9cecc [0,2,0,0,0,0|1,1,0]=4 3681 B12R1.30 CSCO[C@@H](C)c1ccccc1 4fac534708704f5d5e3429eb46cba8d5 [0,2,0,0,0,0|0,1,0]=3 3682 B12R1.30 CSCO[C@@H](C)c1ccccn1 e9e6ffeb6ad8c32ddf7c2cb22d9b25ee [0,2,0,0,0,0|1,1,0]=4 3683 B12R1.30 CSCO[C@@H](C)c1cccnc1 6799e68b88695adbe9845652e8cf13f8 [0,2,0,0,0,0|1,1,0]=4 3684 B12R1.30 CSCO[C@@H](C)c1ccncc1 3e71fd0162eefef395d929c84a37af2d [0,2,0,0,0,0|1,1,0]=4 3685 B12R1.30 CSCO[C@H](C)c1ccccc1 6e65c7d8640db47c99545e1f59d710dc [0,2,0,0,0,0|0,1,0]=3 3686 B12R1.30 CSCO[C@H](C)c1ccccn1 0ecacf74edbb4be90693870fe439bf49 [0,2,0,0,0,0|1,1,0]=4 3687 B12R1.30 CSCO[C@H](C)c1cccnc1 730885ff2e1d3d49743ef910d1431b30 [0,2,0,0,0,0|1,1,0]=4 3688 B12R1.30 CSCO[C@H](C)c1ccncc1 ffb348d899af6643c368889d3ed9e037 [0,2,0,0,0,0|1,1,0]=4 3689 B12R1.30 C[C@@H](CNC=O)c1ccccc1 4fd65e091e214d9221c262810e411c80 [0,2,0,0,0,0|1,0,1]=4 3690 B12R1.30 C[C@@H](CNCF)c1ccccc1 796d7cc72a99b25de3cd91eec937f176 [0,2,0,0,0,0|1,0,0]=3 3691 B12R1.30 C[C@@H](CNCO)c1ccccc1 742ee8e739f2ff7dbfa020bf6612568d [0,2,0,0,0,0|1,0,0]=3 3692 B12R1.30 C[C@@H](COCF)c1ccccc1 3ef1be7494a491550febb3ea126e0341 [0,2,0,0,0,0|0,0,0]=2 3693 B12R1.30 C[C@@H](NCC#N)c1ccccc1 79a0e920b4d897eb15d12e8b6b71cbe9 [0,2,0,0,0,0|2,0,0]=4 3694 B12R1.30 C[C@@H](NCC=O)c1ccccc1 de3c0d8a847d9265ee59861806469e38 [0,2,0,0,0,0|2,0,0]=4 3695 B12R1.30 C[C@@H](NCCF)c1ccccc1 6855a77d5eca1f1b4bab257a19ad71b3 [0,2,0,0,0,0|2,0,0]=4 3696 B12R1.30 C[C@@H](NCCO)c1ccccc1 4d75c0848045c856d6629664b5c37bb2 [0,2,0,0,0,0|2,0,0]=4 3697 B12R1.30 C[C@@H](NCCS)c1ccccc1 f68ec1897d41d2f78889d11e1a576659 [0,2,0,0,0,0|2,0,0]=4 3698 B12R1.30 C[C@@H](OCC#N)c1ccccc1 b7bf8cbcee7c14c575bc4d4a84868d53 [0,2,0,0,0,0|2,0,0]=4 3699 B12R1.30 C[C@@H](OCC=O)c1ccccc1 2ac21f5d0549ec288424cc0d2265d67c [0,2,0,0,0,0|2,0,0]=4 3700 B12R1.30 C[C@@H](OCCF)c1ccccc1 203a44e775c1adfe6a43ad6321e3d4aa [0,2,0,0,0,0|2,0,0]=4 3701 B12R1.30 C[C@@H](OCCS)c1ccccc1 831161e77b199edd57098275b43b0190 [0,2,0,0,0,0|2,0,0]=4 3702 B12R1.30 C[C@H](CNC#N)c1ccccc1 82cbedd68be846042bfc1a0fd0ff5ef2 [0,2,0,0,0,0|1,0,1]=4 3703 B12R1.30 C[C@H](CNC=O)c1ccccc1 d012ad42959d735a95ee99ba7191a36d [0,2,0,0,0,0|1,0,1]=4 3704 B12R1.30 C[C@H](CNCF)c1ccccc1 b55b7c71b6efb4d2ef804c8c8ecd1876 [0,2,0,0,0,0|1,0,0]=3 3705 B12R1.30 C[C@H](CNCO)c1ccccc1 348e8a14ee3f664d50cb7fb06a3ca693 [0,2,0,0,0,0|1,0,0]=3 3706 B12R1.30 C[C@H](COCF)c1ccccc1 dfac0c7125baf2c94bf4011a8539eabb [0,2,0,0,0,0|0,0,0]=2 3707 B12R1.30 C[C@H](NCC#N)c1ccccc1 04ab453e311f4e57bddb16b9d73b093d [0,2,0,0,0,0|2,0,0]=4 3708 B12R1.30 C[C@H](NCC=O)c1ccccc1 a3dc214a4fba86b355b0ede6b011be4e [0,2,0,0,0,0|2,0,0]=4 3709 B12R1.30 C[C@H](NCCF)c1ccccc1 da1d01952688d248cad72e73d81548b6 [0,2,0,0,0,0|2,0,0]=4 3710 B12R1.30 C[C@H](NCCO)c1ccccc1 1afbfcd53073af538ea2805bff509aa6 [0,2,0,0,0,0|2,0,0]=4 3711 B12R1.30 C[C@H](NCCS)c1ccccc1 8f0e850ed93fd86c5c98f711b3615cfc [0,2,0,0,0,0|2,0,0]=4 3712 B12R1.30 C[C@H](OCC#N)c1ccccc1 dec9f32ff56faa2d18e3e3c1709f800a [0,2,0,0,0,0|2,0,0]=4 3713 B12R1.30 C[C@H](OCC=O)c1ccccc1 00d569f48b2d6afec7a482be4dffe552 [0,2,0,0,0,0|2,0,0]=4 3714 B12R1.30 C[C@H](OCCF)c1ccccc1 c0748435be7f607898a504b3471e7402 [0,2,0,0,0,0|2,0,0]=4 3715 B12R1.30 C[C@H](OCCS)c1ccccc1 37922141bea6d1cffd84b12460e94096 [0,2,0,0,0,0|2,0,0]=4 3716 B12R1.30 N#CNCC(O)c1ccccc1 9720d365060a0fcf7ba83a373e380727 [0,2,0,0,0,0|1,0,1]=4 3717 B12R1.30 O=C(CNCF)c1ccccc1 b008ddf68ca6c6ff7ea37d0a87275ccd [0,2,0,0,0,0|1,0,1]=4 3718 B12R1.30 O=C(CNCO)c1ccccc1 1f6ea0716cbea011ade59a66de8cfc95 [0,2,0,0,0,0|1,0,1]=4 3719 B12R1.30 O=C(COCF)c1ccccc1 1a03c575b01170f76330974774069cf7 [0,2,0,0,0,0|0,0,1]=3 3720 B12R1.30 O=C(COCF)c1ccccn1 d721e2a9100a69c5669bc1ea4a691a11 [0,2,0,0,0,0|1,0,1]=4 3721 B12R1.30 O=C(COCF)c1cccnc1 9a8e93ae6bef36d6135782ae10319c45 [0,2,0,0,0,0|1,0,1]=4 3722 B12R1.30 O=CNCC(O)c1ccccc1 bd6972d51445a44c3965cbebc4bd5db7 [0,2,0,0,0,0|1,0,1]=4 3723 B12R1.30 O=CNC[C@@H](O)c1ccccc1 d65458916acffc3e27ffc1f7d36d329e [0,2,0,0,0,0|1,0,1]=4 3724 B12R1.30 O=CNC[C@H](O)c1ccccc1 f93baa496dc07ecacf88304e0a316c36 [0,2,0,0,0,0|1,0,1]=4 3725 B12R1.30 OC(CNCF)c1ccccc1 dadff12dfa7b072497d1230db84a7ab0 [0,2,0,0,0,0|1,0,0]=3 3726 B12R1.30 OC(CNCF)c1ccccn1 28b23d2b21264b95b0a73626d3ab73c9 [0,2,0,0,0,0|2,0,0]=4 3727 B12R1.30 OC(CNCF)c1cccnc1 cf35ee8aac22551332adc042d29300c0 [0,2,0,0,0,0|2,0,0]=4 3728 B12R1.30 OC(CNCF)c1ccncc1 0e2adfe79ee4a1ae9e152358d2961a9a [0,2,0,0,0,0|2,0,0]=4 3729 B12R1.30 OCNCC(O)c1ccccc1 a1873e0f542e845030155bc61f7ab033 [0,2,0,0,0,0|1,0,0]=3 3730 B12R1.30 OCNCC(O)c1ccccn1 ec2dcb570a75423958acfe8c8ceb5bda [0,2,0,0,0,0|2,0,0]=4 3731 B12R1.30 OCNCC(O)c1cccnc1 706b32d1f3a3c7b4480e7c94bfb1ff54 [0,2,0,0,0,0|2,0,0]=4 3732 B12R1.30 OCNCC(O)c1ccncc1 1f895db4e7084cce9c369909872cb36b [0,2,0,0,0,0|2,0,0]=4 3733 B12R1.30 OCNC[C@@H](O)c1ccccc1 6b625a35862ee45205a70adf222a9a23 [0,2,0,0,0,0|1,0,0]=3 3734 B12R1.30 OCNC[C@H](O)c1ccccc1 a19c64470da13d711a93a5da873610b8 [0,2,0,0,0,0|1,0,0]=3 3735 B12R1.30 O[C@@H](CNCF)c1ccccc1 17594babf953eee0d2b4c962daa025ce [0,2,0,0,0,0|1,0,0]=3 3736 B12R1.30 O[C@H](CNCF)c1ccccc1 1fae90a4e809b4254f08900139a841ce [0,2,0,0,0,0|1,0,0]=3 3737 B12R1.39 CCNC(C)(C)c1ccccc1 2e6683f6142d34cb9ce8cfe15a82fe01 [0,2,0,0,0,0|2,0,0]=4 3738 B12R1.39 CCOC(C)(C)c1ccccc1 5bcc79794e808b87e35ba44c1bb3e6b7 [0,2,0,0,0,0|2,0,0]=4 3739 B12R1.107 C=C(C)CN(C)c1ccccc1 892f6b3ce1ea7a9b6cd32d9e819b4a96 [0,2,0,0,0,0|2,0,0]=4 3740 B12R1.107 CC(=O)NC(C)c1ccccc1 5ac270090224b04d6e18bd0f40247bab [0,2,0,0,0,0|2,0,0]=4 3741 B12R1.107 CC(=O)N[C@@H](C)c1ccccc1 83a412c49d00ac7737895652e0438906 [0,2,0,0,0,0|2,0,0]=4 3742 B12R1.107 CC(=O)N[C@H](C)c1ccccc1 6af9f7af8ede42291806b12f353a29c9 [0,2,0,0,0,0|2,0,0]=4 3743 B12R1.107 CC(C)CN(C)c1ccccc1 95fef0ba310b862ee7742e989aa00371 [0,2,0,0,0,0|2,0,0]=4 3744 B12R1.107 CC(C)OC(C)c1ccccc1 c88937e1bba3e11ca71331a692d3263d [0,2,0,0,0,0|2,0,0]=4 3745 B12R1.107 CC(C)O[C@@H](C)c1ccccc1 cd312c9ad337f3d7e7cf959a697dd297 [0,2,0,0,0,0|2,0,0]=4 3746 B12R1.107 CC(C)O[C@H](C)c1ccccc1 b2ce62b73f9b987a3fea9afe8162e394 [0,2,0,0,0,0|2,0,0]=4 3747 B12R1.107 CC(O)CN(C)c1ccccc1 f96f86be852a8f681918c1e7f925b14c [0,2,0,0,0,0|2,0,0]=4 3748 B12R1.107 C[C@H](O)CN(C)c1ccccc1 623c379093f4d5c87dbfc7a6a5452bce [0,2,0,0,0,0|2,0,0]=4 3749 B12R1.308 CCCN(C)c1ccccc1C 73001c2aed106e7b28af99b1d028c245 [0,2,0,0,0,0|2,0,0]=4 3750 B12R1.308 CCCN(C)c1ccccc1F c8eaad67375959ac89e6c1bbf087169d [0,2,0,0,0,0|2,0,0]=4 3751 B12R1.308 CCNC(C)c1ccccc1C 0883f4cb3ceebac2afc1d8b1d74757fe [0,2,0,0,0,0|2,0,0]=4 3752 B12R1.308 CCNC(C)c1ccccc1Cl e4c014f93d31b2cbe46d458b32f53e09 [0,2,0,0,0,0|2,0,0]=4 3753 B12R1.308 CCNC(C)c1ccccc1F f7d95a3361fedbbb65f99a2acb41e413 [0,2,0,0,0,0|2,0,0]=4 3754 B12R1.308 CCNC(C)c1ccccc1I 644333e054a6c1bf2e43ef800eb6ccf0 [0,2,0,0,0,0|2,0,0]=4 3755 B12R1.308 CCN[C@@H](C)c1ccccc1C 8d3fac06d9fd721c033cdce6debd1b11 [0,2,0,0,0,0|2,0,0]=4 3756 B12R1.308 CCN[C@@H](C)c1ccccc1Cl 099142b233a887b54f0becdabd5e841f [0,2,0,0,0,0|2,0,0]=4 3757 B12R1.308 CCN[C@@H](C)c1ccccc1F d09734bb90b2604a0ef3d53cf89c9061 [0,2,0,0,0,0|2,0,0]=4 3758 B12R1.308 CCN[C@H](C)c1ccccc1C 932b5a6a4e53b1370f118a04ec8aea7a [0,2,0,0,0,0|2,0,0]=4 3759 B12R1.308 CCN[C@H](C)c1ccccc1Cl 638f0775df6296d8f14ee24c8a8e2394 [0,2,0,0,0,0|2,0,0]=4 3760 B12R1.308 CCN[C@H](C)c1ccccc1F 769010e7a9b6e656b36dc7b095841e4f [0,2,0,0,0,0|2,0,0]=4 3761 B12R1.308 CCOC(C)c1ccccc1Cl 41900255e15d067e87f6ea562416138f [0,2,0,0,0,0|2,0,0]=4 3762 B12R1.308 CCO[C@@H](C)c1ccccc1Cl 0d253b912a6e6c7137bdc641619c139f [0,2,0,0,0,0|2,0,0]=4 3763 B12R1.308 CCO[C@H](C)c1ccccc1Cl fec58acae71ef20f9f3b3ae583319a6c [0,2,0,0,0,0|2,0,0]=4 3764 B12R1.308 COCN(C)c1ccccc1C f224c9bb5fe23115c7fa370ea3f6470e [0,2,0,0,0,0|1,0,0]=3 3765 B12R1.308 COCN(C)c1ccccc1Cl 1f54d711984a58c2f3926dd45ded75fe [0,2,0,0,0,0|1,0,0]=3 3766 B12R1.308 COCN(C)c1ccccc1F 285cb5429ee8876835de9666442ca7e8 [0,2,0,0,0,0|1,0,0]=3 3767 B12R1.308 COCN(C)c1cccnc1Br 98dca011fc532b04a9cedaec53174393 [0,2,0,0,0,0|2,0,0]=4 3768 B12R1.308 COCN(C)c1cccnc1C f65cab89a1b4f4118a6779a3ca806022 [0,2,0,0,0,0|2,0,0]=4 3769 B12R1.308 COCN(C)c1cccnc1Cl a2aad3c28f1a44d091a3e112aef5db9c [0,2,0,0,0,0|2,0,0]=4 3770 B12R1.308 COCN(C)c1cccnc1F e8ac6a6439b4b36f9f013d2d9e65282d [0,2,0,0,0,0|2,0,0]=4 3771 B12R1.308 COCN(C)c1ccncc1Br 06555417fa6367f84c8a47a67737510c [0,2,0,0,0,0|2,0,0]=4 3772 B12R1.308 COCN(C)c1ccncc1Cl ff587fbb8d73a1518019e58346c3f439 [0,2,0,0,0,0|2,0,0]=4 3773 B12R1.308 COCN(C)c1ccncc1I 4c21d35f0ba25d0ac31708dfbcb1a8cb [0,2,0,0,0,0|2,0,0]=4 3774 B12R1.308 COCN(C)c1cnccc1C cd03a99708ecc966d30230e940744351 [0,2,0,0,0,0|2,0,0]=4 3775 B12R1.308 COCN(C)c1cnccc1Cl 97fa3eb83c8048424b38248561f9205c [0,2,0,0,0,0|2,0,0]=4 3776 B12R1.308 COCN(C)c1cnccc1F 14305ceedf62c5ef5ce1df725642f098 [0,2,0,0,0,0|2,0,0]=4 3777 B12R1.308 COCN(C)c1ncccc1Br 0c9670543693c9c4477c3be0aab4ff15 [0,2,0,0,0,0|2,0,0]=4 3778 B12R1.308 COCN(C)c1ncccc1C ba78e262729d74789fd2682fd3afcbe3 [0,2,0,0,0,0|2,0,0]=4 3779 B12R1.308 COCN(C)c1ncccc1Cl 6c5ed45152cdde466a215d8e9969fd09 [0,2,0,0,0,0|2,0,0]=4 3780 B12R1.308 COCN(C)c1ncccc1F f96dbc0c290b2988ccd784ed0d4f9c49 [0,2,0,0,0,0|2,0,0]=4 3781 B12R1.308 COCN(C)c1ncccc1I 72f722aeffea5c7861e1050461d83d2a [0,2,0,0,0,0|2,0,0]=4 3782 B12R1.308 CSCN(C)c1ccccc1C 5bd84e2103680c3cc36260fd189b1fa2 [0,2,0,0,0,0|1,1,0]=4 3783 B12R1.308 CSCN(C)c1ccccc1Cl 7f57939c15a8a05ae23d364af823fa13 [0,2,0,0,0,0|1,1,0]=4 3784 B12R1.308 CSCN(C)c1ccccc1F c3f0f1779e331775f1251b24adef35a5 [0,2,0,0,0,0|1,1,0]=4 3785 B12R1.25 CCCNc1cccc(c1Br)C 770780c7338a7530cde3d24e2efce410 [0,2,0,0,0,0|2,0,0]=4 3786 B12R1.25 CCCNc1cccc(c1Br)Cl f31276a8b59074caef69be3dcf947d2e [0,2,0,0,0,0|2,0,0]=4 3787 B12R1.25 CCCNc1cccc(c1Br)F 02bcd942237fe57033a243c40ac26059 [0,2,0,0,0,0|2,0,0]=4 3788 B12R1.25 CCCNc1cccc(c1C)C 97a8386687b09a67d8a90226a668fdeb [0,2,0,0,0,0|2,0,0]=4 3789 B12R1.25 CCCNc1cccc(c1C)Cl bc6f641192be0337029dfcce2df042e4 [0,2,0,0,0,0|2,0,0]=4 3790 B12R1.25 CCCNc1cccc(c1C)F 89a081e13c9a18e590ed98c2ff26ab83 [0,2,0,0,0,0|2,0,0]=4 3791 B12R1.25 CCCNc1cccc(c1C)I 9c974f80f36ea6046ee943d1a70cc7df [0,2,0,0,0,0|2,0,0]=4 3792 B12R1.25 CCCNc1cccc(c1Cl)C fde543649405e4c12543338d17fd03b2 [0,2,0,0,0,0|2,0,0]=4 3793 B12R1.25 CCCNc1cccc(c1Cl)Cl bf99dc66ec9cece02e610eca816ef394 [0,2,0,0,0,0|2,0,0]=4 3794 B12R1.25 CCCNc1cccc(c1Cl)F 3f023580b6c9f2222aa01fccf099bb27 [0,2,0,0,0,0|2,0,0]=4 3795 B12R1.25 CCCNc1cccc(c1Cl)I f9222fc245c8235cf0cbc3d1fe9d6986 [0,2,0,0,0,0|2,0,0]=4 3796 B12R1.25 CCCNc1cccc(c1F)C 229a3dd8588ed7b90abbed086b714486 [0,2,0,0,0,0|2,0,0]=4 3797 B12R1.25 CCCNc1cccc(c1F)Cl 5ba1d918d566280f703862620e8ebdfd [0,2,0,0,0,0|2,0,0]=4 3798 B12R1.25 CCCNc1cccc(c1F)F 5fd4c4f4f460dec8a16e70bad8bf8cc5 [0,2,0,0,0,0|2,0,0]=4 3799 B12R1.25 CCCNc1cccc(c1F)I 3e15d572fd6bb21ee3be3365731bc066 [0,2,0,0,0,0|2,0,0]=4 3800 B12R1.25 CCCNc1cccc(c1I)C 2e55cc9a7cbaf2e383ac5783dfbbe7ad [0,2,0,0,0,0|2,0,0]=4 3801 B12R1.25 CCCNc1cccc(c1I)Cl 94b02b6917c99c1fdb855960ba129fe3 [0,2,0,0,0,0|2,0,0]=4 3802 B12R1.25 CCCNc1cccc(c1I)F 061eeac99cd83b35d54ea0fbe1fe006c [0,2,0,0,0,0|2,0,0]=4 3803 B12R1.25 CCCNc1cccc(c1N)N efe7b95ff263293561021b15f933a6ef [0,2,0,0,0,0|2,0,0]=4 3804 B12R1.25 CCCOc1cccc(c1Br)C 0bf69b38602deb88d5269dfa7070c632 [0,2,0,0,0,0|2,0,0]=4 3805 B12R1.25 CCCOc1cccc(c1Br)Cl b3752207b657b24caf0be5aae9cb0688 [0,2,0,0,0,0|2,0,0]=4 3806 B12R1.25 CCCOc1cccc(c1Br)F 5c97bc551005776e8da71676c9171a87 [0,2,0,0,0,0|2,0,0]=4 3807 B12R1.25 CCCOc1cccc(c1Br)I 93034c6201e7bcfab23dfdbab558a319 [0,2,0,0,0,0|2,0,0]=4 3808 B12R1.25 CCCOc1cccc(c1C)Br 3c39a34e01f31c016903f593bde70103 [0,2,0,0,0,0|2,0,0]=4 3809 B12R1.25 CCCOc1cccc(c1C)C 77186d5049b5f52b0bb0f3d5c23e7722 [0,2,0,0,0,0|2,0,0]=4 3810 B12R1.25 CCCOc1cccc(c1C)Cl b1e5c0908d926b858fdbcee1d0f2b28c [0,2,0,0,0,0|2,0,0]=4 3811 B12R1.25 CCCOc1cccc(c1C)F 6aebd3e03a0f702504ff700f113b1676 [0,2,0,0,0,0|2,0,0]=4 3812 B12R1.25 CCCOc1cccc(c1C)I 3dd75aedb45b00e57497c75b291119b5 [0,2,0,0,0,0|2,0,0]=4 3813 B12R1.25 CCCOc1cccc(c1Cl)C 177802219e4a3790c6ac8ccd6fdc6f5e [0,2,0,0,0,0|2,0,0]=4 3814 B12R1.25 CCCOc1cccc(c1Cl)Cl 77f707ea7d3c9ba6b80e028aa3468907 [0,2,0,0,0,0|2,0,0]=4 3815 B12R1.25 CCCOc1cccc(c1Cl)F 47cb4c8dc2bdd9e47e2aff77487099e1 [0,2,0,0,0,0|2,0,0]=4 3816 B12R1.25 CCCOc1cccc(c1Cl)I 5574582c54256992881a418d62e8e15c [0,2,0,0,0,0|2,0,0]=4 3817 B12R1.25 CCCOc1cccc(c1F)C f286ee18de3d4031f059861e14818656 [0,2,0,0,0,0|2,0,0]=4 3818 B12R1.25 CCCOc1cccc(c1F)Cl bc07f7d4bd3e2f9cf6825b91ee170bd5 [0,2,0,0,0,0|2,0,0]=4 3819 B12R1.25 CCCOc1cccc(c1F)F 5217d0d65b9a758b7fc6b7907ba3c030 [0,2,0,0,0,0|2,0,0]=4 3820 B12R1.25 CCCOc1cccc(c1F)I f31809a977514507b48e1504a08ca4ff [0,2,0,0,0,0|2,0,0]=4 3821 B12R1.25 CCCOc1cccc(c1I)C af92a91065b3f6ed4af89aab9bb7216c [0,2,0,0,0,0|2,0,0]=4 3822 B12R1.25 CCCOc1cccc(c1I)Cl e0cffdcbb27e09a4a42b1cb2ddb255c0 [0,2,0,0,0,0|2,0,0]=4 3823 B12R1.25 CCCOc1cccc(c1I)F ecf5b8a29820fefe2ece01d37bda8210 [0,2,0,0,0,0|2,0,0]=4 3824 B12R1.25 CCNCc1cccc(c1Br)C 8a439411dad3155cd651c8e9786a3aff [0,2,0,0,0,0|2,0,0]=4 3825 B12R1.25 CCNCc1cccc(c1Br)F 0f79092d41af531a79ced3c8c3cb44b1 [0,2,0,0,0,0|2,0,0]=4 3826 B12R1.25 CCNCc1cccc(c1Br)I 258114970e6dbba1a235878aa00d0b39 [0,2,0,0,0,0|2,0,0]=4 3827 B12R1.25 CCNCc1cccc(c1C)Br 22ff1b4bd3f19ca36832a2146acc48af [0,2,0,0,0,0|2,0,0]=4 3828 B12R1.25 CCNCc1cccc(c1C)C d1d8a08dab241336adc4e7cf6dd2e8c8 [0,2,0,0,0,0|2,0,0]=4 3829 B12R1.25 CCNCc1cccc(c1C)Cl 8a50f1770a06d398b726602889430f2d [0,2,0,0,0,0|2,0,0]=4 3830 B12R1.25 CCNCc1cccc(c1C)F 81f2623e7634e99cac8145b0bd75d10c [0,2,0,0,0,0|2,0,0]=4 3831 B12R1.25 CCNCc1cccc(c1Cl)Br 2d127f3ff3f889a169c67d48ed429fca [0,2,0,0,0,0|2,0,0]=4 3832 B12R1.25 CCNCc1cccc(c1Cl)C 4a3bdbd600331e6009cec4a0c88116ed [0,2,0,0,0,0|2,0,0]=4 3833 B12R1.25 CCNCc1cccc(c1Cl)Cl d311bc98968f1326eabdf69c622cfc24 [0,2,0,0,0,0|2,0,0]=4 3834 B12R1.25 CCNCc1cccc(c1Cl)F 56e21fbb0a5fc9176a4ab08aead46833 [0,2,0,0,0,0|2,0,0]=4 3835 B12R1.25 CCNCc1cccc(c1Cl)I 02dad398c7cf29bf2892d48e7d054ded [0,2,0,0,0,0|2,0,0]=4 3836 B12R1.25 CCNCc1cccc(c1F)Br 20e8944dbbb9863fb8f63ed20f524bd5 [0,2,0,0,0,0|2,0,0]=4 3837 B12R1.25 CCNCc1cccc(c1F)C e0c999795a20cb69f73bc0fa341275d9 [0,2,0,0,0,0|2,0,0]=4 3838 B12R1.25 CCNCc1cccc(c1F)Cl ccbc62948855b8cb70b73c0045e73058 [0,2,0,0,0,0|2,0,0]=4 3839 B12R1.25 CCNCc1cccc(c1F)F 201ac55dad965d8412f8eb7d65040393 [0,2,0,0,0,0|2,0,0]=4 3840 B12R1.25 CCOCc1cccc(c1Br)C 4c787aff9be56bdae1833db245dad2f8 [0,2,0,0,0,0|2,0,0]=4 3841 B12R1.25 CCOCc1cccc(c1Br)Cl b4656763f9f99531c8e29235338b0b62 [0,2,0,0,0,0|2,0,0]=4 3842 B12R1.25 CCOCc1cccc(c1Br)F 0a7439157802071a74b27b1e28699eb1 [0,2,0,0,0,0|2,0,0]=4 3843 B12R1.25 CCOCc1cccc(c1Br)I d54bbe1dfd5e437d2cb260858a8e9483 [0,2,0,0,0,0|2,0,0]=4 3844 B12R1.25 CCOCc1cccc(c1C)Br ff04a8eeaee06377da8e7e5d16b20638 [0,2,0,0,0,0|2,0,0]=4 3845 B12R1.25 CCOCc1cccc(c1C)C 7beb5d5eab51375598796f0ea69b2f20 [0,2,0,0,0,0|2,0,0]=4 3846 B12R1.25 CCOCc1cccc(c1C)Cl d77d068b6558330d7d82d110daa54070 [0,2,0,0,0,0|2,0,0]=4 3847 B12R1.25 CCOCc1cccc(c1C)F 9ed97897d6bb3ee0563338343378aa62 [0,2,0,0,0,0|2,0,0]=4 3848 B12R1.25 CCOCc1cccc(c1C)I a64fbd464ddd6a3f161c82a1eef2a488 [0,2,0,0,0,0|2,0,0]=4 3849 B12R1.25 CCOCc1cccc(c1Cl)C 0d24d33db447f99d1211968d00c21a62 [0,2,0,0,0,0|2,0,0]=4 3850 B12R1.25 CCOCc1cccc(c1Cl)Cl 2cb46e81a11d80a918ee4a6e2c837d33 [0,2,0,0,0,0|2,0,0]=4 3851 B12R1.25 CCOCc1cccc(c1Cl)F cc5746b78083e5df0d8dddc051f45157 [0,2,0,0,0,0|2,0,0]=4 3852 B12R1.25 CCOCc1cccc(c1F)C 2319c6db0cb526d69d3f50935d5bb3a4 [0,2,0,0,0,0|2,0,0]=4 3853 B12R1.25 CCOCc1cccc(c1F)Cl 43d53f73e3c80dce35eca093808aa42e [0,2,0,0,0,0|2,0,0]=4 3854 B12R1.25 CCOCc1cccc(c1F)F 932d513dd1b0858f4c8d7f1804255f65 [0,2,0,0,0,0|2,0,0]=4 3855 B12R1.25 CCOCc1cccc(c1F)I 363096b52b190c95a8a04872b2c6c6a8 [0,2,0,0,0,0|2,0,0]=4 3856 B12R1.25 CCOCc1cccc(c1I)Br 865fc8747703122573b70e381d9740b5 [0,2,0,0,0,0|2,0,0]=4 3857 B12R1.25 CCOCc1cccc(c1I)C 9ad145c52761cc8220981426af61fe22 [0,2,0,0,0,0|2,0,0]=4 3858 B12R1.25 CCOCc1cccc(c1I)F db68d2463b2ff62d50e7360372570790 [0,2,0,0,0,0|2,0,0]=4 3859 B12R1.25 COCNc1cc[nH]c(=O)c1I 9fd409acf5ebd2dbeed9f669f9ad98c2 [0,2,0,0,0,0|2,0,0]=4 3860 B12R1.25 COCNc1cccc(=O)n1C 037fc909d3f74b6ba4029fa95a2177f3 [0,2,0,0,0,0|2,0,0]=4 3861 B12R1.25 COCNc1cccc(c1Br)C 6b0d07676a919c6f0c8f0aad6711d8e8 [0,2,0,0,0,0|1,0,0]=3 3862 B12R1.25 COCNc1cccc(c1Br)Cl d0dbd376b2f7c86e55ea171dafcfe6d1 [0,2,0,0,0,0|1,0,0]=3 3863 B12R1.25 COCNc1cccc(c1Br)F 587952b55aeb839552ecdade203ef422 [0,2,0,0,0,0|1,0,0]=3 3864 B12R1.25 COCNc1cccc(c1C)C ec5d11c03812e30844cbd5bcf605b38b [0,2,0,0,0,0|1,0,0]=3 3865 B12R1.25 COCNc1cccc(c1C)Cl 91ac556a72545eeb3bcffb18106a81f6 [0,2,0,0,0,0|1,0,0]=3 3866 B12R1.25 COCNc1cccc(c1C)F ef013f4a76bc58946fdfe3e9a130bbab [0,2,0,0,0,0|1,0,0]=3 3867 B12R1.25 COCNc1cccc(c1C)I 439ab75fb2752ec7b6c1076ed4a8d024 [0,2,0,0,0,0|1,0,0]=3 3868 B12R1.25 COCNc1cccc(c1Cl)C 83c414d4f2afce2cbccefb5ec9f7b9f7 [0,2,0,0,0,0|1,0,0]=3 3869 B12R1.25 COCNc1cccc(c1Cl)Cl ecb80c93ce3323da6edd40f1ef41183e [0,2,0,0,0,0|1,0,0]=3 3870 B12R1.25 COCNc1cccc(c1Cl)F 0ea18b030ef87e3ec1febd05951e7df0 [0,2,0,0,0,0|1,0,0]=3 3871 B12R1.25 COCNc1cccc(c1F)C db1ecc681218459ef0f69045a42586eb [0,2,0,0,0,0|1,0,0]=3 3872 B12R1.25 COCNc1cccc(c1F)Cl da2344a176d1eeb026cc34b335d04486 [0,2,0,0,0,0|1,0,0]=3 3873 B12R1.25 COCNc1cccc(c1F)F e5e794d482c2ba99634144a09bc04655 [0,2,0,0,0,0|1,0,0]=3 3874 B12R1.25 COCNc1cccc(c1I)C ebda21c5d402dcacaaa82647d029c2b0 [0,2,0,0,0,0|1,0,0]=3 3875 B12R1.25 COCNc1cccc(c1I)Cl 615e77ededf523c45133530834041814 [0,2,0,0,0,0|1,0,0]=3 3876 B12R1.25 COCNc1cccn(c1=O)C 5e4d89f6ae25e22d00236d4257e91789 [0,2,0,0,0,0|2,0,0]=4 3877 B12R1.25 COCNc1ccnc(c1Br)C 8df8f5a9c5902a34a06e7c2bf68258c6 [0,2,0,0,0,0|2,0,0]=4 3878 B12R1.25 COCNc1ccnc(c1Br)Cl d115c0f92180f0786826a9b2af15fc90 [0,2,0,0,0,0|2,0,0]=4 3879 B12R1.25 COCNc1ccnc(c1Br)F 8279d2541ad4aacb69cd2ae307426517 [0,2,0,0,0,0|2,0,0]=4 3880 B12R1.25 COCNc1ccnc(c1C)Br 6166b2285cf78d474a9a3b1e355064ea [0,2,0,0,0,0|2,0,0]=4 3881 B12R1.25 COCNc1ccnc(c1C)C 3f72c8365fd2274b6e269a49c95a1e11 [0,2,0,0,0,0|2,0,0]=4 3882 B12R1.25 COCNc1ccnc(c1C)Cl 8d44d6b7e2a22c0f4edc037140c73ff0 [0,2,0,0,0,0|2,0,0]=4 3883 B12R1.25 COCNc1ccnc(c1C)F f67f520b75f16d7f4faf75f4ef35e9c2 [0,2,0,0,0,0|2,0,0]=4 3884 B12R1.25 COCNc1ccnc(c1Cl)Br 2f0ca8f7d19dcde6fcff4632c187fe55 [0,2,0,0,0,0|2,0,0]=4 3885 B12R1.25 COCNc1ccnc(c1Cl)C 5ad312d1c1e3bccbd7ac8a7c1a14efcb [0,2,0,0,0,0|2,0,0]=4 3886 B12R1.25 COCNc1ccnc(c1Cl)Cl d66c80e9952b31cc3e1ded6c287cdac0 [0,2,0,0,0,0|2,0,0]=4 3887 B12R1.25 COCNc1ccnc(c1F)Br 7b1cfce9e2989e51a9e5d2325c4d979c [0,2,0,0,0,0|2,0,0]=4 3888 B12R1.25 COCNc1ccnc(c1F)C 53e655c55e468c14069beb5c6531c8cc [0,2,0,0,0,0|2,0,0]=4 3889 B12R1.25 COCNc1ccnc(c1F)Cl 6993648eadd0af33f085a19ced41b93b [0,2,0,0,0,0|2,0,0]=4 3890 B12R1.25 COCNc1ccnc(c1F)F 511995fa77a3920525fcc4140e78e6cf [0,2,0,0,0,0|2,0,0]=4 3891 B12R1.25 COCNc1ccnc(c1I)Br d809a20b7b96e529e40c66e389816da1 [0,2,0,0,0,0|2,0,0]=4 3892 B12R1.25 COCNc1ccnc(c1I)C 6b54014a466e74b3e768e4936e634b4d [0,2,0,0,0,0|2,0,0]=4 3893 B12R1.25 COCNc1ccnc(c1I)Cl 5dad62f1331b2e927461c62fad1f655f [0,2,0,0,0,0|2,0,0]=4 3894 B12R1.25 COCNc1ccnc(c1I)F 38661d7ac048519474785a62dda466f9 [0,2,0,0,0,0|2,0,0]=4 3895 B12R1.25 COCNc1cncc(c1Br)Cl 9f47defe62944ebd9924e6bd881ad962 [0,2,0,0,0,0|2,0,0]=4 3896 B12R1.25 COCNc1cncc(c1C)Br 74d561c39572b4d54e412e3b0b7b63a7 [0,2,0,0,0,0|2,0,0]=4 3897 B12R1.25 COCNc1cncc(c1C)Cl 6f2509b390a57e9d47584c4d1a57c759 [0,2,0,0,0,0|2,0,0]=4 3898 B12R1.25 COCNc1cncc(c1C)F ccd30d0195e4b18ccfbe34a4510d4167 [0,2,0,0,0,0|2,0,0]=4 3899 B12R1.25 COCNc1cncc(c1Cl)Br c5bfb356a845965d230d29a004a53285 [0,2,0,0,0,0|2,0,0]=4 3900 B12R1.25 COCNc1cncc(c1Cl)Cl 6fcac1df29f7372997ff69f5799da3b2 [0,2,0,0,0,0|2,0,0]=4 3901 B12R1.25 COCNc1cncc(c1Cl)F f0fda5c04655a50d2ff28d85ba800120 [0,2,0,0,0,0|2,0,0]=4 3902 B12R1.25 COCNc1cncc(c1F)Cl fb4ead02397703a8949c343a0cbb3a72 [0,2,0,0,0,0|2,0,0]=4 3903 B12R1.25 COCNc1cncc(c1I)Br 934b75a98087dfdd9c9d99562ca9987e [0,2,0,0,0,0|2,0,0]=4 3904 B12R1.25 COCNc1cncc(c1I)Cl 4536282f21da6548be9de7ccf0454d71 [0,2,0,0,0,0|2,0,0]=4 3905 B12R1.25 COCNc1cncc(c1I)F 73ad954c8e710821a1fae5a9baf8d974 [0,2,0,0,0,0|2,0,0]=4 3906 B12R1.25 COCNc1nccc(c1Br)Br ae9a9a46cf3561965080a2b303b4c2e0 [0,2,0,0,0,0|2,0,0]=4 3907 B12R1.25 COCNc1nccc(c1Br)C 642e2cc260cdfb1680032ddc83b23c6f [0,2,0,0,0,0|2,0,0]=4 3908 B12R1.25 COCNc1nccc(c1Br)Cl 82a23c694f87318ec762303e85263a4a [0,2,0,0,0,0|2,0,0]=4 3909 B12R1.25 COCNc1nccc(c1Br)F 6e4ab791045a5ab54c9b6bcab7a8d4d5 [0,2,0,0,0,0|2,0,0]=4 3910 B12R1.25 COCNc1nccc(c1C)Br a89c2f3d06d71e3643147a4642c5b911 [0,2,0,0,0,0|2,0,0]=4 3911 B12R1.25 COCNc1nccc(c1C)C 76a9d46b14218429d842075a7c704fad [0,2,0,0,0,0|2,0,0]=4 3912 B12R1.25 COCNc1nccc(c1C)Cl 2dda4b668dd0632473146667c115ac19 [0,2,0,0,0,0|2,0,0]=4 3913 B12R1.25 COCNc1nccc(c1C)F 4a965bf70a8cf806b2fd0b922d7bcc09 [0,2,0,0,0,0|2,0,0]=4 3914 B12R1.25 COCNc1nccc(c1C)I 067daf4f8dc67dd29a9e1e2be0dfcfb9 [0,2,0,0,0,0|2,0,0]=4 3915 B12R1.25 COCNc1nccc(c1Cl)Br ff529a25213f3aed5bb251f9c78e09db [0,2,0,0,0,0|2,0,0]=4 3916 B12R1.25 COCNc1nccc(c1Cl)C 48f92eb33946b5ad43e9097a6489fe7c [0,2,0,0,0,0|2,0,0]=4 3917 B12R1.25 COCNc1nccc(c1Cl)Cl b75daaa1109d998515233164bcfb6886 [0,2,0,0,0,0|2,0,0]=4 3918 B12R1.25 COCNc1nccc(c1Cl)I 40cd87538a05555cbd3bec22ef9962af [0,2,0,0,0,0|2,0,0]=4 3919 B12R1.25 COCNc1nccc(c1Cl)S ff4a68f06a37f86a9ce25462217741aa [0,2,0,0,0,0|2,0,0]=4 3920 B12R1.25 COCNc1nccc(c1F)Br 441c5af7aa97b58498830c56332bd5bf [0,2,0,0,0,0|2,0,0]=4 3921 B12R1.25 COCNc1nccc(c1F)C 1f9f7073ad3dcc2123764cd90aa25bb3 [0,2,0,0,0,0|2,0,0]=4 3922 B12R1.25 COCNc1nccc(c1F)Cl 84ba2ae4df0a993b043965d04eee2be0 [0,2,0,0,0,0|2,0,0]=4 3923 B12R1.25 COCNc1nccc(c1F)F 44960cb70ffba844107cfc430354a192 [0,2,0,0,0,0|2,0,0]=4 3924 B12R1.25 COCNc1nccc(c1F)I 1e2d7b6d57a68af89025164c656134cd [0,2,0,0,0,0|2,0,0]=4 3925 B12R1.25 COCNc1nccc(c1I)Br 401373db43bc332b6ec5fcb4793a8b43 [0,2,0,0,0,0|2,0,0]=4 3926 B12R1.25 COCNc1nccc(c1I)C 885f8fa29ca7a97ce77b099c1730afa2 [0,2,0,0,0,0|2,0,0]=4 3927 B12R1.25 COCNc1nccc(c1I)Cl 61acdd11ee6836bd930ed49a28f8ac6b [0,2,0,0,0,0|2,0,0]=4 3928 B12R1.25 COCOc1c[nH]cc(c1=O)F 2102413dd8c05f36898af38daccd7d76 [0,2,0,0,0,0|2,0,0]=4 3929 B12R1.25 COCOc1cc[nH]c(=O)c1C 41d1a1066106f96640fcf70403f5266d [0,2,0,0,0,0|2,0,0]=4 3930 B12R1.25 COCOc1cc[nH]c(=O)c1I 7c24b2715f0b7c7128e835c4daa4206b [0,2,0,0,0,0|2,0,0]=4 3931 B12R1.25 COCOc1cccc(c1Br)C 4c6476b2cd63357b7397af4752428217 [0,2,0,0,0,0|1,0,0]=3 3932 B12R1.25 COCOc1cccc(c1Br)Cl cf7b7cc7e7ce0276c87563ec27ade9ba [0,2,0,0,0,0|1,0,0]=3 3933 B12R1.25 COCOc1cccc(c1Br)F 4857e0164f20f644b02258358b370139 [0,2,0,0,0,0|1,0,0]=3 3934 B12R1.25 COCOc1cccc(c1C)Br 86de53cb6c841591c55f9b196108bbc8 [0,2,0,0,0,0|1,0,0]=3 3935 B12R1.25 COCOc1cccc(c1C)C ae8611a9ba4ee16ef3c4694fef5182c7 [0,2,0,0,0,0|1,0,0]=3 3936 B12R1.25 COCOc1cccc(c1C)Cl 8ab441949bd1e230a6205db2bd395042 [0,2,0,0,0,0|1,0,0]=3 3937 B12R1.25 COCOc1cccc(c1C)F 700c87eb3a092df1c1d3a7d1d916de86 [0,2,0,0,0,0|1,0,0]=3 3938 B12R1.25 COCOc1cccc(c1C)I f738e859b3908dbcf3130a557aa8bff0 [0,2,0,0,0,0|1,0,0]=3 3939 B12R1.25 COCOc1cccc(c1Cl)C d2481ddf60b90597845cecd5be423c62 [0,2,0,0,0,0|1,0,0]=3 3940 B12R1.25 COCOc1cccc(c1Cl)Cl 8ddeb21e1e5e668d8891c57582a0a9a9 [0,2,0,0,0,0|1,0,0]=3 3941 B12R1.25 COCOc1cccc(c1Cl)F 0cda4c7422c469e0f2460204ac0df1bf [0,2,0,0,0,0|1,0,0]=3 3942 B12R1.25 COCOc1cccc(c1Cl)I b29b47bc47ede054f059e4161dff44e8 [0,2,0,0,0,0|1,0,0]=3 3943 B12R1.25 COCOc1cccc(c1F)C 5b22002b9fbc9f4c6891c6cc4a6b313a [0,2,0,0,0,0|1,0,0]=3 3944 B12R1.25 COCOc1cccc(c1F)Cl 195ed14f7661758b16be52a8142e3570 [0,2,0,0,0,0|1,0,0]=3 3945 B12R1.25 COCOc1cccc(c1F)F 72ccf10186783fb12718ce1d45d6db9e [0,2,0,0,0,0|1,0,0]=3 3946 B12R1.25 COCOc1cccc(c1I)Br 45b885be7238f1aca48287edd59f642f [0,2,0,0,0,0|1,0,0]=3 3947 B12R1.25 COCOc1cccc(c1I)Cl 566595f3c91a19c057eebbc7183c9666 [0,2,0,0,0,0|1,0,0]=3 3948 B12R1.25 COCOc1cccc(c1I)F 02a06d42197bc460b2ae8bfa01464877 [0,2,0,0,0,0|1,0,0]=3 3949 B12R1.25 COCOc1cccn(c1=O)C aa72124ffa8ad5fdb9541d93fb9dc69a [0,2,0,0,0,0|2,0,0]=4 3950 B12R1.25 COCOc1cccn(c1=S)C 43c8f9bb12ce70d6788dd748a2b864c5 [0,2,0,0,0,0|2,0,0]=4 3951 B12R1.25 COCOc1ccnc(c1Br)C c62a9ab3e2fcbfe5cecf4a46f1929d0c [0,2,0,0,0,0|2,0,0]=4 3952 B12R1.25 COCOc1ccnc(c1Br)Cl 6b6bdf9efaa4d6fab425b10f2269bde9 [0,2,0,0,0,0|2,0,0]=4 3953 B12R1.25 COCOc1ccnc(c1Br)F 1c9613403336619b22f05afcd4eb8415 [0,2,0,0,0,0|2,0,0]=4 3954 B12R1.25 COCOc1ccnc(c1C)C 3d7636c19fb444c14cd045a4f80e985e [0,2,0,0,0,0|2,0,0]=4 3955 B12R1.25 COCOc1ccnc(c1C)F f9cdfc6f3324a7877ce969a4ee3a8143 [0,2,0,0,0,0|2,0,0]=4 3956 B12R1.25 COCOc1ccnc(c1Cl)Br 54400f489268d179b0ee67d14afd29ad [0,2,0,0,0,0|2,0,0]=4 3957 B12R1.25 COCOc1ccnc(c1Cl)Cl 9c62c8b0275a823f93d2e7a8cbcbf7c0 [0,2,0,0,0,0|2,0,0]=4 3958 B12R1.25 COCOc1ccnc(c1Cl)F 88d3272564fd19a7c6615c35a8fa21f0 [0,2,0,0,0,0|2,0,0]=4 3959 B12R1.25 COCOc1ccnc(c1F)Br 88e8e842dce75e4ac8732f85bf7725cc [0,2,0,0,0,0|2,0,0]=4 3960 B12R1.25 COCOc1ccnc(c1F)Cl dc9b60154f6b54c50c7e3f32f7a5a3c5 [0,2,0,0,0,0|2,0,0]=4 3961 B12R1.25 COCOc1ccnc(c1F)F 8fe3ab151812718b9e6c34366a963cdc [0,2,0,0,0,0|2,0,0]=4 3962 B12R1.25 COCOc1ccnc(c1I)C 4bf0c20889962e08d7e7b201a05d7a42 [0,2,0,0,0,0|2,0,0]=4 3963 B12R1.25 COCOc1ccnc(c1I)F 1b5ed80256ae9b85b2a623a02de85490 [0,2,0,0,0,0|2,0,0]=4 3964 B12R1.25 COCOc1cncc(c1Br)C 93c3edd371083a0fdb259a46866792bf [0,2,0,0,0,0|2,0,0]=4 3965 B12R1.25 COCOc1cncc(c1C)Br b0cbe936c01f829cc554785d25501858 [0,2,0,0,0,0|2,0,0]=4 3966 B12R1.25 COCOc1cncc(c1Cl)C 8083c8e82db5c27a96a75ce057e23b02 [0,2,0,0,0,0|2,0,0]=4 3967 B12R1.25 COCOc1cncc(c1F)Br c67024ddd2d89f0f281a30b11e437c60 [0,2,0,0,0,0|2,0,0]=4 3968 B12R1.25 COCOc1nccc(c1Br)C 2582e82e7fd2ed5585dacfeeef62e00d [0,2,0,0,0,0|2,0,0]=4 3969 B12R1.25 COCOc1nccc(c1C)Br 31c4abdfa01e8527b0e1b573474d25c2 [0,2,0,0,0,0|2,0,0]=4 3970 B12R1.25 COCOc1nccc(c1C)C 279619ea06b1c266ceaa563f49b0692c [0,2,0,0,0,0|2,0,0]=4 3971 B12R1.25 COCOc1nccc(c1C)Cl ea608b230582c89ace2b3685afaa97d7 [0,2,0,0,0,0|2,0,0]=4 3972 B12R1.25 COCOc1nccc(c1C)I 949204a0a9a67715e55bc3dfdd36334d [0,2,0,0,0,0|2,0,0]=4 3973 B12R1.25 COCOc1nccc(c1Cl)Br 60992cb8c50574a1d9392334093478ad [0,2,0,0,0,0|2,0,0]=4 3974 B12R1.25 COCOc1nccc(c1F)I 96ec0c20959bc0e13629ddc1efd9c9d6 [0,2,0,0,0,0|2,0,0]=4 3975 B12R1.25 COCOc1nccc(c1I)Cl 1eca8da42966f9b2ea686e3149bf797c [0,2,0,0,0,0|2,0,0]=4 3976 B12R1.25 CSCNc1cccc(c1Br)Cl 29db8110ef7475fcf020871584177e5d [0,2,0,0,0,0|1,1,0]=4 3977 B12R1.25 CSCNc1cccc(c1Br)F 28a1b847c4ceb80351297ecaa71167d1 [0,2,0,0,0,0|1,1,0]=4 3978 B12R1.25 CSCNc1cccc(c1C)Cl c2f73185a951fadf6c1b23f1066668aa [0,2,0,0,0,0|1,1,0]=4 3979 B12R1.25 CSCNc1cccc(c1C)F 16e4dc3651bc963c97c19bfef9b7308f [0,2,0,0,0,0|1,1,0]=4 3980 B12R1.25 CSCNc1cccc(c1C)I a2a9ab35c7f43055d1d232adaeacefe1 [0,2,0,0,0,0|1,1,0]=4 3981 B12R1.25 CSCNc1cccc(c1Cl)C 0bf627d30b1469b7d2bafce0c031ed59 [0,2,0,0,0,0|1,1,0]=4 3982 B12R1.25 CSCNc1cccc(c1Cl)Cl c5a5a696057b2bb1d45bf3eb304d89a2 [0,2,0,0,0,0|1,1,0]=4 3983 B12R1.25 CSCNc1cccc(c1Cl)F 4ab23cf352eb7a5f74b8c7d73afd729f [0,2,0,0,0,0|1,1,0]=4 3984 B12R1.25 CSCNc1cccc(c1Cl)I e63bccad81165911ef030ef632a51cef [0,2,0,0,0,0|1,1,0]=4 3985 B12R1.25 CSCNc1cccc(c1F)Cl 1dad8e81f6c1514bd78d03be12c9b9b2 [0,2,0,0,0,0|1,1,0]=4 3986 B12R1.25 CSCNc1cccc(c1F)F 0cfdb4bd4c06da91ec6460884ea9e7c3 [0,2,0,0,0,0|1,1,0]=4 3987 B12R1.25 CSCNc1cccc(c1F)I 7fc0c4bf244e8c0bbeabaaf3f911a509 [0,2,0,0,0,0|1,1,0]=4 3988 B12R1.25 CSCNc1cccc(c1I)F 40f4672573bbce1463f57de53dd22c18 [0,2,0,0,0,0|1,1,0]=4 3989 B12R1.25 CSCOc1cccc(c1Br)C 2fc2ae98d570fa0330897b64d3d76776 [0,2,0,0,0,0|1,1,0]=4 3990 B12R1.25 CSCOc1cccc(c1Br)Cl 8484ad08f56edfbb700395f2571dcb3d [0,2,0,0,0,0|1,1,0]=4 3991 B12R1.25 CSCOc1cccc(c1Br)F 317817e0022b714c858a03f879b8385d [0,2,0,0,0,0|1,1,0]=4 3992 B12R1.25 CSCOc1cccc(c1Br)I a5dca4071978ea57dab8a60af3a76cf0 [0,2,0,0,0,0|1,1,0]=4 3993 B12R1.25 CSCOc1cccc(c1C)Br 6722fbef621ded6722ecc5a427a4c969 [0,2,0,0,0,0|1,1,0]=4 3994 B12R1.25 CSCOc1cccc(c1C)C 437d0b880396f3c6dc3030313aee7f4d [0,2,0,0,0,0|1,1,0]=4 3995 B12R1.25 CSCOc1cccc(c1C)Cl 1de0452c4095f5fa6524793ff3376d6f [0,2,0,0,0,0|1,1,0]=4 3996 B12R1.25 CSCOc1cccc(c1C)F 39038661b87dcfdd4be5ccc7783034b8 [0,2,0,0,0,0|1,1,0]=4 3997 B12R1.25 CSCOc1cccc(c1C)I 2dc927b18256240b1c40befa9b724fda [0,2,0,0,0,0|1,1,0]=4 3998 B12R1.25 CSCOc1cccc(c1Cl)C e2e05bdf56dafed519445db99c2d4f0e [0,2,0,0,0,0|1,1,0]=4 3999 B12R1.25 CSCOc1cccc(c1Cl)Cl e5cac9b125ae0dd096c71bbf2f97d9d3 [0,2,0,0,0,0|1,1,0]=4 4000 B12R1.25 CSCOc1cccc(c1Cl)F 046718363e4dc227fcf75550ebdeede4 [0,2,0,0,0,0|1,1,0]=4 4001 B12R1.25 CSCOc1cccc(c1Cl)I 079c94c8912771d119bab1122fdca54b [0,2,0,0,0,0|1,1,0]=4 4002 B12R1.25 CSCOc1cccc(c1F)C cc581bee14b8cad4801339554dbbfd62 [0,2,0,0,0,0|1,1,0]=4 4003 B12R1.25 CSCOc1cccc(c1F)Cl 1c418bb59298e2fa8a3eb2feb50fbc15 [0,2,0,0,0,0|1,1,0]=4 4004 B12R1.25 CSCOc1cccc(c1F)F e5df3a5cbe6a7b615688b53146b7806a [0,2,0,0,0,0|1,1,0]=4 4005 B12R1.25 CSCOc1cccc(c1F)I af30307127667ddbfdd16e81ca6e8ffd [0,2,0,0,0,0|1,1,0]=4 4006 B12R1.25 CSCOc1cccc(c1I)Br a642f86274cd092afe9e953e6745c3b2 [0,2,0,0,0,0|1,1,0]=4 4007 B12R1.25 CSCOc1cccc(c1I)C b244d7386e129ef5ab72ef335eda4a60 [0,2,0,0,0,0|1,1,0]=4 4008 B12R1.25 CSCOc1cccc(c1I)Cl e952e5a0575d89138404b82e8628cbbb [0,2,0,0,0,0|1,1,0]=4 4009 B12R1.25 CSCOc1cccc(c1I)F 95886d3e8881562541f54d99a215d3b2 [0,2,0,0,0,0|1,1,0]=4 4010 B12R1.121 C#Cc1ccccc1COCC 3f4d3e90467b2e7bc1cb19fe841f1865 [0,2,0,0,0,0|2,0,0]=4 4011 B12R1.121 C#Cc1ccccc1NCCC 2080cee1a2db0ad1193688b3edc4550e [0,2,0,0,0,0|2,0,0]=4 4012 B12R1.121 C#Cc1ccccc1NCOC 5fe4ba4cb588520b4743c1f3ec820f18 [0,2,0,0,0,0|1,0,0]=3 4013 B12R1.121 C#Cc1ccccc1NCSC 53891ab5d5c841d775b9266fac5bb25d [0,2,0,0,0,0|1,1,0]=4 4014 B12R1.121 C#Cc1ccccc1OCCC a4f7d5986feb93828e0ed01e136164da [0,2,0,0,0,0|2,0,0]=4 4015 B12R1.121 C#Cc1ccccc1OCOC ee47023b58d47b3f17fe6228233fb042 [0,2,0,0,0,0|1,0,0]=3 4016 B12R1.121 C#Cc1ccccc1OCSC 0a79cca06adb122558107c8b3fd5173d [0,2,0,0,0,0|1,1,0]=4 4017 B12R1.121 C#Cc1cccnc1NCOC 22a51f5852727f0ee20ff7302123016f [0,2,0,0,0,0|2,0,0]=4 4018 B12R1.121 C#Cc1cccnc1OCOC 87e7f2be168227133fcb828b1a92eae9 [0,2,0,0,0,0|2,0,0]=4 4019 B12R1.121 C#Cc1ccncc1NCOC 05a64bf3a37399c498e395146301bfec [0,2,0,0,0,0|2,0,0]=4 4020 B12R1.121 C#Cc1cnccc1NCOC 470f31d463c53a5ec3e117676970ea59 [0,2,0,0,0,0|2,0,0]=4 4021 B12R1.121 C#Cc1ncccc1NCOC 1ccdcdb812a76695da4573ab94e004a8 [0,2,0,0,0,0|2,0,0]=4 4022 B12R1.121 C=Cc1ccccc1COCC 450d58f9aa08ac26b17a63c03dda207e [0,2,0,0,0,0|2,0,0]=4 4023 B12R1.121 C=Cc1ccccc1NCCC 393733931c90fefa8f24f7aff42f74b7 [0,2,0,0,0,0|2,0,0]=4 4024 B12R1.121 C=Cc1ccccc1NCOC 29412ee07e90b4fc64aa7c39016304f5 [0,2,0,0,0,0|1,0,0]=3 4025 B12R1.121 C=Cc1ccccc1NCSC b178866127f76af53989981ecd9b9ef2 [0,2,0,0,0,0|1,1,0]=4 4026 B12R1.121 C=Cc1ccccc1OCCC d64cceb48d34bd593308e20fdb8200e9 [0,2,0,0,0,0|2,0,0]=4 4027 B12R1.121 C=Cc1ccccc1OCOC abc36c026478894e162a6fe06b17f2c2 [0,2,0,0,0,0|1,0,0]=3 4028 B12R1.121 C=Cc1ccccc1OCSC d09fb02750a7673eed0c9edbef0f6056 [0,2,0,0,0,0|1,1,0]=4 4029 B12R1.121 C=Cc1ncccc1NCOC bc5389daf8ae46056396d51a3a95bf60 [0,2,0,0,0,0|2,0,0]=4 4030 B12R1.121 CCCNc1ccccc1C#N 27ee33b46676634ca26387e863df78ef [0,2,0,0,0,0|2,0,0]=4 4031 B12R1.121 CCCNc1ccccc1C=O d39fa7b2696866eb4a1bc9c52327bd08 [0,2,0,0,0,0|2,0,0]=4 4032 B12R1.121 CCCNc1ccccc1CBr 5654fbd571e73630b5bc292f9d38b7d4 [0,2,0,0,0,0|2,0,0]=4 4033 B12R1.121 CCCNc1ccccc1CC 39bbfb3458e19c9310d79a68945e3d88 [0,2,0,0,0,0|2,0,0]=4 4034 B12R1.121 CCCNc1ccccc1CO ac2795b4df2d626601005eabc51f6f17 [0,2,0,0,0,0|2,0,0]=4 4035 B12R1.121 CCCNc1ccccc1CS bdc35a4f3d678c28d9513906dedb7b78 [0,2,0,0,0,0|2,0,0]=4 4036 B12R1.121 CCCNc1ccccc1OC d2dcbfb7fdcae7a60fb5172054dc4ef1 [0,2,0,0,0,0|2,0,0]=4 4037 B12R1.121 CCCNc1ccccc1SC d67a4f48a71e6f54241f9032dba32f4c [0,2,0,0,0,0|2,0,0]=4 4038 B12R1.121 CCCOc1ccccc1C#N 5839737f2357762bfdd93be09ee4484c [0,2,0,0,0,0|2,0,0]=4 4039 B12R1.121 CCCOc1ccccc1C=O 96e764f50eca112b9923d943250c3345 [0,2,0,0,0,0|2,0,0]=4 4040 B12R1.121 CCCOc1ccccc1CC 0fb4b6e8cb3dd80fa6a8ce889b16416b [0,2,0,0,0,0|2,0,0]=4 4041 B12R1.121 CCCOc1ccccc1OC e1a8f477385f7131998a3a6295c0d0ee [0,2,0,0,0,0|2,0,0]=4 4042 B12R1.121 CCCOc1ccccc1SC b2283a47a3ea4715fd2e4736f48b48da [0,2,0,0,0,0|2,0,0]=4 4043 B12R1.121 CCNCc1ccccc1C#N 11ab151a2375558bd7afe9ec3d151a51 [0,2,0,0,0,0|2,0,0]=4 4044 B12R1.121 CCNCc1ccccc1CC dba418a277dbea9938d00be21f426b18 [0,2,0,0,0,0|2,0,0]=4 4045 B12R1.121 CCNCc1ccccc1CO 247e788b2f72e3b7b5034ac1bbd368e6 [0,2,0,0,0,0|2,0,0]=4 4046 B12R1.121 CCNCc1ccccc1OC c267ee69e078172dcb8af018da305189 [0,2,0,0,0,0|2,0,0]=4 4047 B12R1.121 CCNCc1ccccc1SC d3fe9219738a624af728407b98f87f8f [0,2,0,0,0,0|2,0,0]=4 4048 B12R1.121 CCOCc1ccccc1C#N a7dce0509c7ec48871f6c0ac5628c2e6 [0,2,0,0,0,0|2,0,0]=4 4049 B12R1.121 CCOCc1ccccc1CC aae357a9f1ec25325b62c78eca4b1963 [0,2,0,0,0,0|2,0,0]=4 4050 B12R1.121 CCOCc1ccccc1OC 5bb7bbe2e4f0450c635782da56d7e647 [0,2,0,0,0,0|2,0,0]=4 4051 B12R1.121 CCOCc1ccccc1SC cea9660c927d54e423fd0e4fd560b596 [0,2,0,0,0,0|2,0,0]=4 4052 B12R1.121 CCc1ccccc1NCOC 042eeb269b0df618d7d6f2598cc467bb [0,2,0,0,0,0|1,0,0]=3 4053 B12R1.121 CCc1ccccc1OCSC 83fd1085b2fcaac32032fa7856c32ad2 [0,2,0,0,0,0|1,1,0]=4 4054 B12R1.121 CCc1cccnc1NCOC d5aa6b7ed43d7dd5d48322529087e3b1 [0,2,0,0,0,0|2,0,0]=4 4055 B12R1.121 CCc1cccnc1OCOC 49f6dc498a769287c039503c57e98d2e [0,2,0,0,0,0|2,0,0]=4 4056 B12R1.121 CCc1ccncc1OCOC 4f8f9476bbd6cd203628a968d8382964 [0,2,0,0,0,0|2,0,0]=4 4057 B12R1.121 CCc1ncccc1NCOC 75f629f3e574040796ba62ffab211c1e [0,2,0,0,0,0|2,0,0]=4 4058 B12R1.121 CCc1ncccc1OCOC 1c9c7148361ca1346dac1bb893b875cf [0,2,0,0,0,0|2,0,0]=4 4059 B12R1.121 COCNc1ccccc1C#N efc6352fd36baa83e43a9df80b51f0f3 [0,2,0,0,0,0|1,0,0]=3 4060 B12R1.121 COCNc1ccccc1C=O 70afd880ba2765b002a0d595de24b5bd [0,2,0,0,0,0|1,0,0]=3 4061 B12R1.121 COCNc1ccccc1CBr c6e5ba88c62ec4d8b10e4b35b95f9f6c [0,2,0,0,0,0|1,0,0]=3 4062 B12R1.121 COCNc1ccccc1CO fd0275a8af8afb8428d4cb054d68dcf3 [0,2,0,0,0,0|1,0,0]=3 4063 B12R1.121 COCNc1ccccc1CS 7dd8b18041eeb88a6084cb8265ff173d [0,2,0,0,0,0|1,0,0]=3 4064 B12R1.121 COCNc1ccccc1OC 86db96cbb2aeddf567e03b2d683c3a70 [0,2,0,0,0,0|1,0,0]=3 4065 B12R1.121 COCNc1ccccc1SC 0b55bcd8f1dccc2689b2725b902d7db3 [0,2,0,0,0,0|1,0,0]=3 4066 B12R1.121 COCNc1cccnc1C#N 9133bba2c8d8c7d947210fa0863efdc8 [0,2,0,0,0,0|2,0,0]=4 4067 B12R1.121 COCNc1cccnc1C=O 1dcdbf0985212609235fbf1bf028c8d6 [0,2,0,0,0,0|2,0,0]=4 4068 B12R1.121 COCNc1cccnc1CCl 2644707dc2871fcd43e70c3c5785ab45 [0,2,0,0,0,0|2,0,0]=4 4069 B12R1.121 COCNc1cccnc1CO 6ca81241ce3c3e9e6c6dca981778f6ce [0,2,0,0,0,0|2,0,0]=4 4070 B12R1.121 COCNc1cccnc1OC e42a77ea1747395f700edd04ff2fb100 [0,2,0,0,0,0|2,0,0]=4 4071 B12R1.121 COCNc1ccncc1C#N 5020a5ca24d82d3df498a1f974730508 [0,2,0,0,0,0|2,0,0]=4 4072 B12R1.121 COCNc1ccncc1C=O 08787fb60db1e8f1f7084dd3aee3ac81 [0,2,0,0,0,0|2,0,0]=4 4073 B12R1.121 COCNc1ccncc1CO 7a8c8ccd4790a4a9ec4b54647ea9dc2d [0,2,0,0,0,0|2,0,0]=4 4074 B12R1.121 COCNc1ccncc1OC ed9b4be07c2086ac29ec04b143ae4747 [0,2,0,0,0,0|2,0,0]=4 4075 B12R1.121 COCNc1ccncc1SC 8f2fb14be9f00a7cd62b28535b5d587f [0,2,0,0,0,0|2,0,0]=4 4076 B12R1.121 COCNc1cnccc1C#N 6e4403700e10ddd541ab8b1bf3d29a57 [0,2,0,0,0,0|2,0,0]=4 4077 B12R1.121 COCNc1cnccc1C=O d87f0481e0e9bade6a6b4864da828178 [0,2,0,0,0,0|2,0,0]=4 4078 B12R1.121 COCNc1cnccc1CO 5306c4099a149ee658f63c5abc906197 [0,2,0,0,0,0|2,0,0]=4 4079 B12R1.121 COCNc1cnccc1OC 91acb543fa97338c427cb00b830adbd1 [0,2,0,0,0,0|2,0,0]=4 4080 B12R1.121 COCNc1ncccc1C#N fb20421e947bd65b6af8002ec5d7f55c [0,2,0,0,0,0|2,0,0]=4 4081 B12R1.121 COCNc1ncccc1C=O 083dd5dec5554be96a261e4bfbdad267 [0,2,0,0,0,0|2,0,0]=4 4082 B12R1.121 COCNc1ncccc1CCl 12053d2ff836aadc41164ba1df08dca5 [0,2,0,0,0,0|2,0,0]=4 4083 B12R1.121 COCNc1ncccc1CO c7078642df615e7c26b01a372a03ff9c [0,2,0,0,0,0|2,0,0]=4 4084 B12R1.121 COCNc1ncccc1OC f8d375b8b6d9734a63e3775c005b02d4 [0,2,0,0,0,0|2,0,0]=4 4085 B12R1.121 COCNc1ncccc1SC 0dc0978a71c3c109b19e44138dd05998 [0,2,0,0,0,0|2,0,0]=4 4086 B12R1.121 COCOc1ccccc1C#N cc8f6685dbcd8980d43bef8fec8601e2 [0,2,0,0,0,0|1,0,0]=3 4087 B12R1.121 COCOc1ccccc1C=O f735e2f3f525a620387fbe462a72b8d7 [0,2,0,0,0,0|1,0,0]=3 4088 B12R1.121 COCOc1ccccc1OC 8016083eed1bdc26c60f5c3b50822424 [0,2,0,0,0,0|1,0,0]=3 4089 B12R1.121 COCOc1ccccc1SC 2ed2b7b33a8d11d5841fc80be08be58f [0,2,0,0,0,0|1,0,0]=3 4090 B12R1.121 COCOc1cccnc1C#N a9df180127b9f0a3b8a8dfc25768b240 [0,2,0,0,0,0|2,0,0]=4 4091 B12R1.121 COCOc1cccnc1C=O 0b0f7d05bc9c165fbc0be5fa5f87a1c9 [0,2,0,0,0,0|2,0,0]=4 4092 B12R1.121 COCOc1cccnc1OC d9500e1bb2540be94bf709bf7a993b98 [0,2,0,0,0,0|2,0,0]=4 4093 B12R1.121 COCOc1ccncc1C#N a2ca7f7653d451fd189ec11beda6e99f [0,2,0,0,0,0|2,0,0]=4 4094 B12R1.121 COCOc1ccncc1C=O 2963b08c51c466b80124b0b7ed5ff0d8 [0,2,0,0,0,0|2,0,0]=4 4095 B12R1.121 COCOc1ccncc1OC fa9d3c06419b4d6df8681526912a249c [0,2,0,0,0,0|2,0,0]=4 4096 B12R1.121 COCOc1cnccc1C#N 4f0b1d3384ad8f1644139279c5545f02 [0,2,0,0,0,0|2,0,0]=4 4097 B12R1.121 COCOc1cnccc1C=O e5e9371e2e088ff39c7f8bef6748fdcc [0,2,0,0,0,0|2,0,0]=4 4098 B12R1.121 COCOc1cnccc1OC 27d0bfd6fdb20ef93f584726a52b316e [0,2,0,0,0,0|2,0,0]=4 4099 B12R1.121 COc1ccccc1OCSC 6f79e6b6a8b0b9409aba7319297e6c30 [0,2,0,0,0,0|1,1,0]=4 4100 B12R1.121 CSCNc1ccccc1C#N aa4f7fb6fd2582754b787f148f43df3a [0,2,0,0,0,0|1,1,0]=4 4101 B12R1.121 CSCNc1ccccc1C=O ca4fc5441f1db2d061e35da97d20fe96 [0,2,0,0,0,0|1,1,0]=4 4102 B12R1.121 CSCNc1ccccc1CBr 7e117f3cb5c8e718fd8a3df4a006deb4 [0,2,0,0,0,0|1,1,0]=4 4103 B12R1.121 CSCNc1ccccc1CO 2ef658cabcf2ad3765644bc53474e60e [0,2,0,0,0,0|1,1,0]=4 4104 B12R1.121 CSCNc1ccccc1CS c0e148c9c24230b0dbcff6121081cca5 [0,2,0,0,0,0|1,1,0]=4 4105 B12R1.121 CSCNc1ccccc1SC e813bb9650a995d186c06f3ff8214956 [0,2,0,0,0,0|1,1,0]=4 4106 B12R1.121 CSCOc1ccccc1C#N 8038f85266719812f20e65f1d3cb2290 [0,2,0,0,0,0|1,1,0]=4 4107 B12R1.121 CSCOc1ccccc1C=O 3a3adafb01ffc02caa6ffe802d0fd229 [0,2,0,0,0,0|1,1,0]=4 4108 B12R1.121 CSCOc1ccccc1SC c9916d7b3422d2ac3675f18dfeae3624 [0,2,0,0,0,0|1,1,0]=4 4109 B12R1.125 C=C(C)CNc1ccccc1C 0775997f92f40e132d20ea5fe7bd037c [0,2,0,0,0,0|2,0,0]=4 4110 B12R1.125 C=C(C)CNc1ccccc1Cl a75535e95522e1719e06cc6979b758b3 [0,2,0,0,0,0|2,0,0]=4 4111 B12R1.125 C=C(C)CNc1ccccc1F 9b7c12d4b75b7be7a150f8ba427b5f42 [0,2,0,0,0,0|2,0,0]=4 4112 B12R1.125 C=C(C)CNc1ccccc1I f6467f3a4a3ed6a797fa030b9ae4ec92 [0,2,0,0,0,0|2,0,0]=4 4113 B12R1.125 C=C(C)CNc1ccccc1S 9590615441677828468f9996a31408ce [0,2,0,0,0,0|2,0,0]=4 4114 B12R1.125 C=C(C)COc1ccccc1C 50941d3358717591e5c55d30412cbebf [0,2,0,0,0,0|2,0,0]=4 4115 B12R1.125 C=C(C)COc1ccccc1Cl c433224d4376530c43d1e8a4447f9529 [0,2,0,0,0,0|2,0,0]=4 4116 B12R1.125 C=C(C)COc1ccccc1F 20b0d2b9bf3e175b0ffacf7761f1d330 [0,2,0,0,0,0|2,0,0]=4 4117 B12R1.125 C=C(C)COc1ccccc1I f8be04256775a295a8c22cdfbdfac3ce [0,2,0,0,0,0|2,0,0]=4 4118 B12R1.125 CC(=O)CNc1ccccc1C 6c131824b73be3bd14e6342145d37cb4 [0,2,0,0,0,0|2,0,0]=4 4119 B12R1.125 CC(=O)CNc1ccccc1F 9434eaabf0739c357d09cdea72164c56 [0,2,0,0,0,0|2,0,0]=4 4120 B12R1.125 CC(=O)NCc1ccccc1Br c47d1b381faeb3750f6d77f8a6825780 [0,2,0,0,0,0|2,0,0]=4 4121 B12R1.125 CC(=O)NCc1ccccc1C 878373bfe1c9994e38f6b300a4c7508f [0,2,0,0,0,0|2,0,0]=4 4122 B12R1.125 CC(=O)NCc1ccccc1Cl b19ee0daad189de3f536de6cee918157 [0,2,0,0,0,0|2,0,0]=4 4123 B12R1.125 CC(=O)NCc1ccccc1F 7cb30f4a5a9e7b6ebe7ffa0ec755e5d6 [0,2,0,0,0,0|2,0,0]=4 4124 B12R1.125 CC(=O)NCc1ccccc1I 3fdc9f6ca170895ba3e43a993004cbe3 [0,2,0,0,0,0|2,0,0]=4 4125 B12R1.125 CC(=O)NCc1ccccc1O 0586c5299a3d61253924ffc29f47c091 [0,2,0,0,0,0|2,0,0]=4 4126 B12R1.125 CC(C)CNc1ccccc1Br 97dcb5c3c65ce65124839fce143060ed [0,2,0,0,0,0|2,0,0]=4 4127 B12R1.125 CC(C)CNc1ccccc1Cl 75d6f72f33e1b81eaa5975119e7851a7 [0,2,0,0,0,0|2,0,0]=4 4128 B12R1.125 CC(C)CNc1ccccc1F 1f6d990d4611c55e81ba435b4de3227f [0,2,0,0,0,0|2,0,0]=4 4129 B12R1.125 CC(C)CNc1ccccc1I 8137d11aab68af4ff87c3b0c458aeadf [0,2,0,0,0,0|2,0,0]=4 4130 B12R1.125 CC(C)CNc1ccccc1S abeaa0222adaeba5cb90e228335806a0 [0,2,0,0,0,0|2,0,0]=4 4131 B12R1.125 CC(C)COc1ccccc1Br 15e4cd0efed59b74bb1886c65548b9ce [0,2,0,0,0,0|2,0,0]=4 4132 B12R1.125 CC(C)COc1ccccc1Cl ec2a4d693a1f337c73c825dab32a22e8 [0,2,0,0,0,0|2,0,0]=4 4133 B12R1.125 CC(C)COc1ccccc1F 3d250d7b85e326d2d954c337a0f1907d [0,2,0,0,0,0|2,0,0]=4 4134 B12R1.125 CC(C)COc1ccccc1I 179013c2eef1a81cfd9d0470359a57c5 [0,2,0,0,0,0|2,0,0]=4 4135 B12R1.125 CC(C)COc1ccccc1S 3c07cbd446137458a8a811b24d5966d2 [0,2,0,0,0,0|2,0,0]=4 4136 B12R1.125 CC(C)NCc1ccccc1Cl 9b9897219917fd3530700a473a4db4bc [0,2,0,0,0,0|2,0,0]=4 4137 B12R1.125 CC(C)NCc1ccccc1F 22106e2f6b32da238c4d16ecaebf9107 [0,2,0,0,0,0|2,0,0]=4 4138 B12R1.125 CC(C)NCc1ccccc1I 3b248e8d40a66b793c94674298302a5d [0,2,0,0,0,0|2,0,0]=4 4139 B12R1.125 CC(C)OCc1ccccc1Cl f1d0578f20039107ab7831c744270352 [0,2,0,0,0,0|2,0,0]=4 4140 B12R1.125 CC(C)OCc1ccccc1F 88ffe0c3ffb1a7712dee49c51d8757cb [0,2,0,0,0,0|2,0,0]=4 4141 B12R1.125 CC(C)OCc1ccccc1I 091e4f6992ab541edd05dc5206b2152a [0,2,0,0,0,0|2,0,0]=4 4142 B12R1.125 CC(O)CNc1ccccc1Br 4a8178895a974705dd8c5d47896d821f [0,2,0,0,0,0|2,0,0]=4 4143 B12R1.125 CC(O)CNc1ccccc1Cl 18a1aeb377915ff3d7752e638825109f [0,2,0,0,0,0|2,0,0]=4 4144 B12R1.125 CC(O)CNc1ccccc1F 2118f4d689b50b2f5bf4fe77b0346bb5 [0,2,0,0,0,0|2,0,0]=4 4145 B12R1.125 CC(O)CNc1ccccc1I 4ba68e475ff4710ffb78d3e623e4dd83 [0,2,0,0,0,0|2,0,0]=4 4146 B12R1.125 CC(O)CNc1ccccc1S c9cd17787d858b75a205fbdc344be6ff [0,2,0,0,0,0|2,0,0]=4 4147 B12R1.125 CN(C)CNc1ccccc1I 9db091b00fc74cd0330b59002f1d7c8a [0,2,0,0,0,0|2,0,0]=4 4148 B12R1.125 CN(C)COc1ccccc1Cl 97615d5e6a9b6d2759b55d0ad129882e [0,2,0,0,0,0|2,0,0]=4 4149 B12R1.125 CN(C)COc1ccccc1F d924d84b19d4fe40db67235213a44035 [0,2,0,0,0,0|2,0,0]=4 4150 B12R1.125 CN(C)COc1ccccc1I 6002f90dd33e7c9d3ab5ef7fc55225a1 [0,2,0,0,0,0|2,0,0]=4 4151 B12R1.125 C[C@@H](O)CNc1ccccc1I 9fbcb093ddb932bd7f24eaa426a08c17 [0,2,0,0,0,0|2,0,0]=4 4152 B12R1.125 C[C@H](O)CNc1ccccc1Br c817d086f8954ccab620e5f4c72375d6 [0,2,0,0,0,0|2,0,0]=4 4153 B12R1.125 C[C@H](O)CNc1ccccc1Cl 764c54c7fa40fe5604a3aadd5e4b8400 [0,2,0,0,0,0|2,0,0]=4 4154 B12R1.125 C[C@H](O)CNc1ccccc1F 215b77315898b180d735c74dedf26562 [0,2,0,0,0,0|2,0,0]=4 4155 B12R1.125 C[C@H](O)CNc1ccccc1I a750a87f3e2f024043f4659d08af95be [0,2,0,0,0,0|2,0,0]=4 4156 B12R1.125 C[C@H](O)CNc1ccccc1S a2817a071e3134750611d07f0df977a7 [0,2,0,0,0,0|2,0,0]=4 4157 B12R1.125 Cc1ccccc1CNC(C)C 2dd08d80be2d3e51d4d72fed96629045 [0,2,0,0,0,0|2,0,0]=4 4158 B12R1.125 Cc1ccccc1NCC(C)C 1586ab8e64ea906befcc8bbfad124462 [0,2,0,0,0,0|2,0,0]=4 4159 B12R1.125 Cc1ccccc1NCC(C)O 31ba569e9dedf1c2e9bd352e34766cab [0,2,0,0,0,0|2,0,0]=4 4160 B12R1.125 Cc1ccccc1NC[C@H](C)O f7931a4967f5c286879c882148e8589e [0,2,0,0,0,0|2,0,0]=4 4161 B12R1.125 Cc1ccccc1OCC(C)C 364254b27b947c9392bf52594b3dc819 [0,2,0,0,0,0|2,0,0]=4 4162 B12R1.125 Cc1ccccc1OCN(C)C 352a0cc9d2eab6580b092e8e3f27bcfa [0,2,0,0,0,0|2,0,0]=4 4163 B12R1.267 BrCCNCc1ccccc1Br ea0d11cb5c5c05c8b45872fc9f05fc12 [0,2,0,0,0,0|2,0,0]=4 4164 B12R1.267 BrCCNCc1ccccc1I 3038a426aa86f4dfd543210d91b43629 [0,2,0,0,0,0|2,0,0]=4 4165 B12R1.267 Brc1ccccc1CNCCI 5143974bbc0a4a35871e2c83139b8e6b [0,2,0,0,0,0|2,0,0]=4 4166 B12R1.267 C#CCCNc1ccccc1Br e99ee8faed098a30a20e4543adc72564 [0,2,0,0,0,0|1,0,1]=4 4167 B12R1.267 C#CCCNc1ccccc1C 7b91fff16f002b988a860bdffd824f2a [0,2,0,0,0,0|1,0,1]=4 4168 B12R1.267 C#CCCNc1ccccc1Cl 88b9d9cb585a576e2079107494fcee66 [0,2,0,0,0,0|1,0,1]=4 4169 B12R1.267 C#CCCNc1ccccc1F b048093680a2502ae4f1b1c3689764ed [0,2,0,0,0,0|1,0,1]=4 4170 B12R1.267 C#CCCNc1ccccc1I fbc516c9eed9fbf54f019a859d2077a0 [0,2,0,0,0,0|1,0,1]=4 4171 B12R1.267 C#CCCNc1ccccc1S 80b6e789e399bac493c4ad0b2c63a5b7 [0,2,0,0,0,0|1,0,1]=4 4172 B12R1.267 C#CCCOc1ccccc1Br a24b1a7316c03d04d404ca316241e951 [0,2,0,0,0,0|1,0,1]=4 4173 B12R1.267 C#CCCOc1ccccc1C b751150d5bc7ae146a3aa4c826abad34 [0,2,0,0,0,0|1,0,1]=4 4174 B12R1.267 C#CCCOc1ccccc1Cl 66409daa86b274decf22c7bf39bd7138 [0,2,0,0,0,0|1,0,1]=4 4175 B12R1.267 C#CCCOc1ccccc1F 9ea9985df54b44e911cf1679054b43ea [0,2,0,0,0,0|1,0,1]=4 4176 B12R1.267 C#CCCOc1ccccc1I 6b12c1ea7962b2ef6d8403a2d04626e0 [0,2,0,0,0,0|1,0,1]=4 4177 B12R1.267 C#CCCOc1ccccc1S 897b0d776dba6571828fe7259a339779 [0,2,0,0,0,0|1,0,1]=4 4178 B12R1.267 C#CCNCc1ccccc1Br 290636e06aed55d8daf9b4cc70a881d0 [0,2,0,0,0,0|1,0,1]=4 4179 B12R1.267 C#CCNCc1ccccc1C a4e8363e27dd69d5d0243711625b7797 [0,2,0,0,0,0|1,0,1]=4 4180 B12R1.267 C#CCNCc1ccccc1Cl 221424104cfc0276d806a90288ca9cf9 [0,2,0,0,0,0|1,0,1]=4 4181 B12R1.267 C#CCNCc1ccccc1F 9359b9c024e43f001589a3229b22e816 [0,2,0,0,0,0|1,0,1]=4 4182 B12R1.267 C#CCNCc1ccccc1I f1ea9f3bd393ef3d2d91751ad07726ef [0,2,0,0,0,0|1,0,1]=4 4183 B12R1.267 C#CCOCc1ccccc1Br 02af93d779ad1b8b4cd2ff766919dc84 [0,2,0,0,0,0|1,0,1]=4 4184 B12R1.267 C#CCOCc1ccccc1C 5cadd4cf6bf6ebf0827ad3b0fd736fa5 [0,2,0,0,0,0|1,0,1]=4 4185 B12R1.267 C#CCOCc1ccccc1Cl 53fc0b65bab9a8d60ac954d25b4b1ea0 [0,2,0,0,0,0|1,0,1]=4 4186 B12R1.267 C#CCOCc1ccccc1F 402ebd1249a1d782d87717c4b015d4d8 [0,2,0,0,0,0|1,0,1]=4 4187 B12R1.267 C#CCOCc1ccccc1I b55237ad33efad3e40be49809e0bd348 [0,2,0,0,0,0|1,0,1]=4 4188 B12R1.267 C/C=C/CNc1ccccc1Br 1b1907df2d5024aed3e5fa69aedb3399 [0,2,0,0,0,0|1,0,1]=4 4189 B12R1.267 C/C=C/CNc1ccccc1C 99bc8a92ed1ace18679e2408606f3364 [0,2,0,0,0,0|1,0,1]=4 4190 B12R1.267 C/C=C/CNc1ccccc1Cl 6b5a5b022e1d490dd80391bad8af9890 [0,2,0,0,0,0|1,0,1]=4 4191 B12R1.267 C/C=C/CNc1ccccc1F 6722666f90dcd08cc17b2edda7c201e3 [0,2,0,0,0,0|1,0,1]=4 4192 B12R1.267 C/C=C/CNc1ccccc1I 49dad7c25cffd7a1fc830aed30c417c9 [0,2,0,0,0,0|1,0,1]=4 4193 B12R1.267 C/C=C/CNc1ccccc1S 2374179c00abf478a6f20c040c57b480 [0,2,0,0,0,0|1,0,1]=4 4194 B12R1.267 C/C=C/COc1ccccc1C dce1e2cf7549461e4472af0213bfe590 [0,2,0,0,0,0|1,0,1]=4 4195 B12R1.267 C/C=C/COc1ccccc1Cl d7378b9e9abba0a516538c31d2b8033d [0,2,0,0,0,0|1,0,1]=4 4196 B12R1.267 C/C=C/COc1ccccc1F 3adf23b88e5fc6bf280a6f9579e77e44 [0,2,0,0,0,0|1,0,1]=4 4197 B12R1.267 C/C=C/COc1ccccc1I 3368be493448c94e00511e02f941b571 [0,2,0,0,0,0|1,0,1]=4 4198 B12R1.267 C/C=C/COc1ccccc1S b9a37410f6aada9716682d52f755badd [0,2,0,0,0,0|1,0,1]=4 4199 B12R1.267 C/C=C\CNc1ccccc1Br 66999467e4d202b0e15ddedfc78c2c39 [0,2,0,0,0,0|1,0,1]=4 4200 B12R1.267 C/C=C\CNc1ccccc1C 68ea7ffbacfbcab8c5090428fecdfc68 [0,2,0,0,0,0|1,0,1]=4 4201 B12R1.267 C/C=C\CNc1ccccc1Cl efe45a207a9960139db5dd6e97826898 [0,2,0,0,0,0|1,0,1]=4 4202 B12R1.267 C/C=C\CNc1ccccc1F ff86ec72e49dcd55ae6b06c76cc6d890 [0,2,0,0,0,0|1,0,1]=4 4203 B12R1.267 C/C=C\CNc1ccccc1I a7e533e5c4109b914c88f4a015f80ae5 [0,2,0,0,0,0|1,0,1]=4 4204 B12R1.267 C/C=C\CNc1ccccc1S 9e74280189a63b197c9248a0ace6ec62 [0,2,0,0,0,0|1,0,1]=4 4205 B12R1.267 C/C=C\COc1ccccc1C ce1881f33dc4a07b3ef4b747164c5783 [0,2,0,0,0,0|1,0,1]=4 4206 B12R1.267 C/C=C\COc1ccccc1Cl 10e650f8590a3ac746945d840030f3ed [0,2,0,0,0,0|1,0,1]=4 4207 B12R1.267 C/C=C\COc1ccccc1F 41a2eda3fc726edc1e07bdca36b547c4 [0,2,0,0,0,0|1,0,1]=4 4208 B12R1.267 C/C=C\COc1ccccc1I 7e2bb55094599bb6417c21b0ceb863ff [0,2,0,0,0,0|1,0,1]=4 4209 B12R1.267 C/C=C\COc1ccccc1S dc45afdce48633a6e4e7fef97f503194 [0,2,0,0,0,0|1,0,1]=4 4210 B12R1.267 C=CCCNc1ccccc1Br 37a7fd0bd7fb73f23c8f918b46b9e00c [0,2,0,0,0,0|1,0,1]=4 4211 B12R1.267 C=CCCNc1ccccc1C df541d63e20ff1c116138ad19eb821f4 [0,2,0,0,0,0|1,0,1]=4 4212 B12R1.267 C=CCCNc1ccccc1Cl a0986cb3e2e460867f9bc9125fc6dc09 [0,2,0,0,0,0|1,0,1]=4 4213 B12R1.267 C=CCCNc1ccccc1F c41512588e7636f6b55fec4094c7ad72 [0,2,0,0,0,0|1,0,1]=4 4214 B12R1.267 C=CCCNc1ccccc1I 57f61cd52776dda13451bca1590ece17 [0,2,0,0,0,0|1,0,1]=4 4215 B12R1.267 C=CCCNc1ccccc1S 2a7fe2b8fb0f8dcae837780f8598719a [0,2,0,0,0,0|1,0,1]=4 4216 B12R1.267 C=CCCOc1ccccc1Br 912ba6f5ea076bb94894ddede7775d48 [0,2,0,0,0,0|1,0,1]=4 4217 B12R1.267 C=CCCOc1ccccc1C 241fe2af7be327e5af96bf7976d61a5a [0,2,0,0,0,0|1,0,1]=4 4218 B12R1.267 C=CCCOc1ccccc1Cl 821f7bb8c5893e8d97ca0bf08715e3c8 [0,2,0,0,0,0|1,0,1]=4 4219 B12R1.267 C=CCCOc1ccccc1F 788f3585adbc4871182c6b62bcae45ef [0,2,0,0,0,0|1,0,1]=4 4220 B12R1.267 C=CCCOc1ccccc1I 83e53f288002a399103dbbf327de6c80 [0,2,0,0,0,0|1,0,1]=4 4221 B12R1.267 C=CCCOc1ccccc1S 9bb43c6a9949b6d42cef7fe85af51343 [0,2,0,0,0,0|1,0,1]=4 4222 B12R1.267 C=CCNCc1ccccc1Br 1427f19506eac4250122ad8eb8782ad8 [0,2,0,0,0,0|1,0,1]=4 4223 B12R1.267 C=CCNCc1ccccc1C fdca27cc064dcbff6c80b19514d79643 [0,2,0,0,0,0|1,0,1]=4 4224 B12R1.267 C=CCNCc1ccccc1Cl f859a02c3c0d2bc519b3b361ed756b5b [0,2,0,0,0,0|1,0,1]=4 4225 B12R1.267 C=CCNCc1ccccc1F 924890df5ab55f0cda74e162fedc9f64 [0,2,0,0,0,0|1,0,1]=4 4226 B12R1.267 C=CCNCc1ccccc1I db3860688a2053d29699e8b13de354d4 [0,2,0,0,0,0|1,0,1]=4 4227 B12R1.267 C=CCOCc1ccccc1Br d3ccb12e49f9287b3b352ec14ea604a0 [0,2,0,0,0,0|1,0,1]=4 4228 B12R1.267 C=CCOCc1ccccc1C 0af9f2a13fc908e1713936563825fe88 [0,2,0,0,0,0|1,0,1]=4 4229 B12R1.267 C=CCOCc1ccccc1Cl 5e72d63283f15a5f9f88481b2d7a5881 [0,2,0,0,0,0|1,0,1]=4 4230 B12R1.267 C=CCOCc1ccccc1F e896fbf9700438cc2bfe31e7ca31924d [0,2,0,0,0,0|1,0,1]=4 4231 B12R1.267 C=CCOCc1ccccc1I e2f2661b91523d2d144da1c77858b612 [0,2,0,0,0,0|1,0,1]=4 4232 B12R1.267 C=CCOCc1ccccc1S 5a033e245e84f0f30931cdda7bbfa848 [0,2,0,0,0,0|1,0,1]=4 4233 B12R1.267 CC=CCNc1ccccc1C 6c625ce9f8fd51bea675332d8ecee0b4 [0,2,0,0,0,0|1,0,1]=4 4234 B12R1.267 CC=CCNc1ccccc1F e8f3a2326d77bcea4cf09a84df5021da [0,2,0,0,0,0|1,0,1]=4 4235 B12R1.267 CC=CCNc1ccccc1S a4a486a387cb1ddad9a45b70356617a7 [0,2,0,0,0,0|1,0,1]=4 4236 B12R1.267 CCCCNc1c[nH]ccc1=O 2171ac1739f21a07081f9ae550f8b6ac [0,2,0,0,0,0|2,0,0]=4 4237 B12R1.267 CCCCNc1c[nH]ccc1=S 80de505aef21eb5fa7069124342902d9 [0,2,0,0,0,0|2,0,0]=4 4238 B12R1.267 CCCCNc1ccc[nH]c1=O ce3e3dbadb26f7436b51db73de858518 [0,2,0,0,0,0|2,0,0]=4 4239 B12R1.267 CCCCNc1ccc[nH]c1=S b876b48cd50df01bff05030a1adde4c2 [0,2,0,0,0,0|2,0,0]=4 4240 B12R1.267 CCCCNc1cccc[n+]1[O-] 3d4bcbc977ce2351df47fd6e0e521d2c [0,2,0,0,0,0|2,0,0]=4 4241 B12R1.267 CCCCNc1ccccc1C cb964fe2d8cfd23c2726cd74a242470b [0,2,0,0,0,0|1,0,0]=3 4242 B12R1.267 CCCCNc1ccccc1Cl 6e7205e8041766fa9aa32cc4e4316fea [0,2,0,0,0,0|1,0,0]=3 4243 B12R1.267 CCCCNc1ccccc1F 93bd26ef4df061c2dc223f5480ce42a3 [0,2,0,0,0,0|1,0,0]=3 4244 B12R1.267 CCCCNc1ccccc1I 8f5af43ba97bf9951ca4d8417a9a57f0 [0,2,0,0,0,0|1,0,0]=3 4245 B12R1.267 CCCCNc1cccnc1Br d3fec478ced1ff0ac4fbfdd57afe172f [0,2,0,0,0,0|2,0,0]=4 4246 B12R1.267 CCCCNc1cccnc1C fad811ff1fa797428fe957bb5e80f5b5 [0,2,0,0,0,0|2,0,0]=4 4247 B12R1.267 CCCCNc1cccnc1Cl ecd1cb3831f5cdfff9b8af4e60d6c2d2 [0,2,0,0,0,0|2,0,0]=4 4248 B12R1.267 CCCCNc1cccnc1F 7ba1ab80518b5062e828d488462f4a2a [0,2,0,0,0,0|2,0,0]=4 4249 B12R1.267 CCCCNc1cccnc1I 9e5a45eda318e7f3ec1ea2b2b4ca580d [0,2,0,0,0,0|2,0,0]=4 4250 B12R1.267 CCCCNc1ccncc1Br 38b090ca0fa5d237d5610ce2c8b20b98 [0,2,0,0,0,0|2,0,0]=4 4251 B12R1.267 CCCCNc1ccncc1C d67d07991761cc4a161bc3b26e7f4ef8 [0,2,0,0,0,0|2,0,0]=4 4252 B12R1.267 CCCCNc1ccncc1Cl 03f85acdcbfb67330f7a401e47a86f4c [0,2,0,0,0,0|2,0,0]=4 4253 B12R1.267 CCCCNc1ccncc1F aad2d25647de24e38769f9c56e6ccf17 [0,2,0,0,0,0|2,0,0]=4 4254 B12R1.267 CCCCNc1ccncc1I 2b4fd0f3bfb9485f6b76852afd0c3b7b [0,2,0,0,0,0|2,0,0]=4 4255 B12R1.267 CCCCNc1cnccc1Br 46f073a4eb1bd7b603173a59f49e462f [0,2,0,0,0,0|2,0,0]=4 4256 B12R1.267 CCCCNc1cnccc1C d787f90e53c25369bc2f084e970b28cf [0,2,0,0,0,0|2,0,0]=4 4257 B12R1.267 CCCCNc1cnccc1Cl 7a5121c3fe1c8fc7bff0ae3db1f40f96 [0,2,0,0,0,0|2,0,0]=4 4258 B12R1.267 CCCCNc1cnccc1F 8064f0adec282f6830fdf8a889ea69a6 [0,2,0,0,0,0|2,0,0]=4 4259 B12R1.267 CCCCNc1cnccc1I fae1a251059b35a37690087eeb65c0aa [0,2,0,0,0,0|2,0,0]=4 4260 B12R1.267 CCCCNc1ncccc1Br 98d92c92f32632a244bed8738209b7df [0,2,0,0,0,0|2,0,0]=4 4261 B12R1.267 CCCCNc1ncccc1C 2e45a4067d865d7da64955a121039499 [0,2,0,0,0,0|2,0,0]=4 4262 B12R1.267 CCCCNc1ncccc1Cl ed6b56853a49eb692493900894acd752 [0,2,0,0,0,0|2,0,0]=4 4263 B12R1.267 CCCCNc1ncccc1F 58ff30c99c1396a51f881d44eff8cf3a [0,2,0,0,0,0|2,0,0]=4 4264 B12R1.267 CCCCNc1ncccc1I 88b4e5d654855dc8008f4dd0d3d049d8 [0,2,0,0,0,0|2,0,0]=4 4265 B12R1.267 CCCCOc1ccc[nH]c1=S 1acec24485cc03175cb8a8431599b7e2 [0,2,0,0,0,0|2,0,0]=4 4266 B12R1.267 CCCCOc1cccc[n+]1[O-] d61ca1438e8f234b267eec7da5f851e7 [0,2,0,0,0,0|2,0,0]=4 4267 B12R1.267 CCCCOc1ccccc1Br bcff99237489f480dc72197e24e0097e [0,2,0,0,0,0|1,0,0]=3 4268 B12R1.267 CCCCOc1ccccc1C 803afc2ce1e6d5fa1371cac971668549 [0,2,0,0,0,0|1,0,0]=3 4269 B12R1.267 CCCCOc1ccccc1Cl 6c2563b268f47d5f170b183906091886 [0,2,0,0,0,0|1,0,0]=3 4270 B12R1.267 CCCCOc1ccccc1F 9ca00bd7723e1d9e4d21ded7a0988504 [0,2,0,0,0,0|1,0,0]=3 4271 B12R1.267 CCCCOc1ccccc1I 08781f94c441e6933e92e36c0080d909 [0,2,0,0,0,0|1,0,0]=3 4272 B12R1.267 CCCCOc1ccccc1S 9afce9d077af63044cd79db09184fde8 [0,2,0,0,0,0|1,0,0]=3 4273 B12R1.267 CCCCOc1cccnc1Br e5d363c5971461c9fcf629544bab4835 [0,2,0,0,0,0|2,0,0]=4 4274 B12R1.267 CCCCOc1cccnc1C 84e9fdf2bba58872ffe7a46a67662b35 [0,2,0,0,0,0|2,0,0]=4 4275 B12R1.267 CCCCOc1cccnc1Cl 9c008ed381bbb5af2ccef6dd0c23af47 [0,2,0,0,0,0|2,0,0]=4 4276 B12R1.267 CCCCOc1cccnc1F 672bde3c259012fccfe4ad9ca0ceb365 [0,2,0,0,0,0|2,0,0]=4 4277 B12R1.267 CCCCOc1cccnc1I e5ef7f49bc226e5a4fad393c87867486 [0,2,0,0,0,0|2,0,0]=4 4278 B12R1.267 CCCCOc1cccoc1=O fbc49b8367347726350d6c0059a469cb [0,2,0,0,0,0|2,0,0]=4 4279 B12R1.267 CCCCOc1ccncc1Br aee52df2a25f5eb47bdb9a5385ff595e [0,2,0,0,0,0|2,0,0]=4 4280 B12R1.267 CCCCOc1ccncc1C a8a96a8ae5494e782a1db105dc9138fd [0,2,0,0,0,0|2,0,0]=4 4281 B12R1.267 CCCCOc1ccncc1Cl 556a29a7e2ccee3abfdcecfbab9cf385 [0,2,0,0,0,0|2,0,0]=4 4282 B12R1.267 CCCCOc1ccncc1F 91a66c1733d087c0353d655137a8cc68 [0,2,0,0,0,0|2,0,0]=4 4283 B12R1.267 CCCCOc1cnccc1Br 15aeb91f2b6964d7a4aa2b0cdf8bfd7b [0,2,0,0,0,0|2,0,0]=4 4284 B12R1.267 CCCCOc1cnccc1C 3b15574ad4f3c24340def9d6fb0c9767 [0,2,0,0,0,0|2,0,0]=4 4285 B12R1.267 CCCCOc1cnccc1Cl 90c5da1d6f50a5ee2172bbaea5ccf31b [0,2,0,0,0,0|2,0,0]=4 4286 B12R1.267 CCCCOc1cnccc1F c551281e572f34bcd577ada96b64037e [0,2,0,0,0,0|2,0,0]=4 4287 B12R1.267 CCCCOc1cnccc1I 211b8ac06e4b1aba8882b53002ac707f [0,2,0,0,0,0|2,0,0]=4 4288 B12R1.267 CCCCOc1coccc1=O 04c68206066ebe73f7acc5e776ca1f43 [0,2,0,0,0,0|2,0,0]=4 4289 B12R1.267 CCCCOc1ncccc1Br ab5e0f1b04532e99ed34495b6176c96c [0,2,0,0,0,0|2,0,0]=4 4290 B12R1.267 CCCCOc1ncccc1C 9acd3db19edc794136930ecc9d37d4c9 [0,2,0,0,0,0|2,0,0]=4 4291 B12R1.267 CCCCOc1ncccc1Cl 9da828dc387ebb2b2a0c22f9935c3aab [0,2,0,0,0,0|2,0,0]=4 4292 B12R1.267 CCCCOc1ncccc1F c7e9db1d1b3a07ca21a548585494e143 [0,2,0,0,0,0|2,0,0]=4 4293 B12R1.267 CCCCOn1ccccc1=N 32ad87ebf11ce06103d90b026c61e876 [0,2,0,0,0,0|2,0,0]=4 4294 B12R1.267 CCCCOn1ccccc1=O 42c813425d770bfeb2151f1fa43ba34c [0,2,0,0,0,0|2,0,0]=4 4295 B12R1.267 CCCCOn1ccccc1=S c288e4f8eec520decee2174f91202f93 [0,2,0,0,0,0|2,0,0]=4 4296 B12R1.267 CCCNCc1cccc[n+]1[O-] 3f8d2f3f831024e14ee84f8df0789f0c [0,2,0,0,0,0|2,0,0]=4 4297 B12R1.267 CCCNCc1ccccc1Br bd58bf891f73040a234956b6adaf58b7 [0,2,0,0,0,0|1,0,0]=3 4298 B12R1.267 CCCNCc1ccccc1C 050fe1959a544b7272683da7815962b7 [0,2,0,0,0,0|1,0,0]=3 4299 B12R1.267 CCCNCc1ccccc1Cl 9af8efc228c85cb32fd226498427ad88 [0,2,0,0,0,0|1,0,0]=3 4300 B12R1.267 CCCNCc1ccccc1F 10db1bdfdcada70cdd61f937a45d1f2e [0,2,0,0,0,0|1,0,0]=3 4301 B12R1.267 CCCNCc1ccccc1I a2ce2cbd3d3a9276a9c0f47a371bdac6 [0,2,0,0,0,0|1,0,0]=3 4302 B12R1.267 CCCNCc1cccnc1Br 402a94c70b6d2183e3d722edecb4a5f9 [0,2,0,0,0,0|2,0,0]=4 4303 B12R1.267 CCCNCc1cccnc1C e1b1b5a8410f06279070c8edcdf17240 [0,2,0,0,0,0|2,0,0]=4 4304 B12R1.267 CCCNCc1cccnc1Cl ab3826b70237d838a83d352eac3e41d3 [0,2,0,0,0,0|2,0,0]=4 4305 B12R1.267 CCCNCc1cccnc1F 199c5897eca11fa291c050d6993ed7e7 [0,2,0,0,0,0|2,0,0]=4 4306 B12R1.267 CCCNCc1ccncc1Br e9f9882823e68b48ae4a932d82f6ad11 [0,2,0,0,0,0|2,0,0]=4 4307 B12R1.267 CCCNCc1ccncc1C 2ed7bb25324af023967144bd7385c902 [0,2,0,0,0,0|2,0,0]=4 4308 B12R1.267 CCCNCc1ccncc1Cl ce9529e88997d3947366216f8c47ea6d [0,2,0,0,0,0|2,0,0]=4 4309 B12R1.267 CCCNCc1ccncc1F 527f173d2b758d4a87007c0ecef48b68 [0,2,0,0,0,0|2,0,0]=4 4310 B12R1.267 CCCNCc1cnccc1C 9bead837e92e04248f1f4a17f6bc75bc [0,2,0,0,0,0|2,0,0]=4 4311 B12R1.267 CCCNCc1ncccc1Br 0ca0f3c5a94b1d72a0af3e923ae6aade [0,2,0,0,0,0|2,0,0]=4 4312 B12R1.267 CCCNCc1ncccc1C d2df36c8f920a1d0503e8cfb0b483277 [0,2,0,0,0,0|2,0,0]=4 4313 B12R1.267 CCCNCc1ncccc1Cl 47e4a918c94fbfb20ad65d8ee4ca972e [0,2,0,0,0,0|2,0,0]=4 4314 B12R1.267 CCCNCc1ncccc1F 4525c38f95b8d93501c447beaff3a3d5 [0,2,0,0,0,0|2,0,0]=4 4315 B12R1.267 CCCOCc1ccc[nH]c1=O e6acbb43398249bcbb739562d726fb3f [0,2,0,0,0,0|2,0,0]=4 4316 B12R1.267 CCCOCc1cccc[n+]1[O-] 61cbe915a919e734a4bcd748d3747d59 [0,2,0,0,0,0|2,0,0]=4 4317 B12R1.267 CCCOCc1ccccc1C 69819a6d99087ea23f1233c6ad1452d2 [0,2,0,0,0,0|1,0,0]=3 4318 B12R1.267 CCCOCc1ccccc1Cl be8fb5e4d0358fc76e083c2c1033dd16 [0,2,0,0,0,0|1,0,0]=3 4319 B12R1.267 CCCOCc1ccccc1F 817daa4caad3d25d218a0e50ef2066fb [0,2,0,0,0,0|1,0,0]=3 4320 B12R1.267 CCCOCc1ccccc1I ce9ddc1d6dd0a2595b0faa5a82ad4942 [0,2,0,0,0,0|1,0,0]=3 4321 B12R1.267 CCCOCc1cccnc1Br 77809bbe385de5a43b12b367d88c71a2 [0,2,0,0,0,0|2,0,0]=4 4322 B12R1.267 CCCOCc1cccnc1C 80f08444768dce951386843ce88fb151 [0,2,0,0,0,0|2,0,0]=4 4323 B12R1.267 CCCOCc1cccnc1Cl 4c16458fea46acd0246b70a5f4d58119 [0,2,0,0,0,0|2,0,0]=4 4324 B12R1.267 CCCOCc1cccnc1F 82e1bbfcda2532af7c2d1073e1466af8 [0,2,0,0,0,0|2,0,0]=4 4325 B12R1.267 CCCOCc1ccncc1Br 64b6d1df5b4d11360abcef9177275c27 [0,2,0,0,0,0|2,0,0]=4 4326 B12R1.267 CCCOCc1ccncc1C 7735e31f03b9348d7e7ebc447c03a04d [0,2,0,0,0,0|2,0,0]=4 4327 B12R1.267 CCCOCc1ccncc1Cl 7f115ca68f6129d35dde1f6128d24c23 [0,2,0,0,0,0|2,0,0]=4 4328 B12R1.267 CCCOCc1ccncc1F 54874f40bf1842d019ae5aa557cd3f64 [0,2,0,0,0,0|2,0,0]=4 4329 B12R1.267 CCCOCc1ccncc1I f9ecfd2dc90caa129d74ba3aa4f216e8 [0,2,0,0,0,0|2,0,0]=4 4330 B12R1.267 CCCOCc1cnccc1Br 1cf6735153beedc757fd6466847c1e0e [0,2,0,0,0,0|2,0,0]=4 4331 B12R1.267 CCCOCc1cnccc1C c5527632473ce43017a4a07048be0b6b [0,2,0,0,0,0|2,0,0]=4 4332 B12R1.267 CCCOCc1cnccc1Cl f11ef4b144489d3c93bb53cdc9f987d4 [0,2,0,0,0,0|2,0,0]=4 4333 B12R1.267 CCCOCc1cnccc1F f2cab6e6a0e3930495040aa86cc52368 [0,2,0,0,0,0|2,0,0]=4 4334 B12R1.267 CCCOCc1ncccc1Br 295e33b84a30fea5fd13900f16d144d8 [0,2,0,0,0,0|2,0,0]=4 4335 B12R1.267 CCCOCc1ncccc1C 7c546d71a2c0070eaea514043b7c3a08 [0,2,0,0,0,0|2,0,0]=4 4336 B12R1.267 CCCOCc1ncccc1Cl 1fac8383dbf1b1b1da43cedc31f90683 [0,2,0,0,0,0|2,0,0]=4 4337 B12R1.267 CCCOCc1ncccc1F 6d94624a107964647d0429a2132b9543 [0,2,0,0,0,0|2,0,0]=4 4338 B12R1.267 CCNCCc1ccccc1Cl b462d134ed26b2145f2b3576e4d12230 [0,2,0,0,0,0|1,0,0]=3 4339 B12R1.267 CCNCCc1ccccc1F dee7dcb89926d867dd249445cc929612 [0,2,0,0,0,0|1,0,0]=3 4340 B12R1.267 CCNCCc1ncccc1Br bb73543459a8b8f22656304c282b7a20 [0,2,0,0,0,0|2,0,0]=4 4341 B12R1.267 CCNCCc1ncccc1C 07ded1235abe1d390563f675a302acd3 [0,2,0,0,0,0|2,0,0]=4 4342 B12R1.267 CCNCCn1ccccc1=O 506f5f99c13f40cbc85b2b5102c6d01d [0,2,0,0,0,0|2,0,0]=4 4343 B12R1.267 CCOCCc1ccccc1Br ff423992d371a6fc4a4fd1c88d225519 [0,2,0,0,0,0|0,0,0]=2 4344 B12R1.267 CCOCCc1ccccc1C 60652323b8b6e9b1615ced7c97b2a1b4 [0,2,0,0,0,0|0,0,0]=2 4345 B12R1.267 CCOCCc1ccccc1Cl 69a4003c1b2444e1ffe9dabcded8220b [0,2,0,0,0,0|0,0,0]=2 4346 B12R1.267 CCOCCc1ccccc1F afa3523c66ce915b25923508bd683d81 [0,2,0,0,0,0|0,0,0]=2 4347 B12R1.267 CCOCCc1ccccc1I e3f39fece90b0172c387ddafe972d300 [0,2,0,0,0,0|0,0,0]=2 4348 B12R1.267 CCOCCc1ccncc1C 12f02602e6c331f70a15f40f769e4ea0 [0,2,0,0,0,0|1,0,0]=3 4349 B12R1.267 CCOCCc1ccncc1Cl 153b4f71944f4bedd9c0b4b80c41a4ab [0,2,0,0,0,0|1,0,0]=3 4350 B12R1.267 CCOCCc1ccncc1F 79366eef9c9a11f0763ef0b6ad1ce70e [0,2,0,0,0,0|1,0,0]=3 4351 B12R1.267 CCOCCc1ncccc1C 60823763fced731daa123238a689e3bd [0,2,0,0,0,0|1,0,0]=3 4352 B12R1.267 CCOCCc1ncccc1F 245e4153f4e3b194e41a9f7498437fde [0,2,0,0,0,0|1,0,0]=3 4353 B12R1.267 CCOCCc1nccnc1C 9f8e6c6fd44ab07f126f6b6c2480ac15 [0,2,0,0,0,0|2,0,0]=4 4354 B12R1.267 CCOCCn1ccccc1=O a039d6e7a80464ced710f04fc1b35557 [0,2,0,0,0,0|1,0,0]=3 4355 B12R1.267 CCOCNc1ccc[nH]c1=S 07e84dbd26d50ce297a9fe715ec8c4c4 [0,2,0,0,0,0|2,0,0]=4 4356 B12R1.267 CCOCNc1cccc[n+]1[O-] cb8d5f8ad5e8347285b6b772cbc067a2 [0,2,0,0,0,0|2,0,0]=4 4357 B12R1.267 CCOCNc1ccccc1I fbeb8312a82b28075d0bb91d0bdb0eba [0,2,0,0,0,0|1,0,0]=3 4358 B12R1.267 CCOCNc1cccnc1Cl 05b5541f3deed008443d28602df3a3fa [0,2,0,0,0,0|2,0,0]=4 4359 B12R1.267 CCOCNc1cccnc1I 7198957508ce46204b0543282baa1ced [0,2,0,0,0,0|2,0,0]=4 4360 B12R1.267 CCOCNc1ccncc1Br 9e4ac7ab8ac59fb1fe618c430adf9738 [0,2,0,0,0,0|2,0,0]=4 4361 B12R1.267 CCOCNc1ccncc1C d0a9abe9171d22ef4695750cf6c938d2 [0,2,0,0,0,0|2,0,0]=4 4362 B12R1.267 CCOCNc1ccncc1Cl e3d7b223708d4752e2c9f14b389971e3 [0,2,0,0,0,0|2,0,0]=4 4363 B12R1.267 CCOCNc1ccncc1F 5d5e32ea2fd4af2054c6749853eda275 [0,2,0,0,0,0|2,0,0]=4 4364 B12R1.267 CCOCNc1ccncc1I cd4980eb72d854e570b93969a2c11534 [0,2,0,0,0,0|2,0,0]=4 4365 B12R1.267 CCOCNc1cnccc1Cl 79ed76bc330385f3b83a11981cc7026c [0,2,0,0,0,0|2,0,0]=4 4366 B12R1.267 CCOCNc1cnccc1F b99e272c5eeadd4ee629994b8384d74c [0,2,0,0,0,0|2,0,0]=4 4367 B12R1.267 CCOCNc1cnccc1I 3bbae25f2351bba880d69d37eeb295c0 [0,2,0,0,0,0|2,0,0]=4 4368 B12R1.267 CCOCNc1ncccc1C 1f685d81d3f859df9e58f8f944a4b304 [0,2,0,0,0,0|2,0,0]=4 4369 B12R1.267 CCOCNc1ncccc1Cl 0411c9ef6d0319e9e0e02be783c1cb7e [0,2,0,0,0,0|2,0,0]=4 4370 B12R1.267 CCOCNc1ncccc1F 9374d1017a94d26877185eb13c6ab442 [0,2,0,0,0,0|2,0,0]=4 4371 B12R1.267 CCOCNc1ncccc1I e42384bb9637818d304ad26d4cfc871b [0,2,0,0,0,0|2,0,0]=4 4372 B12R1.267 CCOCOc1ccc[nH]c1=S 83652f703edf32c8682b78ffc52d63ca [0,2,0,0,0,0|2,0,0]=4 4373 B12R1.267 CCOCOc1ccccc1Cl 6b95252f205acc38cec8fd01d15e5cbf [0,2,0,0,0,0|1,0,0]=3 4374 B12R1.267 CCOCOc1cccnc1C 52f0d792cc4bd394b081ed38b15ea88d [0,2,0,0,0,0|2,0,0]=4 4375 B12R1.267 CCOCOc1cccnc1Cl d56a5ea7e0628429e0080b1faf7f82d6 [0,2,0,0,0,0|2,0,0]=4 4376 B12R1.267 CCOCOc1cccnc1F 465e931d513826293c8056d88409acba [0,2,0,0,0,0|2,0,0]=4 4377 B12R1.267 CCOCOc1cccnc1I 4bbcbcf8e4dd7d930cdc60becccc659c [0,2,0,0,0,0|2,0,0]=4 4378 B12R1.267 CCOCOc1cccoc1=O 870e871cce2aa52fcff3a27787a39708 [0,2,0,0,0,0|2,0,0]=4 4379 B12R1.267 CCOCOc1ccncc1Br 11ef71e3c9b24aa5593a11a96ecb3f89 [0,2,0,0,0,0|2,0,0]=4 4380 B12R1.267 CCOCOc1ccncc1C bbd1d3eedc2657359139d80c36c41afa [0,2,0,0,0,0|2,0,0]=4 4381 B12R1.267 CCOCOc1ccncc1F aaa332df1f1d566e916f590324953a82 [0,2,0,0,0,0|2,0,0]=4 4382 B12R1.267 CCOCOc1cnccc1Br 090eeabba27de62fa14c838dca12df3e [0,2,0,0,0,0|2,0,0]=4 4383 B12R1.267 CCOCOc1cnccc1C ad8c2b04279cdcdbe39eea72352beb82 [0,2,0,0,0,0|2,0,0]=4 4384 B12R1.267 CCOCOc1cnccc1Cl 05a92c90b34b3981124ab77b7e0b6a47 [0,2,0,0,0,0|2,0,0]=4 4385 B12R1.267 CCOCOc1cnccc1F 108ba4c1ba94ad5f29526b3d3fe7f9e8 [0,2,0,0,0,0|2,0,0]=4 4386 B12R1.267 CCOCOc1cnccc1I 4cbc21eb162a30fa7e9abdba3fb31eec [0,2,0,0,0,0|2,0,0]=4 4387 B12R1.267 CCOCOc1coccc1=O 6d091e0aa79d1809e99b797ab53e864e [0,2,0,0,0,0|2,0,0]=4 4388 B12R1.267 CCOCOc1ncccc1C acbd9ed53ac05061c88f7da58dd009a7 [0,2,0,0,0,0|2,0,0]=4 4389 B12R1.267 CCOCOc1ncccc1Cl 584f12693ea71a0764fde3657daac85a [0,2,0,0,0,0|2,0,0]=4 4390 B12R1.267 CCOCOc1ncccc1F 26ba4e2cd1880e64b271c3653ca9aae2 [0,2,0,0,0,0|2,0,0]=4 4391 B12R1.267 CCOCOn1ccccc1=N b8904fbb499f7062372d90a7d45ec628 [0,2,0,0,0,0|2,0,0]=4 4392 B12R1.267 CCOCOn1ccccc1=O 3247c163b77fa2c903b7bc55fc56ffb7 [0,2,0,0,0,0|2,0,0]=4 4393 B12R1.267 CCOCOn1ccccc1=S 0744db47ca6539f8e94d77c6821d809f [0,2,0,0,0,0|2,0,0]=4 4394 B12R1.267 COCCNc1c[nH]ccc1=O 5a64cb0feeb3f3907e02bb41bdd00921 [0,2,0,0,0,0|1,0,0]=3 4395 B12R1.267 COCCNc1c[nH]cnc1=O ad768603114ec2001a21a4245f20c68e [0,2,0,0,0,0|2,0,0]=4 4396 B12R1.267 COCCNc1ccc[nH]c1=O 23981140f490b112dd10ce8f78b35177 [0,2,0,0,0,0|1,0,0]=3 4397 B12R1.267 COCCNc1ccc[nH]c1=S 4bd147468f63e2406d5017b6a9f79687 [0,2,0,0,0,0|1,0,0]=3 4398 B12R1.267 COCCNc1cccc[n+]1[O-] fc538a03217f606ae7256c7f87ff93b0 [0,2,0,0,0,0|1,0,0]=3 4399 B12R1.267 COCCNc1ccccc1Br 2316346ab9c88084bfe847f7f62a0e78 [0,2,0,0,0,0|0,0,0]=2 4400 B12R1.267 COCCNc1ccccc1C 440ffddaa1772446f34e221fdd9eff58 [0,2,0,0,0,0|0,0,0]=2 4401 B12R1.267 COCCNc1ccccc1Cl 22c9cd1bcd1ad7bf6603d76725704441 [0,2,0,0,0,0|0,0,0]=2 4402 B12R1.267 COCCNc1ccccc1F e1818d70eee674628d30c8a4457d7c70 [0,2,0,0,0,0|0,0,0]=2 4403 B12R1.267 COCCNc1ccccc1I d7458fd5683eab62e6e9336c5bd7b7d2 [0,2,0,0,0,0|0,0,0]=2 4404 B12R1.267 COCCNc1ccccc1S ac2543380377bc26937c025a96dacef0 [0,2,0,0,0,0|0,0,0]=2 4405 B12R1.267 COCCNc1cccnc1Br 747792772e88abc6da296b23685bea6f [0,2,0,0,0,0|1,0,0]=3 4406 B12R1.267 COCCNc1cccnc1C d23ab842ac36f14a95a3352e4019a462 [0,2,0,0,0,0|1,0,0]=3 4407 B12R1.267 COCCNc1cccnc1Cl 95660e59a08c74d3b0878847b2a2bd73 [0,2,0,0,0,0|1,0,0]=3 4408 B12R1.267 COCCNc1cccnc1F 033161dd296d783d2bb2aaf5041b8d91 [0,2,0,0,0,0|1,0,0]=3 4409 B12R1.267 COCCNc1cccnc1I 4ac1d7945aed099c7062922fc5d3188c [0,2,0,0,0,0|1,0,0]=3 4410 B12R1.267 COCCNc1cccoc1=O 2886e27aed05c7c028e8cf635348489e [0,2,0,0,0,0|1,0,0]=3 4411 B12R1.267 COCCNc1ccn[nH]c1=O 0221e9b424411684d162869a09a57736 [0,2,0,0,0,0|2,0,0]=4 4412 B12R1.267 COCCNc1ccn[nH]c1=S 7603ae0581740d768e718718c38bd0d5 [0,2,0,0,0,0|2,0,0]=4 4413 B12R1.267 COCCNc1ccncc1Br 52cf8bd877f1cedf8b7469bb1e158e7e [0,2,0,0,0,0|1,0,0]=3 4414 B12R1.267 COCCNc1ccncc1C 8946e86872fbb074a0aa8d067674f639 [0,2,0,0,0,0|1,0,0]=3 4415 B12R1.267 COCCNc1ccncc1Cl 3afbfa9103671ef8a5a75521e58eb37d [0,2,0,0,0,0|1,0,0]=3 4416 B12R1.267 COCCNc1ccncc1F ba8efa866652c20c2d8f7d6b18ee2fc6 [0,2,0,0,0,0|1,0,0]=3 4417 B12R1.267 COCCNc1ccncc1I b45848358dfb0d6a3872667d37705cf7 [0,2,0,0,0,0|1,0,0]=3 4418 B12R1.267 COCCNc1ccnnc1Br 0639b8adfe21301c376abd25a72c641e [0,2,0,0,0,0|2,0,0]=4 4419 B12R1.267 COCCNc1ccnnc1C b0109ac346ce994e5453fcd0741c691b [0,2,0,0,0,0|2,0,0]=4 4420 B12R1.267 COCCNc1ccnnc1Cl 5e2b51a7c5d2d6a2cad7b37c5ebeb965 [0,2,0,0,0,0|2,0,0]=4 4421 B12R1.267 COCCNc1cnccc1Br abaa58df16528e3dcb1f0858b8238a07 [0,2,0,0,0,0|1,0,0]=3 4422 B12R1.267 COCCNc1cnccc1C 80cb9dbc44d2dbe0ed38def93cb6bddb [0,2,0,0,0,0|1,0,0]=3 4423 B12R1.267 COCCNc1cnccc1Cl 1631b25d88df3e2b5d3e2582751c1608 [0,2,0,0,0,0|1,0,0]=3 4424 B12R1.267 COCCNc1cnccc1F 24323ef59c63d5f66e065924b3a9ea39 [0,2,0,0,0,0|1,0,0]=3 4425 B12R1.267 COCCNc1cnccc1I b7ba19eb426ff4ae8b93eac3234cddfd [0,2,0,0,0,0|1,0,0]=3 4426 B12R1.267 COCCNc1cnccc1S 23e2255852e116fbe02915f37cbf7c17 [0,2,0,0,0,0|1,0,0]=3 4427 B12R1.267 COCCNc1cncnc1Br e7e4420d727eb7a57a24c0325c634e7e [0,2,0,0,0,0|2,0,0]=4 4428 B12R1.267 COCCNc1cncnc1C 9d1a2d225e1eda8fefba1f6146198d4b [0,2,0,0,0,0|2,0,0]=4 4429 B12R1.267 COCCNc1cncnc1Cl 433021275e432842aef0eca04886dae0 [0,2,0,0,0,0|2,0,0]=4 4430 B12R1.267 COCCNc1cncnc1I e053e60da27a1290d0470f52758a125c [0,2,0,0,0,0|2,0,0]=4 4431 B12R1.267 COCCNc1cnncc1Br 1f2f65298593d04f8595ac4995a2fd3d [0,2,0,0,0,0|2,0,0]=4 4432 B12R1.267 COCCNc1cnncc1Cl 6a537fb8080cd520dae904f7b7fe8007 [0,2,0,0,0,0|2,0,0]=4 4433 B12R1.267 COCCNc1ncc[nH]c1=O 972012bfb991f5add56db05438c4ee15 [0,2,0,0,0,0|2,0,0]=4 4434 B12R1.267 COCCNc1ncccc1Br a604ebf2cf2b906d82c9de5b92a8bea1 [0,2,0,0,0,0|1,0,0]=3 4435 B12R1.267 COCCNc1ncccc1C b200439ebeebfb9b80997fa3d6e74c08 [0,2,0,0,0,0|1,0,0]=3 4436 B12R1.267 COCCNc1ncccc1Cl eac58380cc0bde315f54a867360b9693 [0,2,0,0,0,0|1,0,0]=3 4437 B12R1.267 COCCNc1ncccc1F db9e27fceea2d4bcb23689a4f2e4f4ee [0,2,0,0,0,0|1,0,0]=3 4438 B12R1.267 COCCNc1ncccc1I 0bf1d1e5054f49afecfee14ec757f447 [0,2,0,0,0,0|1,0,0]=3 4439 B12R1.267 COCCNc1ncccc1O e8df3468a5d78b0d5e1f950442f68888 [0,2,0,0,0,0|1,0,0]=3 4440 B12R1.267 COCCNc1nccnc1Br 7bc3cf7865cb429729a31252e85d7ef5 [0,2,0,0,0,0|2,0,0]=4 4441 B12R1.267 COCCNc1nccnc1C ac817621162cf95e1423a113f6809b4b [0,2,0,0,0,0|2,0,0]=4 4442 B12R1.267 COCCNc1nccnc1Cl 516dc97be226fb3d57255f5f4ab41ad3 [0,2,0,0,0,0|2,0,0]=4 4443 B12R1.267 COCCNc1nccnc1F 00f82d8ada94a8799377bfeb09be35e3 [0,2,0,0,0,0|2,0,0]=4 4444 B12R1.267 COCCNc1nccnc1I 6b36dc6ab2a41345dd19ff5d43b1a701 [0,2,0,0,0,0|2,0,0]=4 4445 B12R1.267 COCCNc1ncncc1Br d842268b284ca14eac4a627e27827ec9 [0,2,0,0,0,0|2,0,0]=4 4446 B12R1.267 COCCNc1ncncc1C 503e3c1ddd2263ecb001e806c8cb0a5c [0,2,0,0,0,0|2,0,0]=4 4447 B12R1.267 COCCNc1ncncc1Cl d0ff29521f6493e24bbb654bd152b662 [0,2,0,0,0,0|2,0,0]=4 4448 B12R1.267 COCCNc1ncncc1F 982e0de5e9c1a15f38f73dbf26f77603 [0,2,0,0,0,0|2,0,0]=4 4449 B12R1.267 COCCNc1ncncc1I de452048758111b83c7b9a750ce99cce [0,2,0,0,0,0|2,0,0]=4 4450 B12R1.267 COCCNc1nnccc1C 98d7e9c3ba13377bc188ffa15f51acd9 [0,2,0,0,0,0|2,0,0]=4 4451 B12R1.267 COCCNc1nnccc1O 6c9ce4d84c906d351bbaef80e58fd339 [0,2,0,0,0,0|2,0,0]=4 4452 B12R1.267 COCCOc1c[nH]cnc1=O 82fdc3841b0cf9e306ec4645d7bf9f6d [0,2,0,0,0,0|2,0,0]=4 4453 B12R1.267 COCCOc1ccc[nH]c1=S ce90dc61f435906da4a6770a64c3c20f [0,2,0,0,0,0|1,0,0]=3 4454 B12R1.267 COCCOc1cccc[n+]1[O-] da17a0e963db3c1f655b4ca490dc3cfd [0,2,0,0,0,0|1,0,0]=3 4455 B12R1.267 COCCOc1ccccc1Br 269ff3ba6771bca876eb0237f38698b5 [0,2,0,0,0,0|0,0,0]=2 4456 B12R1.267 COCCOc1ccccc1C d1a4078b5d8b7f06fefaa8a04a5a197e [0,2,0,0,0,0|0,0,0]=2 4457 B12R1.267 COCCOc1ccccc1Cl 310103c01f49e38bf9b89eb56adc9dcd [0,2,0,0,0,0|0,0,0]=2 4458 B12R1.267 COCCOc1ccccc1F a71971d185ec2566b27b95f9dfa9183e [0,2,0,0,0,0|0,0,0]=2 4459 B12R1.267 COCCOc1ccccc1I 5fb711a5f8e107d6d4a36d7a8a50ed45 [0,2,0,0,0,0|0,0,0]=2 4460 B12R1.267 COCCOc1ccccc1S c61bd9f6f038f9291ed764f12135eb69 [0,2,0,0,0,0|0,0,0]=2 4461 B12R1.267 COCCOc1cccnc1Br 69b7e318c230e7bb90ba87238d32734d [0,2,0,0,0,0|1,0,0]=3 4462 B12R1.267 COCCOc1cccnc1C a7b2c65558a747fc887236e8865f3eb3 [0,2,0,0,0,0|1,0,0]=3 4463 B12R1.267 COCCOc1cccnc1Cl 5e76b5a8aadb17e5213ae769dca84ee3 [0,2,0,0,0,0|1,0,0]=3 4464 B12R1.267 COCCOc1cccnc1F c47da2c6721ec699d8aba3b273df642c [0,2,0,0,0,0|1,0,0]=3 4465 B12R1.267 COCCOc1cccnc1I cd01d8123478c3a9154d37e6a3e611aa [0,2,0,0,0,0|1,0,0]=3 4466 B12R1.267 COCCOc1cccoc1=O 11ed5aba4e2c6e4772234d6fbc948df3 [0,2,0,0,0,0|1,0,0]=3 4467 B12R1.267 COCCOc1ccncc1Br d9306d35dec116c22ab4cd91b0bf747a [0,2,0,0,0,0|1,0,0]=3 4468 B12R1.267 COCCOc1ccncc1C 382f8bb63ceff49efb618d02980c2179 [0,2,0,0,0,0|1,0,0]=3 4469 B12R1.267 COCCOc1ccncc1Cl 75f42c8c8b3c523635c8ca69dba23063 [0,2,0,0,0,0|1,0,0]=3 4470 B12R1.267 COCCOc1ccncc1F 3aefe56a93975552a70c740165789b07 [0,2,0,0,0,0|1,0,0]=3 4471 B12R1.267 COCCOc1ccnnc1Cl a81edbfdb0d8bc06caabde24b2809839 [0,2,0,0,0,0|2,0,0]=4 4472 B12R1.267 COCCOc1cnccc1Br 57c6632476d4462d66e3dd55f101ca70 [0,2,0,0,0,0|1,0,0]=3 4473 B12R1.267 COCCOc1cnccc1C ef59b079a9b2f865601130710aee1c9c [0,2,0,0,0,0|1,0,0]=3 4474 B12R1.267 COCCOc1cnccc1Cl b0b6ba90fbb8566280d73628cd635330 [0,2,0,0,0,0|1,0,0]=3 4475 B12R1.267 COCCOc1cnccc1F c91ca3cedbce1709674baaaa77681ae3 [0,2,0,0,0,0|1,0,0]=3 4476 B12R1.267 COCCOc1cnccc1I b35a9aa66efbd252b237bec9849956ef [0,2,0,0,0,0|1,0,0]=3 4477 B12R1.267 COCCOc1cncnc1C a5077c978af62701fbf98b3c402a1e70 [0,2,0,0,0,0|2,0,0]=4 4478 B12R1.267 COCCOc1cncnc1I 3bbe0ea24837352f1d967a69b67a2a83 [0,2,0,0,0,0|2,0,0]=4 4479 B12R1.267 COCCOc1cnncc1Br f6389c23b82a990e54e6477b724938cd [0,2,0,0,0,0|2,0,0]=4 4480 B12R1.267 COCCOc1cnncc1Cl d9ab7adf3586bc0e74fe47dbd7a280ae [0,2,0,0,0,0|2,0,0]=4 4481 B12R1.267 COCCOc1coccc1=O 23013c2b12b826bc62674714709329af [0,2,0,0,0,0|1,0,0]=3 4482 B12R1.267 COCCOc1ncccc1Br 237777dd11fb61b520b4152aaef37661 [0,2,0,0,0,0|1,0,0]=3 4483 B12R1.267 COCCOc1ncccc1C 216a0d3c2273c6e254118577a20283d0 [0,2,0,0,0,0|1,0,0]=3 4484 B12R1.267 COCCOc1ncccc1Cl 506e5d1836d46b9486c7e2f295b70ded [0,2,0,0,0,0|1,0,0]=3 4485 B12R1.267 COCCOc1ncccc1F e1c0d699796f8f5be68de7af5a1324ba [0,2,0,0,0,0|1,0,0]=3 4486 B12R1.267 COCCOc1nccnc1Br 5cc22e0933dc22214e2a9370784420a4 [0,2,0,0,0,0|2,0,0]=4 4487 B12R1.267 COCCOc1nccnc1C fec76c97caa77bf647ad5ba0c1fb533c [0,2,0,0,0,0|2,0,0]=4 4488 B12R1.267 COCCOc1ncncc1C 759fc9b905fe17b2a89eb0b052be3945 [0,2,0,0,0,0|2,0,0]=4 4489 B12R1.267 COCCOc1ncncc1Cl 07c6863f939585c78a247c7f93dd0418 [0,2,0,0,0,0|2,0,0]=4 4490 B12R1.267 COCCOc1ncncc1F 20b910507c6f85107074d0e8624eca9a [0,2,0,0,0,0|2,0,0]=4 4491 B12R1.267 COCCOc1ncncc1I d1b48f9f58d70eff1ecba7bde2f421e3 [0,2,0,0,0,0|2,0,0]=4 4492 B12R1.267 COCCOc1nnccc1C eaf39aa9881d634243df28b101796053 [0,2,0,0,0,0|2,0,0]=4 4493 B12R1.267 COCCOc1nnccc1Cl 21798f1160b5e545f4d2badb87e0a612 [0,2,0,0,0,0|2,0,0]=4 4494 B12R1.267 COCCOc1nnccc1I c603333bd9d7b3565ccd157388e554ea [0,2,0,0,0,0|2,0,0]=4 4495 B12R1.267 COCCOn1ccccc1=N 13015ff8ac4e2b67331ea97752acbbf0 [0,2,0,0,0,0|1,0,0]=3 4496 B12R1.267 COCCOn1ccccc1=O df7afbf98570b20a240740b67768ac2b [0,2,0,0,0,0|1,0,0]=3 4497 B12R1.267 COCCOn1ccccc1=S d821916d7e4ec6215f8f33f5e6d35171 [0,2,0,0,0,0|1,0,0]=3 4498 B12R1.267 COCNCc1cccc[n+]1[O-] d6d65297cd199f36e068b181f57ad367 [0,2,0,0,0,0|1,0,0]=3 4499 B12R1.267 COCNCc1ccccc1Br b237780edc7e0e7084c58a3782b8f3d4 [0,2,0,0,0,0|0,0,0]=2 4500 B12R1.267 COCNCc1ccccc1C 0cee05accc446e8ea1175470ca772094 [0,2,0,0,0,0|0,0,0]=2 4501 B12R1.267 COCNCc1ccccc1Cl 462467d30ed83a7699177d39d3791eb2 [0,2,0,0,0,0|0,0,0]=2 4502 B12R1.267 COCNCc1ccccc1F ccf1619ef238a69fb648cb5390ba9858 [0,2,0,0,0,0|0,0,0]=2 4503 B12R1.267 COCNCc1ccccc1I cbb778473389aa3adf4240ac9b0e4733 [0,2,0,0,0,0|0,0,0]=2 4504 B12R1.267 COCNCc1cccnc1Br 73dac587102160f722969927ba0060c4 [0,2,0,0,0,0|1,0,0]=3 4505 B12R1.267 COCNCc1cccnc1C ec56e4a453b6a557f077d8574c4268a2 [0,2,0,0,0,0|1,0,0]=3 4506 B12R1.267 COCNCc1cccnc1Cl f18f1439e5ef34fc210df8fb824846f0 [0,2,0,0,0,0|1,0,0]=3 4507 B12R1.267 COCNCc1cccnc1F 572757419453222078f4d5b4960ef984 [0,2,0,0,0,0|1,0,0]=3 4508 B12R1.267 COCNCc1ccncc1Br e5e60cf702f97a31392d9b83a07d30ea [0,2,0,0,0,0|1,0,0]=3 4509 B12R1.267 COCNCc1ccncc1C 16e61c53a2243c4b19a16333f819207b [0,2,0,0,0,0|1,0,0]=3 4510 B12R1.267 COCNCc1ccncc1Cl 198665026af421ea90ba51672b86db47 [0,2,0,0,0,0|1,0,0]=3 4511 B12R1.267 COCNCc1ccncc1F 68cf9544618285bea861218b519b62db [0,2,0,0,0,0|1,0,0]=3 4512 B12R1.267 COCNCc1cnccc1C 6e8084e817d856e173fe608552f010c8 [0,2,0,0,0,0|1,0,0]=3 4513 B12R1.267 COCNCc1ncccc1Br 8861e3cb888c88f5e3ff7cf36ac4459c [0,2,0,0,0,0|1,0,0]=3 4514 B12R1.267 COCNCc1ncccc1C cc078bd001157d252ec034e7f311fc3d [0,2,0,0,0,0|1,0,0]=3 4515 B12R1.267 COCNCc1ncccc1Cl 0b7c3ac3dc396d8ebde2008fe6df39be [0,2,0,0,0,0|1,0,0]=3 4516 B12R1.267 COCNCc1ncccc1F a031a9b80ca52defc805ddb3587bb316 [0,2,0,0,0,0|1,0,0]=3 4517 B12R1.267 COCNCc1nccnc1Cl e148d0e0fa0b0914cd995f6f98570bfb [0,2,0,0,0,0|2,0,0]=4 4518 B12R1.267 COCNCc1nnccc1C 4c6302b9d54abf4b24d383c12f037bd3 [0,2,0,0,0,0|2,0,0]=4 4519 B12R1.267 COCOCc1ccc[nH]c1=O 785e6d209798b19facf726caed7f42f2 [0,2,0,0,0,0|1,0,0]=3 4520 B12R1.267 COCOCc1ccccc1Br bfa4b5bd5970ee9c9b7435f6cb7658a4 [0,2,0,0,0,0|0,0,0]=2 4521 B12R1.267 COCOCc1ccccc1C 72d2b2b099b7f2ec40fa5e1d9474c39e [0,2,0,0,0,0|0,0,0]=2 4522 B12R1.267 COCOCc1ccccc1Cl 69343f28b8b2c88962ef03b7c8399d31 [0,2,0,0,0,0|0,0,0]=2 4523 B12R1.267 COCOCc1ccccc1F eebdc39702ad7fc25bd356221ffea205 [0,2,0,0,0,0|0,0,0]=2 4524 B12R1.267 COCOCc1ccccc1I 0eda0999da600bcd5be24d5bcde342f9 [0,2,0,0,0,0|0,0,0]=2 4525 B12R1.267 COCOCc1ccccc1S ac5a2c9358d2dfcc9af283f6bdd670ac [0,2,0,0,0,0|0,0,0]=2 4526 B12R1.267 COCOCc1cccnc1Br c415e4ce9ab54241b076faac25dc3099 [0,2,0,0,0,0|1,0,0]=3 4527 B12R1.267 COCOCc1cccnc1C dc5100227cbf805cfcc990c503d7232a [0,2,0,0,0,0|1,0,0]=3 4528 B12R1.267 COCOCc1cccnc1Cl 1a41e170c0a5eb11ac539c85ad858c10 [0,2,0,0,0,0|1,0,0]=3 4529 B12R1.267 COCOCc1cccnc1F edee786a8c12acc58c1d1770763df6fa [0,2,0,0,0,0|1,0,0]=3 4530 B12R1.267 COCOCc1ccncc1Br 10437177a49b7400bc98878cb53dd8f3 [0,2,0,0,0,0|1,0,0]=3 4531 B12R1.267 COCOCc1ccncc1C 4862c933baef1f14c8b5175d841efc61 [0,2,0,0,0,0|1,0,0]=3 4532 B12R1.267 COCOCc1ccncc1Cl a34e8c17c18287442f467166d090e677 [0,2,0,0,0,0|1,0,0]=3 4533 B12R1.267 COCOCc1ccncc1F 447138e8a666faa258427d88650e0d8d [0,2,0,0,0,0|1,0,0]=3 4534 B12R1.267 COCOCc1ccncc1I ba04820259fe93d54938488aab1dadda [0,2,0,0,0,0|1,0,0]=3 4535 B12R1.267 COCOCc1ccnnc1C 1eec8ae8a1e3191c8af914213ea1a1ce [0,2,0,0,0,0|2,0,0]=4 4536 B12R1.267 COCOCc1cnccc1Br ba9a85d83cadd24b457babe9832a4f2e [0,2,0,0,0,0|1,0,0]=3 4537 B12R1.267 COCOCc1cnccc1C f4f5293eecc484b595b294b42aaf6241 [0,2,0,0,0,0|1,0,0]=3 4538 B12R1.267 COCOCc1cnccc1Cl 2e39c37bceb431977431aed64087de38 [0,2,0,0,0,0|1,0,0]=3 4539 B12R1.267 COCOCc1cnccc1F d7374d542109f07744eec3d8c1ea536d [0,2,0,0,0,0|1,0,0]=3 4540 B12R1.267 COCOCc1cncnc1Cl 509d145fdeecbe3a5b55a7a3d11a3cd7 [0,2,0,0,0,0|2,0,0]=4 4541 B12R1.267 COCOCc1cnncc1C 1b1751dfbb909754cef984a4f9ba53b4 [0,2,0,0,0,0|2,0,0]=4 4542 B12R1.267 COCOCc1ncccc1Br 45361cea6ac7c6d48eb1c5de6070ce83 [0,2,0,0,0,0|1,0,0]=3 4543 B12R1.267 COCOCc1ncccc1C 594ada32c6d5e2500358d6514bc9c924 [0,2,0,0,0,0|1,0,0]=3 4544 B12R1.267 COCOCc1ncccc1Cl 89d47458dbea593c980b129190b5ae96 [0,2,0,0,0,0|1,0,0]=3 4545 B12R1.267 COCOCc1ncccc1F 75b94ec0b877f2d9d32457351b90774d [0,2,0,0,0,0|1,0,0]=3 4546 B12R1.267 COCOCc1nccnc1C 526e872ceff4207109745660e2448add [0,2,0,0,0,0|2,0,0]=4 4547 B12R1.267 COCOCc1nccnc1Cl 70cdf6b1abf69428d0ae73db25ceeb50 [0,2,0,0,0,0|2,0,0]=4 4548 B12R1.267 COCOCc1ncncc1Br 7a1e1627ac7b0af63c00bef71fdc0c7c [0,2,0,0,0,0|2,0,0]=4 4549 B12R1.267 COCOCc1nnccc1C 918fbb98a9a84d6d59f8b22e38999e51 [0,2,0,0,0,0|2,0,0]=4 4550 B12R1.267 CSCCNc1c[nH]ccc1=O 9a4edb73feba4980865f2c6b63e5a05d [0,2,0,0,0,0|1,1,0]=4 4551 B12R1.267 CSCCNc1ccc[nH]c1=S 5d10ca96fbd3984072cbe168b4cc6901 [0,2,0,0,0,0|1,1,0]=4 4552 B12R1.267 CSCCNc1cccc[n+]1[O-] e7445d9391d1177ef03f07540787d805 [0,2,0,0,0,0|1,1,0]=4 4553 B12R1.267 CSCCNc1ccccc1Br 89f896b7ac37f3ff5e29ed57ee03acae [0,2,0,0,0,0|0,1,0]=3 4554 B12R1.267 CSCCNc1ccccc1C a602aae8e2436b54decd8465bcef52b3 [0,2,0,0,0,0|0,1,0]=3 4555 B12R1.267 CSCCNc1ccccc1Cl 1e4317efcab81ecd52bdd5935b072af9 [0,2,0,0,0,0|0,1,0]=3 4556 B12R1.267 CSCCNc1ccccc1F e263ac1957660b93601a70cc4e4ea086 [0,2,0,0,0,0|0,1,0]=3 4557 B12R1.267 CSCCNc1ccccc1I 50dc8a75e2dd87829cebe11ed891b3e1 [0,2,0,0,0,0|0,1,0]=3 4558 B12R1.267 CSCCNc1ccccc1S 563a1d81ad072cd0e10bb3bb0a36dcef [0,2,0,0,0,0|0,1,0]=3 4559 B12R1.267 CSCCNc1cccnc1Br 74b0d1e9af5bf5aa15d6758fc1fb6965 [0,2,0,0,0,0|1,1,0]=4 4560 B12R1.267 CSCCNc1cccnc1C d6a481f8608d6cd4fa92fe4d84b2738e [0,2,0,0,0,0|1,1,0]=4 4561 B12R1.267 CSCCNc1cccnc1Cl dac17313fc139de414bba08ccc514ba5 [0,2,0,0,0,0|1,1,0]=4 4562 B12R1.267 CSCCNc1cccnc1F 2d52b43aa948026bf6422371a2b193b3 [0,2,0,0,0,0|1,1,0]=4 4563 B12R1.267 CSCCNc1cccnc1I 54bd6372d94f44eedebb8a133c475dc7 [0,2,0,0,0,0|1,1,0]=4 4564 B12R1.267 CSCCNc1ccncc1Br cd4bf3a82b5311e186f41d7beccd8f3f [0,2,0,0,0,0|1,1,0]=4 4565 B12R1.267 CSCCNc1ccncc1C 71e0620d773a6aacf2078d42b30f27a5 [0,2,0,0,0,0|1,1,0]=4 4566 B12R1.267 CSCCNc1ccncc1Cl f3fea00e6103b626b7c745c1dae1acb2 [0,2,0,0,0,0|1,1,0]=4 4567 B12R1.267 CSCCNc1ccncc1F 2dcfa4d3aecc382f907660563eda51f2 [0,2,0,0,0,0|1,1,0]=4 4568 B12R1.267 CSCCNc1ccncc1I 33b288d0c9fd826a8dac9aa1be9d4e3c [0,2,0,0,0,0|1,1,0]=4 4569 B12R1.267 CSCCNc1cnccc1Br 66bff26b3cb0adeb0fd0cbe59ebfae03 [0,2,0,0,0,0|1,1,0]=4 4570 B12R1.267 CSCCNc1cnccc1C 5e45ef56b8a8924439156337d54fef08 [0,2,0,0,0,0|1,1,0]=4 4571 B12R1.267 CSCCNc1cnccc1Cl cdcbfb7980a0e84a3090ef407d53a0d2 [0,2,0,0,0,0|1,1,0]=4 4572 B12R1.267 CSCCNc1cnccc1F b0bfa07fb96ddc1215fea5b799db44fc [0,2,0,0,0,0|1,1,0]=4 4573 B12R1.267 CSCCNc1cnccc1I 7ded4229f669fa14cc4bfab3a0376ef1 [0,2,0,0,0,0|1,1,0]=4 4574 B12R1.267 CSCCNc1cnccc1S 4c37ee033414344cd87463af2373f823 [0,2,0,0,0,0|1,1,0]=4 4575 B12R1.267 CSCCNc1ncccc1Br fe72f68f85b5446d1e1915022f2afb31 [0,2,0,0,0,0|1,1,0]=4 4576 B12R1.267 CSCCNc1ncccc1C 486fa1822bd36b3b65487e14aff1d631 [0,2,0,0,0,0|1,1,0]=4 4577 B12R1.267 CSCCNc1ncccc1Cl 1800950b5061fb8fee7ef5a75c742122 [0,2,0,0,0,0|1,1,0]=4 4578 B12R1.267 CSCCNc1ncccc1F 7a24ec3a103c99f557b937bd28141615 [0,2,0,0,0,0|1,1,0]=4 4579 B12R1.267 CSCCNc1ncccc1I af0ebe64eda0302a9b1ef6248b528554 [0,2,0,0,0,0|1,1,0]=4 4580 B12R1.267 CSCCOc1ccc[nH]c1=S 17e282647f05853060cc6f99a5030e2d [0,2,0,0,0,0|1,1,0]=4 4581 B12R1.267 CSCCOc1cccc[n+]1[O-] 99d4ee6b99228aabd3ee4cd24ffe2db2 [0,2,0,0,0,0|1,1,0]=4 4582 B12R1.267 CSCCOc1ccccc1Br 8581414fdfa463e59db6a516f52cd509 [0,2,0,0,0,0|0,1,0]=3 4583 B12R1.267 CSCCOc1ccccc1C 3a190489aede5345d1d05632cac537ca [0,2,0,0,0,0|0,1,0]=3 4584 B12R1.267 CSCCOc1ccccc1Cl bd29c90b63f15c078d63ef35d2524b5d [0,2,0,0,0,0|0,1,0]=3 4585 B12R1.267 CSCCOc1ccccc1F 5e9c59f726c5c4fa708074cde48b4a7b [0,2,0,0,0,0|0,1,0]=3 4586 B12R1.267 CSCCOc1ccccc1I f7094c1aa5023573c6451d1e7ff86e0d [0,2,0,0,0,0|0,1,0]=3 4587 B12R1.267 CSCCOc1ccccc1S c0b5e2ff8d7489f9bd32e18a82064c65 [0,2,0,0,0,0|0,1,0]=3 4588 B12R1.267 CSCCOc1cccnc1Br 45013f7b723812c9724584ebf7c76b70 [0,2,0,0,0,0|1,1,0]=4 4589 B12R1.267 CSCCOc1cccnc1C f0b56ab50d622c0879e05683ce244a85 [0,2,0,0,0,0|1,1,0]=4 4590 B12R1.267 CSCCOc1cccnc1Cl 1ef75b2e8ab34804348d7340dfc9a323 [0,2,0,0,0,0|1,1,0]=4 4591 B12R1.267 CSCCOc1cccnc1F 70929afbf5121fe6e3fce5c8acf7fb7b [0,2,0,0,0,0|1,1,0]=4 4592 B12R1.267 CSCCOc1cccnc1I 91a432bc5b90ca4fa91413646e78c15d [0,2,0,0,0,0|1,1,0]=4 4593 B12R1.267 CSCCOc1cccoc1=O 514271d5cf96ad8eb8f1f6a054de84ac [0,2,0,0,0,0|1,1,0]=4 4594 B12R1.267 CSCCOc1ccncc1Br 55acef6aaf96f88f68020ec38ac9ed55 [0,2,0,0,0,0|1,1,0]=4 4595 B12R1.267 CSCCOc1ccncc1C c531115ff5326d3a187555557a6ea8c7 [0,2,0,0,0,0|1,1,0]=4 4596 B12R1.267 CSCCOc1ccncc1Cl d8748945650bcf7af008ef92fefa1e95 [0,2,0,0,0,0|1,1,0]=4 4597 B12R1.267 CSCCOc1ccncc1F e6244eb659a684f1ab294e64630169ed [0,2,0,0,0,0|1,1,0]=4 4598 B12R1.267 CSCCOc1cnccc1Br 820a564f090e071e85da21525d72cb95 [0,2,0,0,0,0|1,1,0]=4 4599 B12R1.267 CSCCOc1cnccc1C e3be602ed043b86234a415686b14886c [0,2,0,0,0,0|1,1,0]=4 4600 B12R1.267 CSCCOc1cnccc1Cl 205c799bae158f85f2b8de4bb9918070 [0,2,0,0,0,0|1,1,0]=4 4601 B12R1.267 CSCCOc1cnccc1F 0fde7aec7b10753fcd304e8e7609cde8 [0,2,0,0,0,0|1,1,0]=4 4602 B12R1.267 CSCCOc1cnccc1I 9e79f439a0768b21ff7c13ec93ea1578 [0,2,0,0,0,0|1,1,0]=4 4603 B12R1.267 CSCCOc1coccc1=O 5ac34b216fa4e3544267b66acdd353b9 [0,2,0,0,0,0|1,1,0]=4 4604 B12R1.267 CSCCOc1ncccc1Br fe53e945004e9c562ce3303b927afa69 [0,2,0,0,0,0|1,1,0]=4 4605 B12R1.267 CSCCOc1ncccc1C 287464db5c0583e08e2666fbd87c6efd [0,2,0,0,0,0|1,1,0]=4 4606 B12R1.267 CSCCOc1ncccc1Cl afacb364af23db367f95223d462d0412 [0,2,0,0,0,0|1,1,0]=4 4607 B12R1.267 CSCCOc1ncccc1F aa8d9e96cba89df16831903cd73fc69d [0,2,0,0,0,0|1,1,0]=4 4608 B12R1.267 CSCCOn1ccccc1=N 805561eea8cdf5bc0ee388ac49e46413 [0,2,0,0,0,0|1,1,0]=4 4609 B12R1.267 CSCCOn1ccccc1=O 905a9389d51088d8c6e5cd9cfa89afb5 [0,2,0,0,0,0|1,1,0]=4 4610 B12R1.267 CSCCOn1ccccc1=S dc5403792991678ceb47f69d6fe6ff07 [0,2,0,0,0,0|1,1,0]=4 4611 B12R1.267 CSCNCc1cccc[n+]1[O-] 982c2116778065d566fafe515e72a19f [0,2,0,0,0,0|1,1,0]=4 4612 B12R1.267 CSCNCc1ccccc1Cl 92179a05b0923c81723b70dcc861bfb8 [0,2,0,0,0,0|0,1,0]=3 4613 B12R1.267 CSCNCc1ccccc1F f88a948e935d1f07436a075dc120a40a [0,2,0,0,0,0|0,1,0]=3 4614 B12R1.267 CSCNCc1ccccc1I 980e1aec5f2b58f5eb35e241e05c7f0f [0,2,0,0,0,0|0,1,0]=3 4615 B12R1.267 CSCNCc1cccnc1Br 76d3058194fabea3600eeccb8042698f [0,2,0,0,0,0|1,1,0]=4 4616 B12R1.267 CSCNCc1cccnc1C 9a4aa0afb3fbc5bdbc77c666fc923ac7 [0,2,0,0,0,0|1,1,0]=4 4617 B12R1.267 CSCNCc1cccnc1Cl 49655225ed25af069cf515b340fb19f4 [0,2,0,0,0,0|1,1,0]=4 4618 B12R1.267 CSCNCc1cccnc1F bf887f83f6a9753be9bd5dcce7e66e97 [0,2,0,0,0,0|1,1,0]=4 4619 B12R1.267 CSCNCc1ccncc1Br 2764c983be3fea7c801de4039bd4519c [0,2,0,0,0,0|1,1,0]=4 4620 B12R1.267 CSCNCc1ccncc1C ca0c2aa499cf14b2c4e4de5901d6906c [0,2,0,0,0,0|1,1,0]=4 4621 B12R1.267 CSCNCc1ccncc1Cl 1b45cff6502016cd8896e1926212d89a [0,2,0,0,0,0|1,1,0]=4 4622 B12R1.267 CSCNCc1ccncc1F c6ea4eaa4fce6803349c23357262b9c1 [0,2,0,0,0,0|1,1,0]=4 4623 B12R1.267 CSCNCc1ncccc1Br b76de085f30232275bcf02781f6eb062 [0,2,0,0,0,0|1,1,0]=4 4624 B12R1.267 CSCNCc1ncccc1C 94431dc7cf192f5e8ab4ebb7e55e4f51 [0,2,0,0,0,0|1,1,0]=4 4625 B12R1.267 CSCNCc1ncccc1Cl b8d6339f1cf611692d28433ec310d710 [0,2,0,0,0,0|1,1,0]=4 4626 B12R1.267 CSCNCc1ncccc1F b057ad42c041bc25559f55dd5c37c9a8 [0,2,0,0,0,0|1,1,0]=4 4627 B12R1.267 CSCOCc1ccc[nH]c1=O ccb6331dbed5c7bb57751431fd59f590 [0,2,0,0,0,0|1,1,0]=4 4628 B12R1.267 CSCOCc1ccccc1Cl 1d5a9e1fa52b8915eeebbb38cbfdb556 [0,2,0,0,0,0|0,1,0]=3 4629 B12R1.267 CSCOCc1ccccc1F 4038eb8093f67e51c2eb76b0108c4e61 [0,2,0,0,0,0|0,1,0]=3 4630 B12R1.267 CSCOCc1ccccc1I b3c3bb5963de95894f4aab5be38b7580 [0,2,0,0,0,0|0,1,0]=3 4631 B12R1.267 CSCOCc1cccnc1Br 2d71313a38b5c2a946d6c9d04c05db0d [0,2,0,0,0,0|1,1,0]=4 4632 B12R1.267 CSCOCc1cccnc1C c389126ff57eeafa4fe00dd13f24c4d5 [0,2,0,0,0,0|1,1,0]=4 4633 B12R1.267 CSCOCc1cccnc1Cl 23a31831e747f2a801a7fa04e869f260 [0,2,0,0,0,0|1,1,0]=4 4634 B12R1.267 CSCOCc1cccnc1F 2b7d61f136655cbe025b12c5d451836c [0,2,0,0,0,0|1,1,0]=4 4635 B12R1.267 CSCOCc1ccncc1Br a9278765a5c96015d55750ca9841e1d6 [0,2,0,0,0,0|1,1,0]=4 4636 B12R1.267 CSCOCc1ccncc1C b815160cdcf18e70769ab3c180c9a5ec [0,2,0,0,0,0|1,1,0]=4 4637 B12R1.267 CSCOCc1ccncc1Cl 08bc5b9c8cad6c90fbda624dbcb538af [0,2,0,0,0,0|1,1,0]=4 4638 B12R1.267 CSCOCc1ccncc1F 0b2fec8c5dfc04b27dc5f4ac5f693412 [0,2,0,0,0,0|1,1,0]=4 4639 B12R1.267 CSCOCc1ccncc1I c3e94c8447e27fdc81596e1a9c27d883 [0,2,0,0,0,0|1,1,0]=4 4640 B12R1.267 CSCOCc1cnccc1Br dea80ceaea7aa08794bd858a8bafaa0f [0,2,0,0,0,0|1,1,0]=4 4641 B12R1.267 CSCOCc1cnccc1C 4115433e8bddc456c97a96da85d7dd6e [0,2,0,0,0,0|1,1,0]=4 4642 B12R1.267 CSCOCc1cnccc1Cl 9893c4ae09591926a6b4b9360c86469a [0,2,0,0,0,0|1,1,0]=4 4643 B12R1.267 CSCOCc1cnccc1F 487b2c77db2045cca81e98364d43e18f [0,2,0,0,0,0|1,1,0]=4 4644 B12R1.267 CSCOCc1ncccc1Br 0b6341eac80e26ac66f45107c4e568a3 [0,2,0,0,0,0|1,1,0]=4 4645 B12R1.267 CSCOCc1ncccc1C 2e4743f86e8cb312b0b1b27d4442304e [0,2,0,0,0,0|1,1,0]=4 4646 B12R1.267 CSCOCc1ncccc1Cl 5799d4128190aaeed21af13f31e6cacc [0,2,0,0,0,0|1,1,0]=4 4647 B12R1.267 CSCOCc1ncccc1F 49311f4bad0a7ccb3fa802ea0692eea3 [0,2,0,0,0,0|1,1,0]=4 4648 B12R1.267 Cc1ccccc1CCNC=O 79b73b98e8849e560497af1b05746d24 [0,2,0,0,0,0|1,0,1]=4 4649 B12R1.267 Cc1ccccc1CCOCF 25f7145d6fc74add80093b665dc4393f [0,2,0,0,0,0|0,0,0]=2 4650 B12R1.267 Cc1ccccc1CNCC#N 9ef3f2295981a8a7858a03e4d84476b0 [0,2,0,0,0,0|2,0,0]=4 4651 B12R1.267 Cc1ccccc1CNCC=O 7ed1edf5a061eaff5729d7655a5f8926 [0,2,0,0,0,0|2,0,0]=4 4652 B12R1.267 Cc1ccccc1CNCCBr f77310b29a912c999237b2739aa1210c [0,2,0,0,0,0|2,0,0]=4 4653 B12R1.267 Cc1ccccc1CNCCF 2098ce6c3ac26037f1429812f234d51f [0,2,0,0,0,0|2,0,0]=4 4654 B12R1.267 Cc1ccccc1CNCCI fc22bac86bb7aed276187f2f15c5f39c [0,2,0,0,0,0|2,0,0]=4 4655 B12R1.267 Cc1ccccc1CNCCO 91e2522e5fd17c1e59cb7a4547ef3a2a [0,2,0,0,0,0|2,0,0]=4 4656 B12R1.267 Cc1ccccc1CNCCS 518bc80a508cefc73ae1e4b1db664c64 [0,2,0,0,0,0|2,0,0]=4 4657 B12R1.267 Cc1ccccc1COCC#N 07f7ead490993d034d6706e5b16aba7a [0,2,0,0,0,0|2,0,0]=4 4658 B12R1.267 Cc1ccccc1COCC=O 1072790a37d89897fde03f06fbe2d852 [0,2,0,0,0,0|2,0,0]=4 4659 B12R1.267 Cc1ccccc1COCCF b62a57d7c0fa269c712aedbbb80a9625 [0,2,0,0,0,0|2,0,0]=4 4660 B12R1.267 Cc1ccccc1COCCS aef395cc1a408662a0ccc964cffa43b5 [0,2,0,0,0,0|2,0,0]=4 4661 B12R1.267 Cc1ccccc1NCCC#N ce8a05417d9be1cda3ee1838837d3277 [0,2,0,0,0,0|2,0,0]=4 4662 B12R1.267 Cc1ccccc1NCCC=O 1fe23c766157e1bf7b47279fc74567a0 [0,2,0,0,0,0|2,0,0]=4 4663 B12R1.267 Cc1ccccc1NCCCCl 3f07cd3fee639e67367fcbefe2480469 [0,2,0,0,0,0|2,0,0]=4 4664 B12R1.267 Cc1ccccc1NCCCF cd187669e045c403fa041057668289e1 [0,2,0,0,0,0|2,0,0]=4 4665 B12R1.267 Cc1ccccc1NCCCO 5cbc6801488d8693795187d1801221e4 [0,2,0,0,0,0|2,0,0]=4 4666 B12R1.267 Cc1ccccc1NCCCS 775c2d60048baf56f754562db9cc458f [0,2,0,0,0,0|2,0,0]=4 4667 B12R1.267 Cc1ccccc1NCCON 5748d97c6209b4e72d0f53729eb7c34a [0,2,0,0,0,0|1,0,0]=3 4668 B12R1.267 Cc1ccccc1OCCC#N c8dfae7dcecf4982bbb9b3453f10c618 [0,2,0,0,0,0|2,0,0]=4 4669 B12R1.267 Cc1ccccc1OCCC=O c586d047c8f0432e9537c54c6c57cadd [0,2,0,0,0,0|2,0,0]=4 4670 B12R1.267 Cc1ccccc1OCCCF 17ac468fc98fd39c18bafba1086884be [0,2,0,0,0,0|2,0,0]=4 4671 B12R1.267 Cc1ccccc1OCCCS 6c40726109b118213fac4182f37514c3 [0,2,0,0,0,0|2,0,0]=4 4672 B12R1.267 Cc1cccnc1CCNCF eb0717bd4d5ea35d5647008effe15b74 [0,2,0,0,0,0|2,0,0]=4 4673 B12R1.267 Cc1cccnc1CCNCO e253839bc633e5edad49b49eda83a513 [0,2,0,0,0,0|2,0,0]=4 4674 B12R1.267 Cc1cccnc1CCOCF f6173b8916a000e8b7a7bd5b839c7c93 [0,2,0,0,0,0|1,0,0]=3 4675 B12R1.267 Cc1cccnc1NCCON 867993fcfdcdfbc736b8074894ac84d1 [0,2,0,0,0,0|2,0,0]=4 4676 B12R1.267 Cc1ccncc1NCCON 58dee794ac7b6bbac2b8a96198f77782 [0,2,0,0,0,0|2,0,0]=4 4677 B12R1.267 Cc1cnccc1CCOCF 643f77cea3ec44efeb18aba9cf346fc5 [0,2,0,0,0,0|1,0,0]=3 4678 B12R1.267 Cc1cnccc1NCCON 8a915f50810408fc316933e0e8c959b5 [0,2,0,0,0,0|2,0,0]=4 4679 B12R1.267 Cc1ncccc1NCCON f2d25a2ecd74e4df0a411c39ca51af9d [0,2,0,0,0,0|2,0,0]=4 4680 B12R1.267 Cc1nccnc1CCOCF b49884bec985e13fa89cef7da0dbd386 [0,2,0,0,0,0|2,0,0]=4 4681 B12R1.267 Clc1ccccc1CNCCBr 9b09944bc517f8abdc4e72ad121b2a36 [0,2,0,0,0,0|2,0,0]=4 4682 B12R1.267 Clc1ccccc1CNCCI c20f3a099731b307fa4ff0374c509584 [0,2,0,0,0,0|2,0,0]=4 4683 B12R1.267 FCCCNc1ccccc1Cl 17fac0f3c0fe16e84554f273210a739d [0,2,0,0,0,0|2,0,0]=4 4684 B12R1.267 FCCCNc1ccccc1F bebe212963a66c49720b2be585ecd4c7 [0,2,0,0,0,0|2,0,0]=4 4685 B12R1.267 FCCCNc1ccccc1I a7a4a61d30d1fccf35b205460629f6d9 [0,2,0,0,0,0|2,0,0]=4 4686 B12R1.267 FCCCNc1ccccc1S 1fc063029a53aaa93c66ffdbd6720722 [0,2,0,0,0,0|2,0,0]=4 4687 B12R1.267 FCCCOc1ccccc1Br 499e528be31647c2767a23de412a6892 [0,2,0,0,0,0|2,0,0]=4 4688 B12R1.267 FCCCOc1ccccc1Cl df2e97234eeec5aa9e2bf4aa8d930954 [0,2,0,0,0,0|2,0,0]=4 4689 B12R1.267 FCCCOc1ccccc1F 8aac8d2dd21b9c25c2bae9285eb00f79 [0,2,0,0,0,0|2,0,0]=4 4690 B12R1.267 FCCCOc1ccccc1I 4324cc6c6ddc07e001929c58a563257a [0,2,0,0,0,0|2,0,0]=4 4691 B12R1.267 FCCCOc1ccccc1S 33bc119b6d4654961a63ead32803fa79 [0,2,0,0,0,0|2,0,0]=4 4692 B12R1.267 FCCNCc1ccccc1Br b46fdf31e33910710dd483a85d89d96f [0,2,0,0,0,0|2,0,0]=4 4693 B12R1.267 FCCNCc1ccccc1Cl a14087dde8b7b46255adcf5a803afdbc [0,2,0,0,0,0|2,0,0]=4 4694 B12R1.267 FCCNCc1ccccc1F f832ea6ba744d5ab65af659cd2552ce3 [0,2,0,0,0,0|2,0,0]=4 4695 B12R1.267 FCCNCc1ccccc1I eed8b10184147070559f785fa901c222 [0,2,0,0,0,0|2,0,0]=4 4696 B12R1.267 FCCOCc1ccccc1Br 5a0928a171083f8638f03aacb9dc36dd [0,2,0,0,0,0|2,0,0]=4 4697 B12R1.267 FCCOCc1ccccc1Cl 078ea64bbef33ece9aff7dddc04601a6 [0,2,0,0,0,0|2,0,0]=4 4698 B12R1.267 FCCOCc1ccccc1F 87862c8ddec2c3ff0ce1d65429b7e84b [0,2,0,0,0,0|2,0,0]=4 4699 B12R1.267 FCCOCc1ccccc1I 289e82c65c96603401598d70743f8a2e [0,2,0,0,0,0|2,0,0]=4 4700 B12R1.267 FCNCCc1ccccc1Cl 2b7cd31ed4a3052fcd0d18714236530d [0,2,0,0,0,0|1,0,0]=3 4701 B12R1.267 FCNCCc1ccccc1F 6a44669825c83fc6e919b2f10fd8c7d2 [0,2,0,0,0,0|1,0,0]=3 4702 B12R1.267 FCNCCc1ncccc1Br b8dab67bc218450916f84b88f0223845 [0,2,0,0,0,0|2,0,0]=4 4703 B12R1.267 FCOCCc1ccccc1Br 574267660b831959d0794f82b5ef5850 [0,2,0,0,0,0|0,0,0]=2 4704 B12R1.267 FCOCCc1ccccc1Cl 7ea8671364534b09f9e85fd52379f60c [0,2,0,0,0,0|0,0,0]=2 4705 B12R1.267 FCOCCc1ccccc1F 05e5363269f95ae13cad094391096216 [0,2,0,0,0,0|0,0,0]=2 4706 B12R1.267 FCOCCc1ccccc1I 39aabe4ca087b7967fe2111450ba8931 [0,2,0,0,0,0|0,0,0]=2 4707 B12R1.267 FCOCCc1ccncc1Cl 83e16896c2573842419dec17268aff26 [0,2,0,0,0,0|1,0,0]=3 4708 B12R1.267 FCOCCc1ccncc1F abc09118c7967196818b70b73e2cd126 [0,2,0,0,0,0|1,0,0]=3 4709 B12R1.267 FCOCCc1ncccc1F 70e197110844d94f450c9830d53c2c8b [0,2,0,0,0,0|1,0,0]=3 4710 B12R1.267 Fc1ccccc1CNCCBr b7656da594f64afd8a0d67c46781013a [0,2,0,0,0,0|2,0,0]=4 4711 B12R1.267 Fc1ccccc1CNCCI 460bdcbe7f8be048b77e48771c7dd795 [0,2,0,0,0,0|2,0,0]=4 4712 B12R1.267 Fc1ccccc1CNCCS 9654adc193d5f5d14b8b59c65d5b6a3e [0,2,0,0,0,0|2,0,0]=4 4713 B12R1.267 Fc1ccccc1COCCS 22e124a097dce78e916c7bb33db1d360 [0,2,0,0,0,0|2,0,0]=4 4714 B12R1.267 Fc1ccccc1NCCCCl f878bc210a65cbd4c20ec398956dcb58 [0,2,0,0,0,0|2,0,0]=4 4715 B12R1.267 Fc1ccccc1NCCCS 53267566d7f94c139dfab3268962ea80 [0,2,0,0,0,0|2,0,0]=4 4716 B12R1.267 Fc1ccccc1OCCCS 2546371899f430f36ee407a65eb19906 [0,2,0,0,0,0|2,0,0]=4 4717 B12R1.267 ICCNCc1ccccc1I 6524a5da724df7a531f281468be2fcd1 [0,2,0,0,0,0|2,0,0]=4 4718 B12R1.267 N#CCCNc1ccccc1Cl 931dbc16c9966ee8bb408da25fdc6449 [0,2,0,0,0,0|2,0,0]=4 4719 B12R1.267 N#CCCNc1ccccc1F a9c1b7e4341cdce470a60c66f8f117a5 [0,2,0,0,0,0|2,0,0]=4 4720 B12R1.267 N#CCCNc1ccccc1I 32ebfdca1d1a0618a87896db12f31f43 [0,2,0,0,0,0|2,0,0]=4 4721 B12R1.267 N#CCCNc1ccccc1S 048ed660b0476db77df8e6a45eff4917 [0,2,0,0,0,0|2,0,0]=4 4722 B12R1.267 N#CCCOc1ccccc1Cl 2c149c5a48e8631cede9cc534620f325 [0,2,0,0,0,0|2,0,0]=4 4723 B12R1.267 N#CCCOc1ccccc1F d2b09b8fe8fc3e119d0db9c72e3de50e [0,2,0,0,0,0|2,0,0]=4 4724 B12R1.267 N#CCCOc1ccccc1I 9cb8bccbe9afb1d6e3166d68c636ee8b [0,2,0,0,0,0|2,0,0]=4 4725 B12R1.267 N#CCNCc1ccccc1Br ecf46d486da975c4b090280e96129605 [0,2,0,0,0,0|2,0,0]=4 4726 B12R1.267 N#CCNCc1ccccc1Cl bda9e18ae255853691a9f2f34b4c10cc [0,2,0,0,0,0|2,0,0]=4 4727 B12R1.267 N#CCNCc1ccccc1F 76a02b3894bbf11552c14d331211de1d [0,2,0,0,0,0|2,0,0]=4 4728 B12R1.267 N#CCNCc1ccccc1I d6240d12693c9000211d82778589ba3d [0,2,0,0,0,0|2,0,0]=4 4729 B12R1.267 N#CCOCc1ccccc1Br fdcc9d7c2f742c88f5250a9a3d26c36f [0,2,0,0,0,0|2,0,0]=4 4730 B12R1.267 N#CCOCc1ccccc1Cl 189119f6540e8589a6558f3afd501555 [0,2,0,0,0,0|2,0,0]=4 4731 B12R1.267 N#CCOCc1ccccc1F ddc9f6ab3dd876c0bf1bbb3dfc3fef2d [0,2,0,0,0,0|2,0,0]=4 4732 B12R1.267 N#CCOCc1ccccc1I 9f77ecfea1cfde9b58f3dfc3c9bc65c2 [0,2,0,0,0,0|2,0,0]=4 4733 B12R1.267 N#CCOCc1ccccc1S cdc0ea9c7d1fe4de3898fbd3bf279243 [0,2,0,0,0,0|2,0,0]=4 4734 B12R1.267 N#CNCCc1ccccc1F 677802d7d8b0ae68c15012055008ff19 [0,2,0,0,0,0|1,0,1]=4 4735 B12R1.267 N#CNCCc1ccccc1I 0c2cdf10c87f3a9e472381bec9d907f4 [0,2,0,0,0,0|1,0,1]=4 4736 B12R1.267 NOCCNc1c[nH]ccc1=O 66962afb18f95e7b25d5d916488b85fc [0,2,0,0,0,0|2,0,0]=4 4737 B12R1.267 NOCCNc1c[nH]ccc1=S 0c6d6a7dec00ccbbd959e1f0a9890b64 [0,2,0,0,0,0|2,0,0]=4 4738 B12R1.267 NOCCNc1ccc[nH]c1=O 8ff5471154ee0cbf7b7b6c21435500d0 [0,2,0,0,0,0|2,0,0]=4 4739 B12R1.267 NOCCNc1cccc[n+]1[O-] 4c2881db5626a5d863bd48d6a54e5889 [0,2,0,0,0,0|2,0,0]=4 4740 B12R1.267 NOCCNc1ccccc1F dff59457b52a4f16511147a65bc60927 [0,2,0,0,0,0|1,0,0]=3 4741 B12R1.267 NOCCNc1ccccc1O f8e4a016872a9a28c73f22193ba9c8d4 [0,2,0,0,0,0|1,0,0]=3 4742 B12R1.267 NOCCNc1ccccc1S 9c3e7e35ebf17183a55aaf2cccf40cc5 [0,2,0,0,0,0|1,0,0]=3 4743 B12R1.267 NOCCNc1cccnc1F 2d154e6ed2886cb06f84510c56f31035 [0,2,0,0,0,0|2,0,0]=4 4744 B12R1.267 NOCCNc1cccnc1S f67923f29014e885edb2c9db13d21051 [0,2,0,0,0,0|2,0,0]=4 4745 B12R1.267 NOCCNc1ccncc1F 86f31641de285f3f960145b181a3d496 [0,2,0,0,0,0|2,0,0]=4 4746 B12R1.267 NOCCNc1cnccc1F a00f9d74a07b8c12248efa0d39df9740 [0,2,0,0,0,0|2,0,0]=4 4747 B12R1.267 NOCCNc1ncccc1F e249a9c0f198799b818da684a0fcbb0a [0,2,0,0,0,0|2,0,0]=4 4748 B12R1.267 NOCCNc1ncccc1O fdd52441379aeb4614a470e957c2898d [0,2,0,0,0,0|2,0,0]=4 4749 B12R1.267 O=CCCNc1ccccc1Br 874e1a6c347f6164d6f76f81d037228c [0,2,0,0,0,0|2,0,0]=4 4750 B12R1.267 O=CCCNc1ccccc1Cl 1c6d30842b7301659f553123533df432 [0,2,0,0,0,0|2,0,0]=4 4751 B12R1.267 O=CCCNc1ccccc1F 6df88e74d7b1661a0d843b07f9749746 [0,2,0,0,0,0|2,0,0]=4 4752 B12R1.267 O=CCCNc1ccccc1I 881e42383bbf5296171764938c5aa6ef [0,2,0,0,0,0|2,0,0]=4 4753 B12R1.267 O=CCCNc1ccccc1S 7fc375392e1303ff58ccb9038c0f94c9 [0,2,0,0,0,0|2,0,0]=4 4754 B12R1.267 O=CCCOc1ccccc1Br 885a649663f4de463e05664e40147895 [0,2,0,0,0,0|2,0,0]=4 4755 B12R1.267 O=CCCOc1ccccc1Cl bb8ed6fe1184d59f54ee1862615b9f83 [0,2,0,0,0,0|2,0,0]=4 4756 B12R1.267 O=CCCOc1ccccc1F 2fa7d662e256297d21a803d16994a232 [0,2,0,0,0,0|2,0,0]=4 4757 B12R1.267 O=CCCOc1ccccc1I 3d998d97d6cbb88be33cc3da9faff73d [0,2,0,0,0,0|2,0,0]=4 4758 B12R1.267 O=CCCOc1ccccc1S a0f94b38fd9dc1ece856456c8952ffd9 [0,2,0,0,0,0|2,0,0]=4 4759 B12R1.267 O=CCNCc1ccccc1Br e399bb781fedd0cac269d8fc2996f14e [0,2,0,0,0,0|2,0,0]=4 4760 B12R1.267 O=CCNCc1ccccc1Cl 592c95842baff0ea6b30762cc5ca2efd [0,2,0,0,0,0|2,0,0]=4 4761 B12R1.267 O=CCNCc1ccccc1F 6b4e11cb72d3c5539df6f9995b843adf [0,2,0,0,0,0|2,0,0]=4 4762 B12R1.267 O=CCNCc1ccccc1I d3d12b53cfc8ec5239c1dc3093326181 [0,2,0,0,0,0|2,0,0]=4 4763 B12R1.267 O=CCOCc1ccccc1Br 7bcb3a89680cf1f1fd0f4be96e3c1e39 [0,2,0,0,0,0|2,0,0]=4 4764 B12R1.267 O=CCOCc1ccccc1Cl aca279d69eedf49907f4a61ef721defc [0,2,0,0,0,0|2,0,0]=4 4765 B12R1.267 O=CCOCc1ccccc1F fa1a7a15615c0c19e2f4dc125ea3df1c [0,2,0,0,0,0|2,0,0]=4 4766 B12R1.267 O=CCOCc1ccccc1I 734a86351731ba5ba3154f178c5dbcaf [0,2,0,0,0,0|2,0,0]=4 4767 B12R1.267 O=CCOCc1ccccc1S 041cfb0f5c0f20b1c0d4c07d5f2d5308 [0,2,0,0,0,0|2,0,0]=4 4768 B12R1.267 O=CNCCc1ccccc1Br 4abde841c9ea0597beaa10637d5d75ab [0,2,0,0,0,0|1,0,1]=4 4769 B12R1.267 O=CNCCc1ccccc1Cl a719d8c70a8e416524cfd5e059197592 [0,2,0,0,0,0|1,0,1]=4 4770 B12R1.267 O=CNCCc1ccccc1F 054714acae9e4f3dedf843585ea0bd22 [0,2,0,0,0,0|1,0,1]=4 4771 B12R1.267 O=CNCCc1ccccc1O a376d3f785eac46eb060dea335ad7a1d [0,2,0,0,0,0|1,0,1]=4 4772 B12R1.267 O=c1ccccn1CCNCF b621c0e58b7defa6a90b9cfb1a445aab [0,2,0,0,0,0|2,0,0]=4 4773 B12R1.267 O=c1ccccn1CCNCO 3559c0f89bc9fedc2e675cb91525713d [0,2,0,0,0,0|2,0,0]=4 4774 B12R1.267 O=c1ccccn1CCOCF 4e341183821f5dff83454eca2a5cb454 [0,2,0,0,0,0|1,0,0]=3 4775 B12R1.267 OCCCNc1ccccc1Cl 784289199eb1f667fd138e273b3055b8 [0,2,0,0,0,0|2,0,0]=4 4776 B12R1.267 OCCCNc1ccccc1F dfcb9423e658f0892e1b586f7749e7a5 [0,2,0,0,0,0|2,0,0]=4 4777 B12R1.267 OCCCNc1ccccc1I 9885e0c34ab73fc7eab6f3f5b8cd97c3 [0,2,0,0,0,0|2,0,0]=4 4778 B12R1.267 OCCCNc1ccccc1S 4466a2e5214efe662657c1ef38d6a56d [0,2,0,0,0,0|2,0,0]=4 4779 B12R1.267 OCCNCc1ccccc1Br df94d6734ac0f560fb360e39dd4b947e [0,2,0,0,0,0|2,0,0]=4 4780 B12R1.267 OCCNCc1ccccc1Cl 3a5befb779e389def207bf8ccccf3eb8 [0,2,0,0,0,0|2,0,0]=4 4781 B12R1.267 OCCNCc1ccccc1F ed939a7a48266a2f41cc5e4f1e741af5 [0,2,0,0,0,0|2,0,0]=4 4782 B12R1.267 OCCNCc1ccccc1I ae82480090df47b9736b4a586b9e66c7 [0,2,0,0,0,0|2,0,0]=4 4783 B12R1.267 OCNCCc1ccccc1Cl 1b84a7a1568849a05b57068c3918906a [0,2,0,0,0,0|1,0,0]=3 4784 B12R1.267 OCNCCc1ccccc1F eb3b5d5f729061dd7d0426963bb11f7c [0,2,0,0,0,0|1,0,0]=3 4785 B12R1.267 OCNCCc1ncccc1Br 59d846cc0f6b983c7c08f6cd4a4433e7 [0,2,0,0,0,0|2,0,0]=4 4786 B12R1.267 SCCCNc1ccccc1Cl c4d03ceb3e538981668d71a7bfd8cbed [0,2,0,0,0,0|2,0,0]=4 4787 B12R1.267 SCCCNc1ccccc1I 88fd34af4dafde9f681eefa4032b9ba4 [0,2,0,0,0,0|2,0,0]=4 4788 B12R1.267 SCCCNc1ccccc1S 8761170f9c7958779f9ac8b8fa337365 [0,2,0,0,0,0|2,0,0]=4 4789 B12R1.267 SCCCOc1ccccc1Cl 35ae5ef6c1318a24833cc2707ca373c3 [0,2,0,0,0,0|2,0,0]=4 4790 B12R1.267 SCCNCc1ccccc1Br b8209633972813bf1bc7220008967dbd [0,2,0,0,0,0|2,0,0]=4 4791 B12R1.267 SCCNCc1ccccc1Cl ebf258e1c42f497575777369ac95da5f [0,2,0,0,0,0|2,0,0]=4 4792 B12R1.267 SCCNCc1ccccc1I 92d0326fdb78bab0b559a53a956bdcbc [0,2,0,0,0,0|2,0,0]=4 4793 B12R1.267 SCCOCc1ccccc1Br 2974a1a34077df01a526c92dc71fe7e1 [0,2,0,0,0,0|2,0,0]=4 4794 B12R1.267 SCCOCc1ccccc1Cl af22fdda4a6aed8dc8854b260c3db265 [0,2,0,0,0,0|2,0,0]=4 4795 B12R1.267 SCCOCc1ccccc1I 7e1445eeb10ec46213921732a4f0c947 [0,2,0,0,0,0|2,0,0]=4 4796 B12R1.267 SCCOCc1ccccc1S f4cf8e5f52b3bfc3ef5c599d397d5f9b [0,2,0,0,0,0|2,0,0]=4 4797 B12R1.267 Sc1ccccc1NCCCCl daeff88095140f125d25874d90c55a3e [0,2,0,0,0,0|2,0,0]=4 4798 B12R1.371 CCC(C)Nc1ccccc1Cl de4bf505a5bbedeb31e8a75347207b67 [0,2,0,0,0,0|2,0,0]=4 4799 B12R1.371 CCC(C)Nc1ccccc1I cd67cc2bf7f4f6d6c61e47b710e1bb55 [0,2,0,0,0,0|2,0,0]=4 4800 B12R1.371 CCC(C)Nc1ccccc1S ecd9db41f3061f567fc7308b02ebdeed [0,2,0,0,0,0|2,0,0]=4 4801 B12R1.371 CCC(C)Oc1ccccc1C a9f8caaebcb535b77e0f35c5ea074362 [0,2,0,0,0,0|2,0,0]=4 4802 B12R1.371 CCC(C)Oc1ccccc1Cl 6f598d947434a44e209cdf34b797bf91 [0,2,0,0,0,0|2,0,0]=4 4803 B12R1.371 CCC(C)Oc1ccccc1F b533bd9cc207ae92fa5d1dd0e1595cbc [0,2,0,0,0,0|2,0,0]=4 4804 B12R1.371 CCC(C)Oc1ccccc1I 35e6ee1db321949fbb0c54358fea5b12 [0,2,0,0,0,0|2,0,0]=4 4805 B12R1.371 CCC(C)Oc1ccccc1S 430f323aec7886fe8f11d201c4780b84 [0,2,0,0,0,0|2,0,0]=4 4806 B12R1.371 CCN(C)Cc1ccccc1Cl e51c361dfc91d5636e1e5a4513a1b110 [0,2,0,0,0,0|2,0,0]=4 4807 B12R1.371 CCN(C)Cc1ccccc1F 7c051a9a85266df48aaa13dcfa2254cd [0,2,0,0,0,0|2,0,0]=4 4808 B12R1.371 CCN(C)Cc1ccccc1I 83032bc0e16de05a0971afc60500c87f [0,2,0,0,0,0|2,0,0]=4 4809 B12R1.374 CCCNc1cc(ccc1Br)Cl 02b2a3d82b0d449e759aa2b3684f921b [0,2,0,0,0,0|2,0,0]=4 4810 B12R1.374 CCCNc1cc(ccc1C)C 50a50f03453cd3bc0af8f2724ba27d51 [0,2,0,0,0,0|2,0,0]=4 4811 B12R1.374 CCCNc1cc(ccc1C)Cl ea0afd2afc8bf7b9f2293953d8c5b9a9 [0,2,0,0,0,0|2,0,0]=4 4812 B12R1.374 CCCNc1cc(ccc1C)F 3f25a5e2d0341d6c886e4e0e74cba39e [0,2,0,0,0,0|2,0,0]=4 4813 B12R1.374 CCCNc1cc(ccc1C)I 0d550a0d27de70048a83d8fd9ccad2a5 [0,2,0,0,0,0|2,0,0]=4 4814 B12R1.374 CCCNc1cc(ccc1Cl)C ec707217c9f35589b06852d948057f32 [0,2,0,0,0,0|2,0,0]=4 4815 B12R1.374 CCCNc1cc(ccc1Cl)Cl 473f258f6fd2795d466821cdd7a7b892 [0,2,0,0,0,0|2,0,0]=4 4816 B12R1.374 CCCNc1cc(ccc1Cl)F f2b96bd720fefa10804c339f9cb62113 [0,2,0,0,0,0|2,0,0]=4 4817 B12R1.374 CCCNc1cc(ccc1Cl)I 58595e5d90d32804718d10a6a99a9a35 [0,2,0,0,0,0|2,0,0]=4 4818 B12R1.374 CCCNc1cc(ccc1F)Br f2de6fed384bb48eb08a1f316e2491df [0,2,0,0,0,0|2,0,0]=4 4819 B12R1.374 CCCNc1cc(ccc1F)C 4b7d4e9ca36718ad5090b0c169da5412 [0,2,0,0,0,0|2,0,0]=4 4820 B12R1.374 CCCNc1cc(ccc1F)Cl 1901b1c9decc78ea3898c3fdb75b758b [0,2,0,0,0,0|2,0,0]=4 4821 B12R1.374 CCCNc1cc(ccc1F)F 1843062e0a42db6deecf08447b9353ec [0,2,0,0,0,0|2,0,0]=4 4822 B12R1.374 CCCNc1cc(ccc1F)I 99bbabb1bc6b14e0248f3bcec543d258 [0,2,0,0,0,0|2,0,0]=4 4823 B12R1.374 CCCNc1cc(ccc1I)Br 971771b18c1263d5869aca2e728773e3 [0,2,0,0,0,0|2,0,0]=4 4824 B12R1.374 CCCNc1cc(ccc1I)C 6c7e217e952e3751cab26aaa5250c680 [0,2,0,0,0,0|2,0,0]=4 4825 B12R1.374 CCCNc1cc(ccc1I)Cl c4ed50f0c235e6d63240e4a5d975068d [0,2,0,0,0,0|2,0,0]=4 4826 B12R1.374 CCCNc1cc(ccc1I)F 860a04c6b38506f694b59212447db95b [0,2,0,0,0,0|2,0,0]=4 4827 B12R1.374 CCCNc1cc(ccc1N)N 36459471273be6793f78c727185692f6 [0,2,0,0,0,0|2,0,0]=4 4828 B12R1.374 CCCNc1cc(ccc1S)Br 7d9d856141938482be72d9a7e068c66d [0,2,0,0,0,0|2,0,0]=4 4829 B12R1.374 CCCNc1cc(ccc1S)Cl d82d7c261ba09313c396a9102d7d4922 [0,2,0,0,0,0|2,0,0]=4 4830 B12R1.374 CCCNc1cc(ccc1S)F 2a95bbd0540d87bf56a29d554b8d9425 [0,2,0,0,0,0|2,0,0]=4 4831 B12R1.374 CCCOc1cc(ccc1Br)Cl c167ed418c8e942bcc34939d30f1ca63 [0,2,0,0,0,0|2,0,0]=4 4832 B12R1.374 CCCOc1cc(ccc1Br)F 278eeb22854a3a575d20e01bda264a81 [0,2,0,0,0,0|2,0,0]=4 4833 B12R1.374 CCCOc1cc(ccc1Br)I 6898fb8deafd40105b8fdae4c004c376 [0,2,0,0,0,0|2,0,0]=4 4834 B12R1.374 CCCOc1cc(ccc1C)Br 329ad13382747bcf2ad36fe04bf44b50 [0,2,0,0,0,0|2,0,0]=4 4835 B12R1.374 CCCOc1cc(ccc1C)C dd222d3c4f2e9e8b0be7e485de4b135a [0,2,0,0,0,0|2,0,0]=4 4836 B12R1.374 CCCOc1cc(ccc1C)Cl 8c37a8c39155c8d4ae61de5f760606fa [0,2,0,0,0,0|2,0,0]=4 4837 B12R1.374 CCCOc1cc(ccc1C)F d6e4899ca0b93b9199a5119f7c066542 [0,2,0,0,0,0|2,0,0]=4 4838 B12R1.374 CCCOc1cc(ccc1C)I bdf89f8a65604ea871310e67062e80c5 [0,2,0,0,0,0|2,0,0]=4 4839 B12R1.374 CCCOc1cc(ccc1Cl)Br 6d239ee2abb95a76e297e6c0e64d7625 [0,2,0,0,0,0|2,0,0]=4 4840 B12R1.374 CCCOc1cc(ccc1Cl)C a5ab5b24bf11f836570ab2372b2fefdc [0,2,0,0,0,0|2,0,0]=4 4841 B12R1.374 CCCOc1cc(ccc1Cl)Cl 35b722ff6ae4fc205cdec28d72ade86d [0,2,0,0,0,0|2,0,0]=4 4842 B12R1.374 CCCOc1cc(ccc1Cl)F 04ebd2ff7fd196d3539ef74133114816 [0,2,0,0,0,0|2,0,0]=4 4843 B12R1.374 CCCOc1cc(ccc1Cl)I 7593e9a388c88aa80c253e553ab3be46 [0,2,0,0,0,0|2,0,0]=4 4844 B12R1.374 CCCOc1cc(ccc1F)Br 1821f7aa8466dd99b1cc05313cac5cb2 [0,2,0,0,0,0|2,0,0]=4 4845 B12R1.374 CCCOc1cc(ccc1F)C 38e6e56944e8d675d8c4918ee01309f2 [0,2,0,0,0,0|2,0,0]=4 4846 B12R1.374 CCCOc1cc(ccc1F)Cl 84bb84199b69e32d05e85ec5ee5bba01 [0,2,0,0,0,0|2,0,0]=4 4847 B12R1.374 CCCOc1cc(ccc1F)F 89f4689667f86406e9fcbcfb2d1aa510 [0,2,0,0,0,0|2,0,0]=4 4848 B12R1.374 CCCOc1cc(ccc1F)I 4e554be5a18bb93e0b6e599f756303ec [0,2,0,0,0,0|2,0,0]=4 4849 B12R1.374 CCCOc1cc(ccc1I)Br 9f35534bb6dd52234675eaf4e49eb29a [0,2,0,0,0,0|2,0,0]=4 4850 B12R1.374 CCCOc1cc(ccc1I)C c50f7bbf0998f712b32d3328ff05f058 [0,2,0,0,0,0|2,0,0]=4 4851 B12R1.374 CCCOc1cc(ccc1I)Cl 1e8b8f7d62a3998db9e0772cc91a7c69 [0,2,0,0,0,0|2,0,0]=4 4852 B12R1.374 CCCOc1cc(ccc1I)F 9cd97d6e6e2b8a733bf1f52558ecef72 [0,2,0,0,0,0|2,0,0]=4 4853 B12R1.374 CCNCc1cc(ccc1Br)Cl 0c2be0b3bf1985b5b05d219673535e98 [0,2,0,0,0,0|2,0,0]=4 4854 B12R1.374 CCNCc1cc(ccc1Br)F f128f7cbfb55e03dcd02a9a0e847e0bd [0,2,0,0,0,0|2,0,0]=4 4855 B12R1.374 CCNCc1cc(ccc1C)Cl 5c3d828b361e1f9f26336b7c94146fb9 [0,2,0,0,0,0|2,0,0]=4 4856 B12R1.374 CCNCc1cc(ccc1C)F 02242fbf50d00c61839387e2843635e4 [0,2,0,0,0,0|2,0,0]=4 4857 B12R1.374 CCNCc1cc(ccc1Cl)Br 050834f50ce26ac364993e9494b1c1ca [0,2,0,0,0,0|2,0,0]=4 4858 B12R1.374 CCNCc1cc(ccc1Cl)C c919fb8ddb460ac61332d88e0da44e30 [0,2,0,0,0,0|2,0,0]=4 4859 B12R1.374 CCNCc1cc(ccc1Cl)Cl dd04a93fb0933022526f5b5618e22d82 [0,2,0,0,0,0|2,0,0]=4 4860 B12R1.374 CCNCc1cc(ccc1Cl)F 6d42f707e0cc290ba215255ef3e9d023 [0,2,0,0,0,0|2,0,0]=4 4861 B12R1.374 CCNCc1cc(ccc1F)Br a14285a26da161d215dbe2db7b6f5147 [0,2,0,0,0,0|2,0,0]=4 4862 B12R1.374 CCNCc1cc(ccc1F)C a5ab831072cd1356849b68b69dabb15e [0,2,0,0,0,0|2,0,0]=4 4863 B12R1.374 CCNCc1cc(ccc1F)Cl 13dcc378fbfdb91a5208b55230788787 [0,2,0,0,0,0|2,0,0]=4 4864 B12R1.374 CCNCc1cc(ccc1F)F e1c8954a42473abf295230470c433b1d [0,2,0,0,0,0|2,0,0]=4 4865 B12R1.374 CCNCc1cc(ccc1I)Br 10e11bffc2eb415895f59307ff5663d8 [0,2,0,0,0,0|2,0,0]=4 4866 B12R1.374 CCOCC1=CC(=O)C=CC1=O ed73a92ade968d023c82ee9d85222322 [0,2,0,0,0,0|2,0,0]=4 4867 B12R1.374 CCOCc1cc(ccc1Br)F 2649867911bbc1bcde97cd6ff396369b [0,2,0,0,0,0|2,0,0]=4 4868 B12R1.374 CCOCc1cc(ccc1Br)I c33a1f0c3be037c82832345931c26451 [0,2,0,0,0,0|2,0,0]=4 4869 B12R1.374 CCOCc1cc(ccc1C)C d507ff95ae7e7ed07c81c4679109b168 [0,2,0,0,0,0|2,0,0]=4 4870 B12R1.374 CCOCc1cc(ccc1C)Cl c1c8283d59d3df16bd84de6a6a9650c5 [0,2,0,0,0,0|2,0,0]=4 4871 B12R1.374 CCOCc1cc(ccc1C)F 9d8cd07496e315f093c0d91899749223 [0,2,0,0,0,0|2,0,0]=4 4872 B12R1.374 CCOCc1cc(ccc1C)I 96609a5b90742ff331474ff3d351eef0 [0,2,0,0,0,0|2,0,0]=4 4873 B12R1.374 CCOCc1cc(ccc1Cl)Br 7a94299ab99aedae4813724b3ee877c5 [0,2,0,0,0,0|2,0,0]=4 4874 B12R1.374 CCOCc1cc(ccc1Cl)C 0935bc53e3e84704653080e53877693f [0,2,0,0,0,0|2,0,0]=4 4875 B12R1.374 CCOCc1cc(ccc1Cl)Cl 0d03e056fe112962304ef8f1f01a631e [0,2,0,0,0,0|2,0,0]=4 4876 B12R1.374 CCOCc1cc(ccc1Cl)F 174b4cf6ad8b18e4eafdbb289befb3a4 [0,2,0,0,0,0|2,0,0]=4 4877 B12R1.374 CCOCc1cc(ccc1Cl)I 1a4140a8c2ebde3831d6319704fea876 [0,2,0,0,0,0|2,0,0]=4 4878 B12R1.374 CCOCc1cc(ccc1F)Br 1bc5de0083e048968248d2b2f0bc8da1 [0,2,0,0,0,0|2,0,0]=4 4879 B12R1.374 CCOCc1cc(ccc1F)C 4ad0879138b363befe036ec632276981 [0,2,0,0,0,0|2,0,0]=4 4880 B12R1.374 CCOCc1cc(ccc1F)Cl 317d18036cb67e08f01a2b3f737adc04 [0,2,0,0,0,0|2,0,0]=4 4881 B12R1.374 CCOCc1cc(ccc1F)F ab315f3456af8db0ca7174294204f1f4 [0,2,0,0,0,0|2,0,0]=4 4882 B12R1.374 CCOCc1cc(ccc1F)I 9367780ec0d04bce3d0abc5a99b356ca [0,2,0,0,0,0|2,0,0]=4 4883 B12R1.374 CCOCc1cc(ccc1I)Br 208fce120ef73519b96c4871145e737b [0,2,0,0,0,0|2,0,0]=4 4884 B12R1.374 CCOCc1cc(ccc1I)C e9cfd991aca42a01a6223c55db8ab723 [0,2,0,0,0,0|2,0,0]=4 4885 B12R1.374 CCOCc1cc(ccc1I)Cl 6a4cbbee00ff6ef298570049ddfa01f2 [0,2,0,0,0,0|2,0,0]=4 4886 B12R1.374 CCOCc1cc(ccc1I)F 256ed01e834542a23ce0022331f399aa [0,2,0,0,0,0|2,0,0]=4 4887 B12R1.374 COCNc1cc(ccc1Br)Cl 9b1fe0d0966963bce459019a6ca28e75 [0,2,0,0,0,0|1,0,0]=3 4888 B12R1.374 COCNc1cc(ccc1Br)I 52dd65a5b4253964b87d050fb8ab2cfa [0,2,0,0,0,0|1,0,0]=3 4889 B12R1.374 COCNc1cc(ccc1C)Br f47089b3efc4eee3453cdc0ea37010fe [0,2,0,0,0,0|1,0,0]=3 4890 B12R1.374 COCNc1cc(ccc1C)C 11b2b63da7eb457530d7c6acce74b6a0 [0,2,0,0,0,0|1,0,0]=3 4891 B12R1.374 COCNc1cc(ccc1C)Cl 3eb626936d59869444566c950d33ea20 [0,2,0,0,0,0|1,0,0]=3 4892 B12R1.374 COCNc1cc(ccc1C)F 18b64d4c6d9ca4898521c8e0fcf55e28 [0,2,0,0,0,0|1,0,0]=3 4893 B12R1.374 COCNc1cc(ccc1C)I f9d6c120a1f9ca51ef52c90a4317a50f [0,2,0,0,0,0|1,0,0]=3 4894 B12R1.374 COCNc1cc(ccc1Cl)Br 8592759be78ce2f047eadabc58eb5a17 [0,2,0,0,0,0|1,0,0]=3 4895 B12R1.374 COCNc1cc(ccc1Cl)C 48cd11c79c5ad279aadf8df2552229ef [0,2,0,0,0,0|1,0,0]=3 4896 B12R1.374 COCNc1cc(ccc1Cl)Cl 57d6c891337d8d3aae6b381d23240082 [0,2,0,0,0,0|1,0,0]=3 4897 B12R1.374 COCNc1cc(ccc1Cl)F 79bf4ae43efa541fb07c6e973eca08ac [0,2,0,0,0,0|1,0,0]=3 4898 B12R1.374 COCNc1cc(ccc1Cl)I b149c5d85b56e612ff41ab7d4e3e937f [0,2,0,0,0,0|1,0,0]=3 4899 B12R1.374 COCNc1cc(ccc1F)Br d475b916ae4ed42b3799d4d450173c10 [0,2,0,0,0,0|1,0,0]=3 4900 B12R1.374 COCNc1cc(ccc1F)C c3c430cdc00ac485f61f6be7d5f319cf [0,2,0,0,0,0|1,0,0]=3 4901 B12R1.374 COCNc1cc(ccc1F)Cl 9852bec6dbe8269a57ad99529542cd29 [0,2,0,0,0,0|1,0,0]=3 4902 B12R1.374 COCNc1cc(ccc1F)F 360cdc278552b4c73f6aee34806ad4bf [0,2,0,0,0,0|1,0,0]=3 4903 B12R1.374 COCNc1cc(ccc1F)I 04741128d94051c84e5768e32eb5b288 [0,2,0,0,0,0|1,0,0]=3 4904 B12R1.374 COCNc1cc(ccc1I)Br 7ca2d70a79dae6ff8d3069d1cf5527ad [0,2,0,0,0,0|1,0,0]=3 4905 B12R1.374 COCNc1cc(ccc1I)C bf50458b96d0c9e22675a36013eea6c9 [0,2,0,0,0,0|1,0,0]=3 4906 B12R1.374 COCNc1cc(ccc1I)Cl 98cbbc046ee3468062e025b610a07f9f [0,2,0,0,0,0|1,0,0]=3 4907 B12R1.374 COCNc1cc(ccc1I)F 72c0cd6465c3ca9f5926b3447f7d814f [0,2,0,0,0,0|1,0,0]=3 4908 B12R1.374 COCNc1cc(ccc1S)Br ca01f0d7a421dce1aabc444186bc8ce1 [0,2,0,0,0,0|1,0,0]=3 4909 B12R1.374 COCNc1cc(ccc1S)Cl f863eaf5ffd6321875e747274fd6d189 [0,2,0,0,0,0|1,0,0]=3 4910 B12R1.374 COCNc1cc(ccc1S)F d348d5ad8b3b63186f0f92a49bf58273 [0,2,0,0,0,0|1,0,0]=3 4911 B12R1.374 COCNc1cc(cnc1Br)Br f8357166eeff983cc2742616a25bb857 [0,2,0,0,0,0|2,0,0]=4 4912 B12R1.374 COCNc1cc(cnc1Br)C 25db39731231c88854c91a3b86888fbd [0,2,0,0,0,0|2,0,0]=4 4913 B12R1.374 COCNc1cc(cnc1Br)Cl 5d8d04b946aea645a5b4c0a6a6d1f56c [0,2,0,0,0,0|2,0,0]=4 4914 B12R1.374 COCNc1cc(cnc1Br)F 72cfba25229c72691551790a09ffc3b5 [0,2,0,0,0,0|2,0,0]=4 4915 B12R1.374 COCNc1cc(cnc1Br)I 3720c41cbe59c294b5d6e562e5692ba7 [0,2,0,0,0,0|2,0,0]=4 4916 B12R1.374 COCNc1cc(cnc1C)Br 50229f2c3372f5acdfe2648ab8eac387 [0,2,0,0,0,0|2,0,0]=4 4917 B12R1.374 COCNc1cc(cnc1C)C 7653c622d6ab63d852534e1a0296b7e5 [0,2,0,0,0,0|2,0,0]=4 4918 B12R1.374 COCNc1cc(cnc1C)Cl 5f6d44c0288e61364600237c4f9bffb9 [0,2,0,0,0,0|2,0,0]=4 4919 B12R1.374 COCNc1cc(cnc1C)F 38aaa5a386efc3ad5092be0bad749d01 [0,2,0,0,0,0|2,0,0]=4 4920 B12R1.374 COCNc1cc(cnc1Cl)Br 8ddf51808fa6806d1c8c41e1c7f69bad [0,2,0,0,0,0|2,0,0]=4 4921 B12R1.374 COCNc1cc(cnc1Cl)C 2f6055c35a8cc55e4bf69237ceaed02d [0,2,0,0,0,0|2,0,0]=4 4922 B12R1.374 COCNc1cc(cnc1Cl)Cl 01751747f0d3ef188a9b5313646dfe4e [0,2,0,0,0,0|2,0,0]=4 4923 B12R1.374 COCNc1cc(cnc1Cl)F 19b7bc2212da7d12563d44aebfb51ba7 [0,2,0,0,0,0|2,0,0]=4 4924 B12R1.374 COCNc1cc(cnc1Cl)I 6a5714ba547bcd7d0cf02387a30d43a0 [0,2,0,0,0,0|2,0,0]=4 4925 B12R1.374 COCNc1cc(cnc1F)Br 9d5a5e668d7dff30632ea00dcacc2732 [0,2,0,0,0,0|2,0,0]=4 4926 B12R1.374 COCNc1cc(cnc1F)C 6c74770aa21b2f8372e74324cb190d61 [0,2,0,0,0,0|2,0,0]=4 4927 B12R1.374 COCNc1cc(cnc1F)Cl 209e8b6b9043e38cfe4107c6f3c70e41 [0,2,0,0,0,0|2,0,0]=4 4928 B12R1.374 COCNc1cc(cnc1I)Br 4467334bee3356a681e77dfeb90272b5 [0,2,0,0,0,0|2,0,0]=4 4929 B12R1.374 COCNc1cc(cnc1I)Cl 4a6bdfce3700d9bd3d112a6ae0a845c7 [0,2,0,0,0,0|2,0,0]=4 4930 B12R1.374 COCNc1cc(ncc1Br)Br 07e0aea1b042778735a3a7b68dbe0812 [0,2,0,0,0,0|2,0,0]=4 4931 B12R1.374 COCNc1cc(ncc1Br)Cl 8b993e9e3c4699a668a67f186838226f [0,2,0,0,0,0|2,0,0]=4 4932 B12R1.374 COCNc1cc(ncc1Br)F 7982b1891504147538cb01c2d79155e0 [0,2,0,0,0,0|2,0,0]=4 4933 B12R1.374 COCNc1cc(ncc1C)Br 24e6d4b2121841fa8101f4162edb4b64 [0,2,0,0,0,0|2,0,0]=4 4934 B12R1.374 COCNc1cc(ncc1C)C 4a18c934a4b107eacd215aac4b77d6cf [0,2,0,0,0,0|2,0,0]=4 4935 B12R1.374 COCNc1cc(ncc1C)Cl 60d7fda18f250fbac208c5e43d3b4e78 [0,2,0,0,0,0|2,0,0]=4 4936 B12R1.374 COCNc1cc(ncc1C)F 68bdd28f64e877455458f51fb08b51d5 [0,2,0,0,0,0|2,0,0]=4 4937 B12R1.374 COCNc1cc(ncc1Cl)Br 1dafaf6d44f724ee4d5f0a86f3fb9709 [0,2,0,0,0,0|2,0,0]=4 4938 B12R1.374 COCNc1cc(ncc1Cl)C 620c73b980fdba3903763c91dd1456ff [0,2,0,0,0,0|2,0,0]=4 4939 B12R1.374 COCNc1cc(ncc1Cl)Cl 37574447d06094d56893df85a6a61ffa [0,2,0,0,0,0|2,0,0]=4 4940 B12R1.374 COCNc1cc(ncc1Cl)F b4b0bb660a3e310f2622639329395c07 [0,2,0,0,0,0|2,0,0]=4 4941 B12R1.374 COCNc1cc(ncc1F)Br 7e1102b7defc985b4b97cfd706b598a0 [0,2,0,0,0,0|2,0,0]=4 4942 B12R1.374 COCNc1cc(ncc1F)C fea76f8375fdcee1b8d2858cd47a1d45 [0,2,0,0,0,0|2,0,0]=4 4943 B12R1.374 COCNc1cc(ncc1F)Cl 2702c09002837644416f577db64828ca [0,2,0,0,0,0|2,0,0]=4 4944 B12R1.374 COCNc1cc(ncc1F)F 12081528951396aff4df78c774fe1d86 [0,2,0,0,0,0|2,0,0]=4 4945 B12R1.374 COCNc1cc(ncc1I)Br 9d3854a7d2302fdcea1f69cba07ac0f3 [0,2,0,0,0,0|2,0,0]=4 4946 B12R1.374 COCNc1cc(ncc1I)C 11d70ae0f75b770776256f42893a7450 [0,2,0,0,0,0|2,0,0]=4 4947 B12R1.374 COCNc1cc(ncc1I)Cl b7e1de17a9314848d0f661135d1ddaf2 [0,2,0,0,0,0|2,0,0]=4 4948 B12R1.374 COCNc1cc(ncc1I)F 9c49347e6c016f29b7942d0ebb1ad9aa [0,2,0,0,0,0|2,0,0]=4 4949 B12R1.374 COCNc1nc(ccc1Br)Br e810c5af84e6c34d04e5d08430b37637 [0,2,0,0,0,0|2,0,0]=4 4950 B12R1.374 COCNc1nc(ccc1Br)C 9380a9f4fce5a2f16b04a3923c0b8520 [0,2,0,0,0,0|2,0,0]=4 4951 B12R1.374 COCNc1nc(ccc1Br)Cl 3af3136e4798640c2922e8bcc5a4a1bb [0,2,0,0,0,0|2,0,0]=4 4952 B12R1.374 COCNc1nc(ccc1Br)F abd5d570f5e6d1e2a937f3146b036e97 [0,2,0,0,0,0|2,0,0]=4 4953 B12R1.374 COCNc1nc(ccc1Br)I 87db081fc7ae99279c2af66c86ca5fa4 [0,2,0,0,0,0|2,0,0]=4 4954 B12R1.374 COCNc1nc(ccc1C)Br da33c0de33c9afd755e8deef0a0e33a5 [0,2,0,0,0,0|2,0,0]=4 4955 B12R1.374 COCNc1nc(ccc1C)C 8e7084b012a4c59b34ec3c90b5f1610b [0,2,0,0,0,0|2,0,0]=4 4956 B12R1.374 COCNc1nc(ccc1C)Cl e2c86e9ec27e3d51e177f4f5b845de64 [0,2,0,0,0,0|2,0,0]=4 4957 B12R1.374 COCNc1nc(ccc1Cl)Br 57a0e5868f1887c1f09aa7f71dc9bad7 [0,2,0,0,0,0|2,0,0]=4 4958 B12R1.374 COCNc1nc(ccc1Cl)Cl 595b02a99bc3e59ebdfefdc494232ebd [0,2,0,0,0,0|2,0,0]=4 4959 B12R1.374 COCNc1nc(ccc1F)Br c793fec21eff44fbd120087bc46c4047 [0,2,0,0,0,0|2,0,0]=4 4960 B12R1.374 COCNc1nc(ccc1F)C 9226877ef44f9135a6542307890977c4 [0,2,0,0,0,0|2,0,0]=4 4961 B12R1.374 COCNc1nc(ccc1F)Cl 7119fd131006bca834f55d546bff6f22 [0,2,0,0,0,0|2,0,0]=4 4962 B12R1.374 COCNc1nc(ccc1F)F 03db095fbef6e2cc211da4388e4f204e [0,2,0,0,0,0|2,0,0]=4 4963 B12R1.374 COCNc1nc(ccc1I)Br 74188d1eaa79def8b88c7d6b40c1c0fb [0,2,0,0,0,0|2,0,0]=4 4964 B12R1.374 COCNc1nc(ccc1I)C 4f30c7047485bc9e2515ba151f007d88 [0,2,0,0,0,0|2,0,0]=4 4965 B12R1.374 COCNc1nc(ccc1I)Cl dfd57f833a7eb8d4f9bcf001e3312a30 [0,2,0,0,0,0|2,0,0]=4 4966 B12R1.374 COCOc1cc(ccc1C)Br 258646c3b2de9bd430fc54b754753d6b [0,2,0,0,0,0|1,0,0]=3 4967 B12R1.374 COCOc1cc(ccc1C)C e95bfec3a2da92fed4f2b48fa739a4a4 [0,2,0,0,0,0|1,0,0]=3 4968 B12R1.374 COCOc1cc(ccc1C)Cl 4c779b82789a28ffdeb0da7a6e9fbeb5 [0,2,0,0,0,0|1,0,0]=3 4969 B12R1.374 COCOc1cc(ccc1C)F c4b36e3e2f680007b1c9ca4b2563c522 [0,2,0,0,0,0|1,0,0]=3 4970 B12R1.374 COCOc1cc(ccc1C)I 47815316a9fe4ddf5aa8637a0affa611 [0,2,0,0,0,0|1,0,0]=3 4971 B12R1.374 COCOc1cc(ccc1Cl)Br 58b5d1719b98af98d9a9069bbb79cc13 [0,2,0,0,0,0|1,0,0]=3 4972 B12R1.374 COCOc1cc(ccc1Cl)C ac4e0e776c4c3379e6f803a4f2b2149a [0,2,0,0,0,0|1,0,0]=3 4973 B12R1.374 COCOc1cc(ccc1Cl)Cl 37ecdd4c24a099d1234ddf338d29d2b1 [0,2,0,0,0,0|1,0,0]=3 4974 B12R1.374 COCOc1cc(ccc1Cl)F bc82f30028b9c091480455cbde381117 [0,2,0,0,0,0|1,0,0]=3 4975 B12R1.374 COCOc1cc(ccc1Cl)I dd0039f563b0eecb00a3f5397daf85d3 [0,2,0,0,0,0|1,0,0]=3 4976 B12R1.374 COCOc1cc(ccc1F)Br 7b531edddbaf4a6a795336a3f5dff94b [0,2,0,0,0,0|1,0,0]=3 4977 B12R1.374 COCOc1cc(ccc1F)C 40e123e4e17d9a11339c1a5a3bfbe1ce [0,2,0,0,0,0|1,0,0]=3 4978 B12R1.374 COCOc1cc(ccc1F)Cl df794e99ce53284f76318c122fbb8e50 [0,2,0,0,0,0|1,0,0]=3 4979 B12R1.374 COCOc1cc(ccc1F)F 395f9fde4dbd2e30735644fa11bc1ad0 [0,2,0,0,0,0|1,0,0]=3 4980 B12R1.374 COCOc1cc(ccc1F)I 39727f56ecf078fff09896b2b97892ee [0,2,0,0,0,0|1,0,0]=3 4981 B12R1.374 COCOc1cc(ccc1I)Br f27bd66ca016eae6efb1b4fe8746be0c [0,2,0,0,0,0|1,0,0]=3 4982 B12R1.374 COCOc1cc(ccc1I)C 8b957e43ff492b0cfe86de659e50cda6 [0,2,0,0,0,0|1,0,0]=3 4983 B12R1.374 COCOc1cc(ccc1I)Cl 3576fb723fbb772905972d32f64de3da [0,2,0,0,0,0|1,0,0]=3 4984 B12R1.374 COCOc1cc(ccc1I)F ad0651268822194cd1e5160ab5415700 [0,2,0,0,0,0|1,0,0]=3 4985 B12R1.374 COCOc1cc(cnc1Br)Br 55628a86c1c919ba382065471fea1160 [0,2,0,0,0,0|2,0,0]=4 4986 B12R1.374 COCOc1cc(cnc1Br)C 0f7c10bdafa0539f198ec714e9f7fa36 [0,2,0,0,0,0|2,0,0]=4 4987 B12R1.374 COCOc1cc(cnc1Br)Cl a232dfe52ed7961ebc8124fa53c8e077 [0,2,0,0,0,0|2,0,0]=4 4988 B12R1.374 COCOc1cc(cnc1Br)F 64784db6790d4fd5fa34645972067135 [0,2,0,0,0,0|2,0,0]=4 4989 B12R1.374 COCOc1cc(cnc1C)Br 7fd38c6ea913ed8c7211d1f74d17887c [0,2,0,0,0,0|2,0,0]=4 4990 B12R1.374 COCOc1cc(cnc1C)Cl 1802dc3658d9c7040465e5f05d335e90 [0,2,0,0,0,0|2,0,0]=4 4991 B12R1.374 COCOc1cc(cnc1C)F dbc6358fced486e832978d0ffed084a5 [0,2,0,0,0,0|2,0,0]=4 4992 B12R1.374 COCOc1cc(cnc1Cl)Br eb148567766d80390e59c99e538a9c45 [0,2,0,0,0,0|2,0,0]=4 4993 B12R1.374 COCOc1cc(cnc1Cl)C 088cf15654f9e48975afc94450ff5b87 [0,2,0,0,0,0|2,0,0]=4 4994 B12R1.374 COCOc1cc(cnc1Cl)Cl 65e5671ace293784d59f65263d6b021f [0,2,0,0,0,0|2,0,0]=4 4995 B12R1.374 COCOc1cc(cnc1Cl)F a42a044fe09c2a2aa4417df00437478b [0,2,0,0,0,0|2,0,0]=4 4996 B12R1.374 COCOc1cc(cnc1F)Br 45d5a5504930f23c05884890ed71cc2c [0,2,0,0,0,0|2,0,0]=4 4997 B12R1.374 COCOc1cc(cnc1F)C 66d4c7b7787697ca05d1da0d03301650 [0,2,0,0,0,0|2,0,0]=4 4998 B12R1.374 COCOc1cc(cnc1F)Cl 8b1c88ce81b75814efc61d4acb894478 [0,2,0,0,0,0|2,0,0]=4 4999 B12R1.374 COCOc1cc(cnc1F)F 52c84c9a430754b20c1ffc1da203dfcf [0,2,0,0,0,0|2,0,0]=4 5000 B12R1.374 COCOc1cc(cnc1I)Br c1820765600b43a7618a262cdcee4dea [0,2,0,0,0,0|2,0,0]=4 5001 B12R1.374 COCOc1cc(cnc1I)Cl ad532e1f2699beed330978326cca9854 [0,2,0,0,0,0|2,0,0]=4 5002 B12R1.374 COCOc1cc(cnc1I)F 581e7a7f274192ddb3957c14f08cf07b [0,2,0,0,0,0|2,0,0]=4 5003 B12R1.374 COCOc1cc(ncc1Br)Br f2bc4f7227fa9ef0037a7dd2d85f240b [0,2,0,0,0,0|2,0,0]=4 5004 B12R1.374 COCOc1cc(ncc1Br)C adc21e664a0e812d0956b67d8104c319 [0,2,0,0,0,0|2,0,0]=4 5005 B12R1.374 COCOc1cc(ncc1Br)Cl 503e50cad68cfce907869de0e11ccbf9 [0,2,0,0,0,0|2,0,0]=4 5006 B12R1.374 COCOc1cc(ncc1Br)F 1371cd7a6d6f9e9a45d07f932449f4e1 [0,2,0,0,0,0|2,0,0]=4 5007 B12R1.374 COCOc1cc(ncc1C)Br a48ceab34f6f4f23f546ee13d8b4e831 [0,2,0,0,0,0|2,0,0]=4 5008 B12R1.374 COCOc1cc(ncc1C)Cl 7efbdda61fc4345c882219c0306cb664 [0,2,0,0,0,0|2,0,0]=4 5009 B12R1.374 COCOc1cc(ncc1C)F 38d1d8e0605d88625caa3026b0928af2 [0,2,0,0,0,0|2,0,0]=4 5010 B12R1.374 COCOc1cc(ncc1Cl)Br 90ebc63999a2a0808a05b7bb56dcd689 [0,2,0,0,0,0|2,0,0]=4 5011 B12R1.374 COCOc1cc(ncc1Cl)C 1fd651c57c7620c18e2116a7798214bf [0,2,0,0,0,0|2,0,0]=4 5012 B12R1.374 COCOc1cc(ncc1Cl)Cl a9561eb3a13cb13d6c951bc59985cc3b [0,2,0,0,0,0|2,0,0]=4 5013 B12R1.374 COCOc1cc(ncc1F)Br 66ef2abbea19d0171eccbcf0bb977f4f [0,2,0,0,0,0|2,0,0]=4 5014 B12R1.374 COCOc1cc(ncc1F)Cl db064f584cf93308bdaa5069cda87b37 [0,2,0,0,0,0|2,0,0]=4 5015 B12R1.374 COCOc1cc(ncc1I)Cl fa230be78e43191ceca63c4297277d3b [0,2,0,0,0,0|2,0,0]=4 5016 B12R1.374 COCOc1cc(ncc1I)F 05b1d3a41826bfacb36403556aa3885e [0,2,0,0,0,0|2,0,0]=4 5017 B12R1.374 COCOc1cn(ccc1=O)C 686b3f99d4f69d93d50ea9f16599d9df [0,2,0,0,0,0|2,0,0]=4 5018 B12R1.374 COCOc1nc(ccc1Br)Br c0cdb10558fb514e8f7a5463c02259b2 [0,2,0,0,0,0|2,0,0]=4 5019 B12R1.374 COCOc1nc(ccc1Br)C aff1d6bbb316ed7a279fba5b359ee125 [0,2,0,0,0,0|2,0,0]=4 5020 B12R1.374 COCOc1nc(ccc1Br)Cl 80d66ba8b936a83bb0688d14d0311b87 [0,2,0,0,0,0|2,0,0]=4 5021 B12R1.374 COCOc1nc(ccc1Cl)Br 06f67383c485fa4085c8060e5a00d906 [0,2,0,0,0,0|2,0,0]=4 5022 B12R1.374 COCOc1nc(ccc1Cl)Cl f951494a51e0971878a6c1bbd33357b5 [0,2,0,0,0,0|2,0,0]=4 5023 B12R1.374 COCOc1nc(ccc1F)Cl 41abd2503e51cc953a0eaf932a4811cf [0,2,0,0,0,0|2,0,0]=4 5024 B12R1.374 COCOc1nc(ccc1I)Br 2b027e053817a05341925b11519c1a4c [0,2,0,0,0,0|2,0,0]=4 5025 B12R1.374 COCOc1nc(ccc1I)C ad0e486a11f769a6865172772b2cdbf7 [0,2,0,0,0,0|2,0,0]=4 5026 B12R1.374 COCOc1nc(ccc1I)Cl ff92fdcc680ad9ef7ee7f51f8cd6d703 [0,2,0,0,0,0|2,0,0]=4 5027 B12R1.374 COCOn1cc(ccc1=O)Br 7f09e4889b064378fb74aeeb0f5ac5c7 [0,2,0,0,0,0|2,0,0]=4 5028 B12R1.374 CSCNc1cc(ccc1C)C 48f5a834dce3609b0cf3eeb824b6a12f [0,2,0,0,0,0|1,1,0]=4 5029 B12R1.374 CSCNc1cc(ccc1C)Cl 32fa436dc072ca161363617d7e43baf5 [0,2,0,0,0,0|1,1,0]=4 5030 B12R1.374 CSCNc1cc(ccc1C)F 8b19014f731ebd744cc210949a9fb17b [0,2,0,0,0,0|1,1,0]=4 5031 B12R1.374 CSCNc1cc(ccc1C)I 29eff50e174ad49f83f036c654598d00 [0,2,0,0,0,0|1,1,0]=4 5032 B12R1.374 CSCNc1cc(ccc1Cl)Cl 0ab8334d310bdce0a539a1bbec8ea58c [0,2,0,0,0,0|1,1,0]=4 5033 B12R1.374 CSCNc1cc(ccc1Cl)F 7630a425bd9d2e2638b0df327d7dcc24 [0,2,0,0,0,0|1,1,0]=4 5034 B12R1.374 CSCNc1cc(ccc1Cl)I 650a0b215f59d223cbbab0220252d697 [0,2,0,0,0,0|1,1,0]=4 5035 B12R1.374 CSCNc1cc(ccc1F)C 48b056c62c8b676eae02654a4aa5b5c0 [0,2,0,0,0,0|1,1,0]=4 5036 B12R1.374 CSCNc1cc(ccc1F)Cl c2247ef15857c7595cdfa92cc7be1661 [0,2,0,0,0,0|1,1,0]=4 5037 B12R1.374 CSCNc1cc(ccc1F)F 1354e3cdfd0fb2caa3f6493923109f15 [0,2,0,0,0,0|1,1,0]=4 5038 B12R1.374 CSCNc1cc(ccc1F)I 58e5122694174908823301219d76c704 [0,2,0,0,0,0|1,1,0]=4 5039 B12R1.374 CSCNc1cc(ccc1I)Br 32328032e64363cbf0380444c969594c [0,2,0,0,0,0|1,1,0]=4 5040 B12R1.374 CSCNc1cc(ccc1I)C af2f4453d59c1a6dac709eb3a312884a [0,2,0,0,0,0|1,1,0]=4 5041 B12R1.374 CSCNc1cc(ccc1I)Cl 48b679b15274c6b4fa910a6ccb9d67bb [0,2,0,0,0,0|1,1,0]=4 5042 B12R1.374 CSCNc1cc(ccc1I)F b59382ef225f86bc23416484a84af6d9 [0,2,0,0,0,0|1,1,0]=4 5043 B12R1.374 CSCOc1cc(ccc1Br)I 81d6370991637b45953b85d3cd5e8bcc [0,2,0,0,0,0|1,1,0]=4 5044 B12R1.374 CSCOc1cc(ccc1C)Br 0a548497c12c29f2e9c2f52f8c3a5489 [0,2,0,0,0,0|1,1,0]=4 5045 B12R1.374 CSCOc1cc(ccc1C)C 077b318796cea4d7eb4dba0d5a332ccc [0,2,0,0,0,0|1,1,0]=4 5046 B12R1.374 CSCOc1cc(ccc1C)Cl 90cd552efcf17452de9982538c98fd94 [0,2,0,0,0,0|1,1,0]=4 5047 B12R1.374 CSCOc1cc(ccc1C)F c855ab6c8f1cb1bd2fe7998667aaeca0 [0,2,0,0,0,0|1,1,0]=4 5048 B12R1.374 CSCOc1cc(ccc1C)I 70ba3baec2034a5d47d4a6cc5a74eef3 [0,2,0,0,0,0|1,1,0]=4 5049 B12R1.374 CSCOc1cc(ccc1Cl)Br 811b7a57350cea06dea6622baaf9db98 [0,2,0,0,0,0|1,1,0]=4 5050 B12R1.374 CSCOc1cc(ccc1Cl)C 57f1755f006bd706ec567937fc050309 [0,2,0,0,0,0|1,1,0]=4 5051 B12R1.374 CSCOc1cc(ccc1Cl)Cl 3d6f7527bfad8f88be8229fc1a71b6c0 [0,2,0,0,0,0|1,1,0]=4 5052 B12R1.374 CSCOc1cc(ccc1Cl)F 675782e984007089c6ef2ad7373a9fb9 [0,2,0,0,0,0|1,1,0]=4 5053 B12R1.374 CSCOc1cc(ccc1Cl)I 00613a67b1870d6a7057984beda76436 [0,2,0,0,0,0|1,1,0]=4 5054 B12R1.374 CSCOc1cc(ccc1F)Br a35d0c37acc58e7bd347029cd5044a21 [0,2,0,0,0,0|1,1,0]=4 5055 B12R1.374 CSCOc1cc(ccc1F)C 873334163ad4883659f09ece21200baa [0,2,0,0,0,0|1,1,0]=4 5056 B12R1.374 CSCOc1cc(ccc1F)Cl 6987c33546a7ad70a274a02c0af47736 [0,2,0,0,0,0|1,1,0]=4 5057 B12R1.374 CSCOc1cc(ccc1F)F a797f1a3fa06c88845152b382f254fe9 [0,2,0,0,0,0|1,1,0]=4 5058 B12R1.374 CSCOc1cc(ccc1F)I 1bcdbf708c9ee762ed1588172eedf3d5 [0,2,0,0,0,0|1,1,0]=4 5059 B12R1.374 CSCOc1cc(ccc1I)Br 92006d15bbee3c6cd4bc9e207895e672 [0,2,0,0,0,0|1,1,0]=4 5060 B12R1.374 CSCOc1cc(ccc1I)C a7787e2f9667c213b599870e0739cf7e [0,2,0,0,0,0|1,1,0]=4 5061 B12R1.374 CSCOc1cc(ccc1I)Cl 9f23d744bd7dce3f23d90b3fed4b4e06 [0,2,0,0,0,0|1,1,0]=4 5062 B12R1.374 CSCOc1cc(ccc1I)F 60fa8342aa60463a722abcc0f75143d1 [0,2,0,0,0,0|1,1,0]=4 5063 B12R1.1631 CCCNc1c(cccc1C)C 6fa514017b0d2a3d8d5aa663660bff82 [0,2,0,0,0,0|2,0,0]=4 5064 B12R1.1631 CCCNc1c(cccc1Cl)C 755dc7d95d239069b1b587efde5a655e [0,2,0,0,0,0|2,0,0]=4 5065 B12R1.1631 CCCNc1c(cccc1Cl)Cl dbfd83ed91b5c261a50b0e2eaa64ae85 [0,2,0,0,0,0|2,0,0]=4 5066 B12R1.1631 CCCNc1c(cccc1Cl)F 568244574b2cd070cb4004dda7849d6c [0,2,0,0,0,0|2,0,0]=4 5067 B12R1.1631 CCCNc1c(cccc1F)C 00272e8e5eaacd12d5c96f9c3634d232 [0,2,0,0,0,0|2,0,0]=4 5068 B12R1.1631 CCCNc1c(cccc1F)F 582978bc5ff7a546e6e970066e48a85f [0,2,0,0,0,0|2,0,0]=4 5069 B12R1.1631 CCCNc1c(cccc1I)C 825df22c3e8b1c9fc925f18421340f30 [0,2,0,0,0,0|2,0,0]=4 5070 B12R1.1631 CCCNc1c(cccc1I)Cl caaeff24fa1b76f67445f56ccbc21fc4 [0,2,0,0,0,0|2,0,0]=4 5071 B12R1.1631 CCCNc1c(cccc1I)F d629cfddba24f1b7a49e80b74b0b36fd [0,2,0,0,0,0|2,0,0]=4 5072 B12R1.1631 CCCNc1c(cccc1S)F fb6f0c355db5487af21dab44d45e0258 [0,2,0,0,0,0|2,0,0]=4 5073 B12R1.1631 CCCOc1c(cccc1Br)Br 847a3f83e1d564e11005e4488c1314dd [0,2,0,0,0,0|2,0,0]=4 5074 B12R1.1631 CCCOc1c(cccc1Br)C c46c535e311dfc3b1a5c3539134d807f [0,2,0,0,0,0|2,0,0]=4 5075 B12R1.1631 CCCOc1c(cccc1Br)Cl 56671e510cefde9b2aa900f162ad953c [0,2,0,0,0,0|2,0,0]=4 5076 B12R1.1631 CCCOc1c(cccc1Br)F 9e3c3c460a315366ae76bf1fa80b1083 [0,2,0,0,0,0|2,0,0]=4 5077 B12R1.1631 CCCOc1c(cccc1C)C c4a8d81c04b99cc10dfac09ad3a600ea [0,2,0,0,0,0|2,0,0]=4 5078 B12R1.1631 CCCOc1c(cccc1Cl)C 2fb3703b8ef2f19798a8697d0660cd83 [0,2,0,0,0,0|2,0,0]=4 5079 B12R1.1631 CCCOc1c(cccc1Cl)Cl 92456ddc24db8f4802c16a9c3d1798a3 [0,2,0,0,0,0|2,0,0]=4 5080 B12R1.1631 CCCOc1c(cccc1Cl)F 47c942054bd196d28bf4a1c8e24e978c [0,2,0,0,0,0|2,0,0]=4 5081 B12R1.1631 CCCOc1c(cccc1F)C 5cdd4c2a7e0207976995d577b759ec91 [0,2,0,0,0,0|2,0,0]=4 5082 B12R1.1631 CCCOc1c(cccc1F)F 150b9c9b34fbfcea1851ccac5caf25cf [0,2,0,0,0,0|2,0,0]=4 5083 B12R1.1631 CCCOc1c(cccc1I)C caad23f78031de1d292e01df6be6484e [0,2,0,0,0,0|2,0,0]=4 5084 B12R1.1631 CCCOc1c(cccc1I)Cl d4aa1937d2cc24014d844b295068a5bd [0,2,0,0,0,0|2,0,0]=4 5085 B12R1.1631 CCCOc1c(cccc1I)F 0023296da4f3f0cdfe5cb7ad2fa868d3 [0,2,0,0,0,0|2,0,0]=4 5086 B12R1.1631 CCCOc1c(cccc1I)I cb1fb3fe1bb40116d181ea41db834892 [0,2,0,0,0,0|2,0,0]=4 5087 B12R1.1631 CCNCc1c(cccc1Br)Br beaadcb065659067f7cb09b5563429f5 [0,2,0,0,0,0|2,0,0]=4 5088 B12R1.1631 CCNCc1c(cccc1Br)Cl f9a29919dc762a843ba703c72d31bbb5 [0,2,0,0,0,0|2,0,0]=4 5089 B12R1.1631 CCNCc1c(cccc1Br)F 2d2c052bbbc300be99899c541cc2a622 [0,2,0,0,0,0|2,0,0]=4 5090 B12R1.1631 CCNCc1c(cccc1C)C e9bdad412735bbf372768149f197beeb [0,2,0,0,0,0|2,0,0]=4 5091 B12R1.1631 CCNCc1c(cccc1Cl)C b7efe633f925d16e00b1145b4b57f422 [0,2,0,0,0,0|2,0,0]=4 5092 B12R1.1631 CCNCc1c(cccc1Cl)Cl ba1640cc7c2f75bc6a3d9151f14ee648 [0,2,0,0,0,0|2,0,0]=4 5093 B12R1.1631 CCNCc1c(cccc1Cl)F a755172c4e56d529f9be2d8dd08f1a5e [0,2,0,0,0,0|2,0,0]=4 5094 B12R1.1631 CCNCc1c(cccc1F)C a9948c5ad0fff8699dfd212a337ea716 [0,2,0,0,0,0|2,0,0]=4 5095 B12R1.1631 CCNCc1c(cccc1F)F 81e7c9957599c603f67c665a43768861 [0,2,0,0,0,0|2,0,0]=4 5096 B12R1.1631 CCOCc1c(cccc1Br)Br 4179e62ba6916bf4d4d59fb0f095a766 [0,2,0,0,0,0|2,0,0]=4 5097 B12R1.1631 CCOCc1c(cccc1Br)C 6d5b6d5e71dff1e815e9c914827734ca [0,2,0,0,0,0|2,0,0]=4 5098 B12R1.1631 CCOCc1c(cccc1Br)Cl b3bd3490fea946ab0458f5b694a0adec [0,2,0,0,0,0|2,0,0]=4 5099 B12R1.1631 CCOCc1c(cccc1Br)F bec5ac33edd0ec7fb607e8abaaaf515e [0,2,0,0,0,0|2,0,0]=4 5100 B12R1.1631 CCOCc1c(cccc1C)C 2f83ecb4bc0da4ce337d384197f472b9 [0,2,0,0,0,0|2,0,0]=4 5101 B12R1.1631 CCOCc1c(cccc1Cl)C e147b211cffa2eefc68092a931706b36 [0,2,0,0,0,0|2,0,0]=4 5102 B12R1.1631 CCOCc1c(cccc1Cl)Cl 5bcfc6202cce33727b542b6ca08644fa [0,2,0,0,0,0|2,0,0]=4 5103 B12R1.1631 CCOCc1c(cccc1Cl)F 731560168538483e173aea415a4650b5 [0,2,0,0,0,0|2,0,0]=4 5104 B12R1.1631 CCOCc1c(cccc1F)C 6768659c9d19a14b96b1f7c87ba1814c [0,2,0,0,0,0|2,0,0]=4 5105 B12R1.1631 CCOCc1c(cccc1F)F 6ac38fa9156def8ace530cca5a1e3828 [0,2,0,0,0,0|2,0,0]=4 5106 B12R1.1631 CCOCc1c(cccc1I)Br 3eb74e96a215c8313829d99c48541a82 [0,2,0,0,0,0|2,0,0]=4 5107 B12R1.1631 CCOCc1c(cccc1I)C 1f9fd9c6520debe1de51500ddfe4f175 [0,2,0,0,0,0|2,0,0]=4 5108 B12R1.1631 CCOCc1c(cccc1I)Cl c90870f879850730bf6145bab50364c6 [0,2,0,0,0,0|2,0,0]=4 5109 B12R1.1631 CCOCc1c(cccc1I)F 6df29e2018ccaefc66e14cd3d6020e51 [0,2,0,0,0,0|2,0,0]=4 5110 B12R1.1631 COCNc1c(cc[nH]c1=O)F 9b74d040d9871387d7cdd604a1d34bd5 [0,2,0,0,0,0|2,0,0]=4 5111 B12R1.1631 COCNc1c(cccc1C)C 86d7d57f708fc63f997d301397a4ecdd [0,2,0,0,0,0|1,0,0]=3 5112 B12R1.1631 COCNc1c(cccc1Cl)C be276eafc3fb9e792dcced5b67c4d51c [0,2,0,0,0,0|1,0,0]=3 5113 B12R1.1631 COCNc1c(cccc1Cl)Cl 1b73347b16b7cad46d10aa6451eb7ebb [0,2,0,0,0,0|1,0,0]=3 5114 B12R1.1631 COCNc1c(cccc1Cl)F e26713466005071bea3e1208b77fb7b5 [0,2,0,0,0,0|1,0,0]=3 5115 B12R1.1631 COCNc1c(cccc1Cl)S 5b1e4ff624600b060999c4e88f178491 [0,2,0,0,0,0|1,0,0]=3 5116 B12R1.1631 COCNc1c(cccc1F)C 80ca836daeba61a7a06360577ebab95f [0,2,0,0,0,0|1,0,0]=3 5117 B12R1.1631 COCNc1c(cccc1F)F da63665c79e96754d94e9f999440fefc [0,2,0,0,0,0|1,0,0]=3 5118 B12R1.1631 COCNc1c(cccc1I)C 2ba2cd1042267e15351308777a035e5e [0,2,0,0,0,0|1,0,0]=3 5119 B12R1.1631 COCNc1c(cccc1I)Cl c742be9f879d23ec9f71772e7c13b818 [0,2,0,0,0,0|1,0,0]=3 5120 B12R1.1631 COCNc1c(cccc1I)F 679d849481b23d52a267808b122d031c [0,2,0,0,0,0|1,0,0]=3 5121 B12R1.1631 COCNc1c(cccc1S)F f6ec78f432916223603937dca9168910 [0,2,0,0,0,0|1,0,0]=3 5122 B12R1.1631 COCNc1c(ccnc1Br)Br 492053e12bc4d5bdb58f49390183a86c [0,2,0,0,0,0|2,0,0]=4 5123 B12R1.1631 COCNc1c(ccnc1Br)C 3244d185f1240fdcf1b123ddeeff8c60 [0,2,0,0,0,0|2,0,0]=4 5124 B12R1.1631 COCNc1c(ccnc1Br)Cl 3869c273a8e475331dccd8ce044b3f30 [0,2,0,0,0,0|2,0,0]=4 5125 B12R1.1631 COCNc1c(ccnc1C)Br 7727d2c0c91c58ec4549f6df9eeed292 [0,2,0,0,0,0|2,0,0]=4 5126 B12R1.1631 COCNc1c(ccnc1C)C b9fb0bf297aaabd1488d6285a566524c [0,2,0,0,0,0|2,0,0]=4 5127 B12R1.1631 COCNc1c(ccnc1C)Cl 9f911a3cec8e60f91ff3e1a62f365e66 [0,2,0,0,0,0|2,0,0]=4 5128 B12R1.1631 COCNc1c(ccnc1Cl)Br 39b86fcc3a6ec878c9dec26cd98a43ef [0,2,0,0,0,0|2,0,0]=4 5129 B12R1.1631 COCNc1c(ccnc1Cl)C 42b2a7423ee9cf59de61f1dfe998fddf [0,2,0,0,0,0|2,0,0]=4 5130 B12R1.1631 COCNc1c(ccnc1Cl)Cl 0d9d770a324785127a46b4012b68defd [0,2,0,0,0,0|2,0,0]=4 5131 B12R1.1631 COCNc1c(ccnc1Cl)I c18fd1f2be9fff2d45b627909f6a4f82 [0,2,0,0,0,0|2,0,0]=4 5132 B12R1.1631 COCNc1c(ccnc1F)C c83dc0332c1c5a8347e73dd92e28adf9 [0,2,0,0,0,0|2,0,0]=4 5133 B12R1.1631 COCNc1c(ccnc1F)Cl 943a7e0e4aef592769692ed03455a225 [0,2,0,0,0,0|2,0,0]=4 5134 B12R1.1631 COCNc1c(cncc1Br)Br 52a407e7c9494ea8f3c9a65835a011e4 [0,2,0,0,0,0|2,0,0]=4 5135 B12R1.1631 COCNc1c(cncc1Br)C df89d2feac7478bd4dad93fe088a9b9f [0,2,0,0,0,0|2,0,0]=4 5136 B12R1.1631 COCNc1c(cncc1Br)Cl 5fd0d06f0ed8f4d75360c5003de9cb6f [0,2,0,0,0,0|2,0,0]=4 5137 B12R1.1631 COCNc1c(cncc1Br)F 1ca60843528b754ea5e97673049d0b4f [0,2,0,0,0,0|2,0,0]=4 5138 B12R1.1631 COCNc1c(cncc1C)C c041436fad7486be1906ff6672ebdabe [0,2,0,0,0,0|2,0,0]=4 5139 B12R1.1631 COCNc1c(cncc1Cl)C 93ba005952238bc474d2d839548813ca [0,2,0,0,0,0|2,0,0]=4 5140 B12R1.1631 COCNc1c(cncc1Cl)Cl 2209a2b0b650f2a2f36cf8abb223a523 [0,2,0,0,0,0|2,0,0]=4 5141 B12R1.1631 COCNc1c(cncc1F)C e3b8e6aa729507c8ec5b2cbb32800018 [0,2,0,0,0,0|2,0,0]=4 5142 B12R1.1631 COCNc1c(cncc1F)F 3922442cb7252282c121e2e2f447feca [0,2,0,0,0,0|2,0,0]=4 5143 B12R1.1631 COCNc1c(cncc1I)Br b1f56c40a115ac8c3acb5644c4af1a48 [0,2,0,0,0,0|2,0,0]=4 5144 B12R1.1631 COCNc1c(cncc1I)C 2a42f2770c26489c741c57035b492e47 [0,2,0,0,0,0|2,0,0]=4 5145 B12R1.1631 COCNc1c(cncc1I)Cl 74efb3ed327459ff55be4ac33568a846 [0,2,0,0,0,0|2,0,0]=4 5146 B12R1.1631 COCNc1c(cncc1I)F 1a87ae43d9ff51e0d58d6232dd25c683 [0,2,0,0,0,0|2,0,0]=4 5147 B12R1.1631 COCNc1c(cncc1I)I 38cec811e47dc0ffc38ad7d9de623ca3 [0,2,0,0,0,0|2,0,0]=4 5148 B12R1.1631 COCOc1c([nH]ccc1=O)C a40ee38b3c925e58449f083da38851db [0,2,0,0,0,0|2,0,0]=4 5149 B12R1.1631 COCOc1c(cccc1Br)C 22ffeade5be3230da337fc2438a7a786 [0,2,0,0,0,0|1,0,0]=3 5150 B12R1.1631 COCOc1c(cccc1Br)F a9f9e2335d20a986319ca26a50fb4a7f [0,2,0,0,0,0|1,0,0]=3 5151 B12R1.1631 COCOc1c(cccc1C)C 9bab687482fb28ca28f33fae22a064a9 [0,2,0,0,0,0|1,0,0]=3 5152 B12R1.1631 COCOc1c(cccc1Cl)C 9c975bee6684ed90d54141a40dbf9f91 [0,2,0,0,0,0|1,0,0]=3 5153 B12R1.1631 COCOc1c(cccc1Cl)Cl 051a27b339969d354b08e9e2960daec4 [0,2,0,0,0,0|1,0,0]=3 5154 B12R1.1631 COCOc1c(cccc1Cl)F 27c82cdce775a47a872c38788e33191c [0,2,0,0,0,0|1,0,0]=3 5155 B12R1.1631 COCOc1c(cccc1F)C 3f1ced0bb9104b0854c6b985e4784c4d [0,2,0,0,0,0|1,0,0]=3 5156 B12R1.1631 COCOc1c(cccc1F)F 57b6ba67ad727a2bcffd68f9926613d5 [0,2,0,0,0,0|1,0,0]=3 5157 B12R1.1631 COCOc1c(cccc1I)C c7558fdffe83a19db3355a38c8e92853 [0,2,0,0,0,0|1,0,0]=3 5158 B12R1.1631 COCOc1c(ccnc1Br)Br f39c20e9ef3fd48bdf4ae6505c7d6bd4 [0,2,0,0,0,0|2,0,0]=4 5159 B12R1.1631 COCOc1c(ccnc1Br)C 86a89ddfd820f1082f116b2b1469d14a [0,2,0,0,0,0|2,0,0]=4 5160 B12R1.1631 COCOc1c(ccnc1Br)Cl a39777ed2ea744929788249a7d8892ca [0,2,0,0,0,0|2,0,0]=4 5161 B12R1.1631 COCOc1c(ccnc1Br)F 49afe963484298737b2900b72ba12aff [0,2,0,0,0,0|2,0,0]=4 5162 B12R1.1631 COCOc1c(ccnc1C)C 89700674b3a74c5f341078e5ff47d591 [0,2,0,0,0,0|2,0,0]=4 5163 B12R1.1631 COCOc1c(ccnc1Cl)Br f287fb0dd832f42a684b7eec892e363d [0,2,0,0,0,0|2,0,0]=4 5164 B12R1.1631 COCOc1c(ccnc1Cl)C 9400fe61703c186515d6df745ab1bea4 [0,2,0,0,0,0|2,0,0]=4 5165 B12R1.1631 COCOc1c(ccnc1Cl)Cl d24b54f770679f1643f7907756884546 [0,2,0,0,0,0|2,0,0]=4 5166 B12R1.1631 COCOc1c(ccnc1Cl)F 022cec4756322fb64ea41ca9734242fb [0,2,0,0,0,0|2,0,0]=4 5167 B12R1.1631 COCOc1c(ccnc1Cl)I 5b7d08dcfef0b27cfb7a0b7c6f42de45 [0,2,0,0,0,0|2,0,0]=4 5168 B12R1.1631 COCOc1c(ccnc1F)Br 510b2e23e7d9bb213953488fcc7716a0 [0,2,0,0,0,0|2,0,0]=4 5169 B12R1.1631 COCOc1c(ccnc1F)C b8e867f5d5fc05d0807833b128478105 [0,2,0,0,0,0|2,0,0]=4 5170 B12R1.1631 COCOc1c(ccnc1F)F b29db471e945189f1ba77273484ce0cb [0,2,0,0,0,0|2,0,0]=4 5171 B12R1.1631 COCOc1c(ccnc1F)I 262af3005ce957dc7529802d2f56fcef [0,2,0,0,0,0|2,0,0]=4 5172 B12R1.1631 COCOc1c(ccnc1I)Cl 18ea77c56a174519dee7115ba045d6e5 [0,2,0,0,0,0|2,0,0]=4 5173 B12R1.1631 COCOc1c(ccnc1I)I cfdfea127448e4cb7b2e3b330f21c5d2 [0,2,0,0,0,0|2,0,0]=4 5174 B12R1.1631 COCOc1c(cncc1Br)C 608d3f4e1ee37cf7957fb15c6e0cc252 [0,2,0,0,0,0|2,0,0]=4 5175 B12R1.1631 COCOc1c(cncc1Br)Cl ca57a79c32872168bda578a0942d24b5 [0,2,0,0,0,0|2,0,0]=4 5176 B12R1.1631 COCOc1c(cncc1Br)F 3d9c5232261b11bbe694e958c75ce5e5 [0,2,0,0,0,0|2,0,0]=4 5177 B12R1.1631 COCOc1c(cncc1I)Br 20ec93da48ad9c13f70257fcab9a420d [0,2,0,0,0,0|2,0,0]=4 5178 B12R1.1631 COCOc1c(occc1=O)C cd260e0afa366618ce65ce342270121e [0,2,0,0,0,0|2,0,0]=4 5179 B12R1.1631 COCOc1c(occc1=S)C 3c6f1d04edbac5c6b3f051c525724431 [0,2,0,0,0,0|2,0,0]=4 5180 B12R1.1631 CSCNc1c(cccc1Br)F c15900e60633ed455ad667170ddd304d [0,2,0,0,0,0|1,1,0]=4 5181 B12R1.1631 CSCNc1c(cccc1C)C ed6534585af1d9888ba4323011845be6 [0,2,0,0,0,0|1,1,0]=4 5182 B12R1.1631 CSCNc1c(cccc1Cl)C 91ee6fce27c12f504b98a3b75d8f5190 [0,2,0,0,0,0|1,1,0]=4 5183 B12R1.1631 CSCNc1c(cccc1Cl)Cl 3d1bd59a46807a151446ad18bcf508ae [0,2,0,0,0,0|1,1,0]=4 5184 B12R1.1631 CSCNc1c(cccc1Cl)F dee75291aee1f8510bee8fb08411f8ad [0,2,0,0,0,0|1,1,0]=4 5185 B12R1.1631 CSCNc1c(cccc1F)C cbf069b1454676610e267007130eebfd [0,2,0,0,0,0|1,1,0]=4 5186 B12R1.1631 CSCNc1c(cccc1F)F 300649bcf706111927261fc7847a97b2 [0,2,0,0,0,0|1,1,0]=4 5187 B12R1.1631 CSCNc1c(cccc1I)C 1acd9ad1798379ea15e842e39577173a [0,2,0,0,0,0|1,1,0]=4 5188 B12R1.1631 CSCNc1c(cccc1I)Cl c2d9935936dde5401c09ef336891fa83 [0,2,0,0,0,0|1,1,0]=4 5189 B12R1.1631 CSCNc1c(cccc1I)F ae27f30c3283061cde52520ad0d86d45 [0,2,0,0,0,0|1,1,0]=4 5190 B12R1.1631 CSCNc1c(cccc1S)F 005ed319ac870d3868144fa2f7d66c60 [0,2,0,0,0,0|1,1,0]=4 5191 B12R1.1631 CSCOc1c(cccc1Br)C 138627c3b0b38f278c90297fc083114d [0,2,0,0,0,0|1,1,0]=4 5192 B12R1.1631 CSCOc1c(cccc1Br)F d6c533f2d798d36a8fba4f5b7d2b1092 [0,2,0,0,0,0|1,1,0]=4 5193 B12R1.1631 CSCOc1c(cccc1C)C 960baf72ff4e8d6a8b629930f6a079da [0,2,0,0,0,0|1,1,0]=4 5194 B12R1.1631 CSCOc1c(cccc1Cl)C 3c9114658146bcd2c9add2866ed8ab0e [0,2,0,0,0,0|1,1,0]=4 5195 B12R1.1631 CSCOc1c(cccc1Cl)Cl 7f08f45e756032989bab351e7e6f6b5e [0,2,0,0,0,0|1,1,0]=4 5196 B12R1.1631 CSCOc1c(cccc1Cl)F b6f861b03000a02f592c75911ac1b7c1 [0,2,0,0,0,0|1,1,0]=4 5197 B12R1.1631 CSCOc1c(cccc1F)C cf6d57db31b8ea2aec50d04de2b9d7fa [0,2,0,0,0,0|1,1,0]=4 5198 B12R1.1631 CSCOc1c(cccc1F)F e45dc2c33f762265799326704935624e [0,2,0,0,0,0|1,1,0]=4 5199 B12R1.1631 CSCOc1c(cccc1I)C db48c8915595416c734ddbd6111edfa3 [0,2,0,0,0,0|1,1,0]=4 5200 B12R1.1631 CSCOc1c(cccc1I)Cl 19771317301c9288238133e9620936e0 [0,2,0,0,0,0|1,1,0]=4 5201 B12R1.1631 CSCOc1c(cccc1I)F e60421a9ffef55dfd086f4523032269c [0,2,0,0,0,0|1,1,0]=4 5202 B12R1.1631 CSCOc1c(cccc1I)I 4f9e9122688e90b6fa9d7cf7cf30b12a [0,2,0,0,0,0|1,1,0]=4 5203 B12R1.28 BrCCNCc1cccc(c1)Br effb840743a36d5ca1212ae572e23e89 [0,2,0,0,0,0|2,0,0]=4 5204 B12R1.28 BrCCNCc1cccc(c1)I 705e584509c8e70c3e5306c34cf9d9dc [0,2,0,0,0,0|2,0,0]=4 5205 B12R1.28 Brc1cccc(c1)CNCCI a24c38b5ffa11e307c2e1a19f30a87d3 [0,2,0,0,0,0|2,0,0]=4 5206 B12R1.28 C#CCCNc1cccc(c1)Br 9a789c86a2cb6f6d9b3d1caf2d383f0c [0,2,0,0,0,0|1,0,1]=4 5207 B12R1.28 C#CCCNc1cccc(c1)C 19358508c1bbebd980867915586e7a0a [0,2,0,0,0,0|1,0,1]=4 5208 B12R1.28 C#CCCNc1cccc(c1)Cl 36c233d7a207a03116e70d3cd23df5e1 [0,2,0,0,0,0|1,0,1]=4 5209 B12R1.28 C#CCCNc1cccc(c1)F 36eef0dcfe007e0b963c57632c53b3c4 [0,2,0,0,0,0|1,0,1]=4 5210 B12R1.28 C#CCCNc1cccc(c1)I 8112f92384a73dcbd7578ed047f14240 [0,2,0,0,0,0|1,0,1]=4 5211 B12R1.28 C#CCCNc1cccc(c1)S e026ee9ed3d15f88f0ba971adbd88d19 [0,2,0,0,0,0|1,0,1]=4 5212 B12R1.28 C#CCCOc1cccc(c1)Br c2d141cdc218d1d9b64a8eefb9382001 [0,2,0,0,0,0|1,0,1]=4 5213 B12R1.28 C#CCCOc1cccc(c1)C 18ae8309037ff9651a14fc9738c6a7d6 [0,2,0,0,0,0|1,0,1]=4 5214 B12R1.28 C#CCCOc1cccc(c1)Cl 4944a2ae7c53ce04dbef55f6df0145e9 [0,2,0,0,0,0|1,0,1]=4 5215 B12R1.28 C#CCCOc1cccc(c1)F 6a1fcf0c2c4def3d6766bfc7dd2af1b4 [0,2,0,0,0,0|1,0,1]=4 5216 B12R1.28 C#CCCOc1cccc(c1)I 350811b9532c204b9fd9cf4f3736c4b8 [0,2,0,0,0,0|1,0,1]=4 5217 B12R1.28 C#CCCOc1cccc(c1)S 259268913978a21237405d4e003f7abe [0,2,0,0,0,0|1,0,1]=4 5218 B12R1.28 C#CCNCc1cccc(c1)Br 471eb6b5483fba7246ae7477dc9674e4 [0,2,0,0,0,0|1,0,1]=4 5219 B12R1.28 C#CCNCc1cccc(c1)C 8db36a4f97c5d0f0f17ade20487f71d0 [0,2,0,0,0,0|1,0,1]=4 5220 B12R1.28 C#CCNCc1cccc(c1)Cl 64840a79052dacc496b02f3f8655a7be [0,2,0,0,0,0|1,0,1]=4 5221 B12R1.28 C#CCNCc1cccc(c1)F 92f907ab228196e83f868d49332e2148 [0,2,0,0,0,0|1,0,1]=4 5222 B12R1.28 C#CCNCc1cccc(c1)I 4da7a645a734dbb8860582e88e01d776 [0,2,0,0,0,0|1,0,1]=4 5223 B12R1.28 C#CCOCc1cccc(c1)Br b6018afed24b02de605e58d0c12cf7cd [0,2,0,0,0,0|1,0,1]=4 5224 B12R1.28 C#CCOCc1cccc(c1)C 2431a51d96ac730b834f70f120288c64 [0,2,0,0,0,0|1,0,1]=4 5225 B12R1.28 C#CCOCc1cccc(c1)Cl 9ce81957dba54ed717fff03e4c30ae4f [0,2,0,0,0,0|1,0,1]=4 5226 B12R1.28 C#CCOCc1cccc(c1)F 3ea25c8088593d2602f82441bbe767a0 [0,2,0,0,0,0|1,0,1]=4 5227 B12R1.28 C#CCOCc1cccc(c1)I ee71218be94987887dccdd83ee6c896a [0,2,0,0,0,0|1,0,1]=4 5228 B12R1.28 C/C=C/CNc1cccc(c1)Br a2a4ffb13df66bc6f5fd65745354daf3 [0,2,0,0,0,0|1,0,1]=4 5229 B12R1.28 C/C=C/CNc1cccc(c1)C 8da617065114d03b678a93cf249b27f7 [0,2,0,0,0,0|1,0,1]=4 5230 B12R1.28 C/C=C/CNc1cccc(c1)Cl a321a64687bc7e589120f424933cd2d2 [0,2,0,0,0,0|1,0,1]=4 5231 B12R1.28 C/C=C/CNc1cccc(c1)F 71cafafb1f1e8b6121b9b13096f0fc70 [0,2,0,0,0,0|1,0,1]=4 5232 B12R1.28 C/C=C/CNc1cccc(c1)I d2f964ed520df8f3aeecd7f050c1985b [0,2,0,0,0,0|1,0,1]=4 5233 B12R1.28 C/C=C/CNc1cccc(c1)S ec49e90993d9a78711d475148cac4c72 [0,2,0,0,0,0|1,0,1]=4 5234 B12R1.28 C/C=C/COc1cccc(c1)Br 72e4bc852d44ba31a847e204d2da404e [0,2,0,0,0,0|1,0,1]=4 5235 B12R1.28 C/C=C/COc1cccc(c1)C 3ba4d822cba50bbc6be0b4bb2f2ebb3d [0,2,0,0,0,0|1,0,1]=4 5236 B12R1.28 C/C=C/COc1cccc(c1)Cl 8ca2bf180186d4e7bfe19d428dfe7811 [0,2,0,0,0,0|1,0,1]=4 5237 B12R1.28 C/C=C/COc1cccc(c1)F 5074841a69b3ba42e5246b5f75cb4bda [0,2,0,0,0,0|1,0,1]=4 5238 B12R1.28 C/C=C/COc1cccc(c1)I 7abbdb89bd64553f484003423d90fe9f [0,2,0,0,0,0|1,0,1]=4 5239 B12R1.28 C/C=C/COc1cccc(c1)S 7080dba1b36872549a84c0750f8cb3ff [0,2,0,0,0,0|1,0,1]=4 5240 B12R1.28 C/C=C\CNc1cccc(c1)Br 7070d8ae71f4af92f8b602236c10e93a [0,2,0,0,0,0|1,0,1]=4 5241 B12R1.28 C/C=C\CNc1cccc(c1)C d9d5a3b664a5f0201836bd778c9a0849 [0,2,0,0,0,0|1,0,1]=4 5242 B12R1.28 C/C=C\CNc1cccc(c1)Cl 04625aaaf5accf11670fca06cbf179cd [0,2,0,0,0,0|1,0,1]=4 5243 B12R1.28 C/C=C\CNc1cccc(c1)F 0907f1c38a6392cdde953637934da498 [0,2,0,0,0,0|1,0,1]=4 5244 B12R1.28 C/C=C\CNc1cccc(c1)I 3a9b75e66c5c614dcbb90951ba554cc0 [0,2,0,0,0,0|1,0,1]=4 5245 B12R1.28 C/C=C\CNc1cccc(c1)S a0e54ccff2742c467e8fbea49b77ae88 [0,2,0,0,0,0|1,0,1]=4 5246 B12R1.28 C/C=C\COc1cccc(c1)Br 15b9554195d237378876ca7d504f98c8 [0,2,0,0,0,0|1,0,1]=4 5247 B12R1.28 C/C=C\COc1cccc(c1)C 8f36ad1133ab371e69bffa981477ceda [0,2,0,0,0,0|1,0,1]=4 5248 B12R1.28 C/C=C\COc1cccc(c1)Cl d19230bedb310950f229d85746a83423 [0,2,0,0,0,0|1,0,1]=4 5249 B12R1.28 C/C=C\COc1cccc(c1)F 2e8bc4bcc243d49ae976ed443382fb18 [0,2,0,0,0,0|1,0,1]=4 5250 B12R1.28 C/C=C\COc1cccc(c1)I c8a336888e595e1b5ed81353e45b7a26 [0,2,0,0,0,0|1,0,1]=4 5251 B12R1.28 C/C=C\COc1cccc(c1)S b203829723f78fca904ac9665341c217 [0,2,0,0,0,0|1,0,1]=4 5252 B12R1.28 C=CCCNc1cccc(c1)Br a4591bb4416f805149b0909810ab29d6 [0,2,0,0,0,0|1,0,1]=4 5253 B12R1.28 C=CCCNc1cccc(c1)C 70e9ee7f1373cdce657590dcaaee2c38 [0,2,0,0,0,0|1,0,1]=4 5254 B12R1.28 C=CCCNc1cccc(c1)Cl 19162552426aeacd3712850fde3210a7 [0,2,0,0,0,0|1,0,1]=4 5255 B12R1.28 C=CCCNc1cccc(c1)F 81c75f294981eb08b0645aa6963892cb [0,2,0,0,0,0|1,0,1]=4 5256 B12R1.28 C=CCCNc1cccc(c1)I 30686e36ca4ea9e4b1c8c068bcd02635 [0,2,0,0,0,0|1,0,1]=4 5257 B12R1.28 C=CCCNc1cccc(c1)O 4b0fc2f89835c748a984f50980e6f661 [0,2,0,0,0,0|1,0,1]=4 5258 B12R1.28 C=CCCNc1cccc(c1)S 0e5e47057816232f21824c3c1be4f0e4 [0,2,0,0,0,0|1,0,1]=4 5259 B12R1.28 C=CCCOc1cccc(c1)Br bba605c77db17708fe312f894767d698 [0,2,0,0,0,0|1,0,1]=4 5260 B12R1.28 C=CCCOc1cccc(c1)C 149a4772d857d0958ea6f806e16636d0 [0,2,0,0,0,0|1,0,1]=4 5261 B12R1.28 C=CCCOc1cccc(c1)Cl 67bc79f975b7bd708c6d3bfc735cfdf1 [0,2,0,0,0,0|1,0,1]=4 5262 B12R1.28 C=CCCOc1cccc(c1)F 7694510654f456e3e402094dd0cffe6f [0,2,0,0,0,0|1,0,1]=4 5263 B12R1.28 C=CCCOc1cccc(c1)I c6e9b0baa68bda97c89fcbde2e05974c [0,2,0,0,0,0|1,0,1]=4 5264 B12R1.28 C=CCCOc1cccc(c1)S a2d0654b16a9cf122115a53cdac92996 [0,2,0,0,0,0|1,0,1]=4 5265 B12R1.28 C=CCNCc1cccc(c1)Br b63e5813142181fe4d2ae87165600d16 [0,2,0,0,0,0|1,0,1]=4 5266 B12R1.28 C=CCNCc1cccc(c1)C 14043a5011f1ee2ad6a15cfb5e6699a2 [0,2,0,0,0,0|1,0,1]=4 5267 B12R1.28 C=CCNCc1cccc(c1)Cl 66e118b9471edb950a57f6cd5a000bd7 [0,2,0,0,0,0|1,0,1]=4 5268 B12R1.28 C=CCNCc1cccc(c1)F 96d06b72e578205c238d4d384474e486 [0,2,0,0,0,0|1,0,1]=4 5269 B12R1.28 C=CCNCc1cccc(c1)I 7953a0dde57a1150b48c08f3ddd78878 [0,2,0,0,0,0|1,0,1]=4 5270 B12R1.28 C=CCOCc1cccc(c1)Br 329f270b357b9fc1c2b0cb0c841f8d1a [0,2,0,0,0,0|1,0,1]=4 5271 B12R1.28 C=CCOCc1cccc(c1)C 3b39b8f97a073e3df1b46f24d8839125 [0,2,0,0,0,0|1,0,1]=4 5272 B12R1.28 C=CCOCc1cccc(c1)Cl e3356a865a02f4ad71510b0a6bbaaeaf [0,2,0,0,0,0|1,0,1]=4 5273 B12R1.28 C=CCOCc1cccc(c1)F c64f528910fdec6ae318a6a295a1b20c [0,2,0,0,0,0|1,0,1]=4 5274 B12R1.28 C=CCOCc1cccc(c1)I 5b3be50e4d4f00ffdb7092a775a6ad5c [0,2,0,0,0,0|1,0,1]=4 5275 B12R1.28 CC=CCNc1cccc(c1)C 30ec1285d9bc656faa9242a94847159d [0,2,0,0,0,0|1,0,1]=4 5276 B12R1.28 CC=CCNc1cccc(c1)F 4305289cfcb4f5f2c78858c21518b03a [0,2,0,0,0,0|1,0,1]=4 5277 B12R1.28 CC=CCNc1cccc(c1)O 0ec4450758cda2ae602b2e783d8c49bd [0,2,0,0,0,0|1,0,1]=4 5278 B12R1.28 CC=CCNc1cccc(c1)S 8e7bc312fb945df2c9ee408d70f309a5 [0,2,0,0,0,0|1,0,1]=4 5279 B12R1.28 CCCCNc1cc(ccn1)Br 3ce8e9f067c3a96b8cf9dbb1309fc04e [0,2,0,0,0,0|2,0,0]=4 5280 B12R1.28 CCCCNc1cc(ccn1)C df22b9236c0d0914a12a55dc7c64c005 [0,2,0,0,0,0|2,0,0]=4 5281 B12R1.28 CCCCNc1cc(ccn1)Cl cffab7d82e3b95857c958e6281b555d3 [0,2,0,0,0,0|2,0,0]=4 5282 B12R1.28 CCCCNc1cc(ccn1)F 76d962442661bbd03d8a1a7a4e1b4df8 [0,2,0,0,0,0|2,0,0]=4 5283 B12R1.28 CCCCNc1cc(ccn1)I 59ce12897e7090fd85fc4dfb96fddf31 [0,2,0,0,0,0|2,0,0]=4 5284 B12R1.28 CCCCNc1cc[nH]c(=O)c1 3680c4d5311ae40abd6ce4902a0424b0 [0,2,0,0,0,0|2,0,0]=4 5285 B12R1.28 CCCCNc1cc[nH]c(=S)c1 ea9cb42b74e9dcca19e8748ca3c5dc34 [0,2,0,0,0,0|2,0,0]=4 5286 B12R1.28 CCCCNc1ccc[n+](c1)[O-] 679e1535df40d2e493121e03e1801eb4 [0,2,0,0,0,0|2,0,0]=4 5287 B12R1.28 CCCCNc1cccc(=O)[nH]1 3692f6133be3cd54daa34043dfb91b4f [0,2,0,0,0,0|2,0,0]=4 5288 B12R1.28 CCCCNc1cccc(c1)Br 3ba87045eb71cb9daeb0c6df049ffff7 [0,2,0,0,0,0|1,0,0]=3 5289 B12R1.28 CCCCNc1cccc(c1)C f36b39ad3ead5e197d911ea9d057dd4e [0,2,0,0,0,0|1,0,0]=3 5290 B12R1.28 CCCCNc1cccc(c1)Cl a6dae9e8390011a3064dddc965e1d2b9 [0,2,0,0,0,0|1,0,0]=3 5291 B12R1.28 CCCCNc1cccc(c1)F 0ad37da684945b6ecbc5a392ea5af5e5 [0,2,0,0,0,0|1,0,0]=3 5292 B12R1.28 CCCCNc1cccc(c1)I dc76b7022ba07d453e5841475326c95d [0,2,0,0,0,0|1,0,0]=3 5293 B12R1.28 CCCCNc1cccc(c1)S 43cd57044d5c62dbdc445cebf65eff9d [0,2,0,0,0,0|1,0,0]=3 5294 B12R1.28 CCCCNc1cccc(n1)Br fac5b1f9c484cf59cb6a4b3669a341c0 [0,2,0,0,0,0|2,0,0]=4 5295 B12R1.28 CCCCNc1cccc(n1)C b50c160478b645e8709ed00a31cf2df2 [0,2,0,0,0,0|2,0,0]=4 5296 B12R1.28 CCCCNc1cccc(n1)Cl ed33204606245079fd78621e5440d037 [0,2,0,0,0,0|2,0,0]=4 5297 B12R1.28 CCCCNc1cccc(n1)F a31fed733d277471f4055bcc2e8b1eab [0,2,0,0,0,0|2,0,0]=4 5298 B12R1.28 CCCCNc1cccc(n1)I 0b65a525126639de52d69849ecc93a45 [0,2,0,0,0,0|2,0,0]=4 5299 B12R1.28 CCCCNc1ccnc(c1)Br ecb5342ab7f6e01e3e3b964c4843f8aa [0,2,0,0,0,0|2,0,0]=4 5300 B12R1.28 CCCCNc1ccnc(c1)C e6b03d134a6089ca15a5b9a55503d762 [0,2,0,0,0,0|2,0,0]=4 5301 B12R1.28 CCCCNc1ccnc(c1)Cl 1749b707475bfdeb026197262d22361b [0,2,0,0,0,0|2,0,0]=4 5302 B12R1.28 CCCCNc1ccnc(c1)F 87d73fa5d39fd30e54e9de6d0cafb0f4 [0,2,0,0,0,0|2,0,0]=4 5303 B12R1.28 CCCCNc1ccnc(c1)I 202ff841ad6a80e2f7d252fb9a46ab0d [0,2,0,0,0,0|2,0,0]=4 5304 B12R1.28 CCCCNc1cncc(c1)Br b2fa56f79c380776fe44ba4523a4021f [0,2,0,0,0,0|2,0,0]=4 5305 B12R1.28 CCCCNc1cncc(c1)C 5129cdde89e6a0cff0e8b3d16e5355bb [0,2,0,0,0,0|2,0,0]=4 5306 B12R1.28 CCCCNc1cncc(c1)Cl 48ec9e7a10b4511c58afedd0548e3091 [0,2,0,0,0,0|2,0,0]=4 5307 B12R1.28 CCCCNc1cncc(c1)F 15ad4e01c89a4cfa3dd1c42baf244de2 [0,2,0,0,0,0|2,0,0]=4 5308 B12R1.28 CCCCNc1cncc(c1)I ce2eb3e0439ff3de201262b9bef469f8 [0,2,0,0,0,0|2,0,0]=4 5309 B12R1.28 CCCCOc1cc(ccn1)Br 127a4e24d70a2e56fe8dba38ab0d7418 [0,2,0,0,0,0|2,0,0]=4 5310 B12R1.28 CCCCOc1cc(ccn1)C a277689bb0c81dba2c426460cd5c464b [0,2,0,0,0,0|2,0,0]=4 5311 B12R1.28 CCCCOc1cc(ccn1)Cl 56a40f70abea0a64471fae4dba24fb5e [0,2,0,0,0,0|2,0,0]=4 5312 B12R1.28 CCCCOc1cc(ccn1)F 7b3ecf9ab860ac39a00f40bc9043bf42 [0,2,0,0,0,0|2,0,0]=4 5313 B12R1.28 CCCCOc1ccc[n+](c1)[O-] df749312c20bba98ad1c8de7c9bf010c [0,2,0,0,0,0|2,0,0]=4 5314 B12R1.28 CCCCOc1cccc(=O)[nH]1 1f22aa2f2c8c4d772359ded89a265096 [0,2,0,0,0,0|2,0,0]=4 5315 B12R1.28 CCCCOc1cccc(c1)Br b144f667443368aab820c1f558ee7729 [0,2,0,0,0,0|1,0,0]=3 5316 B12R1.28 CCCCOc1cccc(c1)C de4e90dba26d310b97e7df87ced1e000 [0,2,0,0,0,0|1,0,0]=3 5317 B12R1.28 CCCCOc1cccc(c1)Cl 6912ea50178fc697373b3eb109be83be [0,2,0,0,0,0|1,0,0]=3 5318 B12R1.28 CCCCOc1cccc(c1)F 9bbd58eababd7836ec763165664cc247 [0,2,0,0,0,0|1,0,0]=3 5319 B12R1.28 CCCCOc1cccc(c1)I 02e05e5116a879aa64014a15641eb41a [0,2,0,0,0,0|1,0,0]=3 5320 B12R1.28 CCCCOc1cccc(c1)S 092550c23bce2a6555f79ad42c314952 [0,2,0,0,0,0|1,0,0]=3 5321 B12R1.28 CCCCOc1cccc(n1)Br 1a9bd0f42ab10adce3654ad95086796d [0,2,0,0,0,0|2,0,0]=4 5322 B12R1.28 CCCCOc1cccc(n1)C d9b6d18f8cc402e5aad7db256f0801f6 [0,2,0,0,0,0|2,0,0]=4 5323 B12R1.28 CCCCOc1cccc(n1)F 795e9d086b4da4df60943f877937c501 [0,2,0,0,0,0|2,0,0]=4 5324 B12R1.28 CCCCOc1ccnc(c1)Br a75bf8d3945a7df05c18cef85d06ff19 [0,2,0,0,0,0|2,0,0]=4 5325 B12R1.28 CCCCOc1ccnc(c1)C 958584adfae3a5ad9d3921f49695ad0e [0,2,0,0,0,0|2,0,0]=4 5326 B12R1.28 CCCCOc1ccnc(c1)Cl 8ed91e6bca5cac7a57b73dca14f3ec8b [0,2,0,0,0,0|2,0,0]=4 5327 B12R1.28 CCCCOc1ccnc(c1)F 3873283cc21b8a16e46b3da5fa810d2c [0,2,0,0,0,0|2,0,0]=4 5328 B12R1.28 CCCCOc1cncc(c1)Br a7527beb0dfc7f59c17ee94303ef08de [0,2,0,0,0,0|2,0,0]=4 5329 B12R1.28 CCCCOc1cncc(c1)C 0007ff0e63944aa372234adb125a872c [0,2,0,0,0,0|2,0,0]=4 5330 B12R1.28 CCCCOc1cncc(c1)Cl 43cf7404510a84ae2ffcd7f30b3b3691 [0,2,0,0,0,0|2,0,0]=4 5331 B12R1.28 CCCCOc1cncc(c1)F 01b81a592c8dbfe673a2ba66b9183d00 [0,2,0,0,0,0|2,0,0]=4 5332 B12R1.28 CCCCOc1cncc(c1)I 6a71a3ae9a8b6a209904e90b5446a08d [0,2,0,0,0,0|2,0,0]=4 5333 B12R1.28 CCCNCc1cc(ccn1)Br 62b70cd570592b04505bcfacfa76c0a8 [0,2,0,0,0,0|2,0,0]=4 5334 B12R1.28 CCCNCc1cc(ccn1)C 8f64567856c5a6b9541eee6863b3acf3 [0,2,0,0,0,0|2,0,0]=4 5335 B12R1.28 CCCNCc1cc(ccn1)Cl 33d38006b2776043cf75acff3a96c3bc [0,2,0,0,0,0|2,0,0]=4 5336 B12R1.28 CCCNCc1cc[nH]c(=O)c1 4d3551ff6d97808fad95dbe208e6e6f7 [0,2,0,0,0,0|2,0,0]=4 5337 B12R1.28 CCCNCc1ccc[n+](c1)[O-] 9030f4a8f20f481b4d929fabb8e9f8c4 [0,2,0,0,0,0|2,0,0]=4 5338 B12R1.28 CCCNCc1cccc(c1)Br ab115619eaf5d28cfa37403b6fa7ac8f [0,2,0,0,0,0|1,0,0]=3 5339 B12R1.28 CCCNCc1cccc(c1)C 0ea9b946138db81b53023dbdaca16203 [0,2,0,0,0,0|1,0,0]=3 5340 B12R1.28 CCCNCc1cccc(c1)Cl d46956d798c81ca7a12e7d74076d63f3 [0,2,0,0,0,0|1,0,0]=3 5341 B12R1.28 CCCNCc1cccc(c1)F fec44b74b110238869e7726b42829c72 [0,2,0,0,0,0|1,0,0]=3 5342 B12R1.28 CCCNCc1cccc(c1)I ec50005f001189b77183e63c9ca35e03 [0,2,0,0,0,0|1,0,0]=3 5343 B12R1.28 CCCNCc1cccc(n1)Br bc593c6f51687abad18885bc99f5c95a [0,2,0,0,0,0|2,0,0]=4 5344 B12R1.28 CCCNCc1cccc(n1)C eb159799c3e39812c6e0f5ecfc00929c [0,2,0,0,0,0|2,0,0]=4 5345 B12R1.28 CCCNCc1cccc(n1)Cl 94687edaf9eb76abc359c0ee14de5cdb [0,2,0,0,0,0|2,0,0]=4 5346 B12R1.28 CCCNCc1cccc(n1)F d2389ac79e260eebbc9be9dd76bffa68 [0,2,0,0,0,0|2,0,0]=4 5347 B12R1.28 CCCNCc1ccnc(c1)Br cd93074a785b440f75a051f29d102f74 [0,2,0,0,0,0|2,0,0]=4 5348 B12R1.28 CCCNCc1ccnc(c1)C 44e3f8e97f0195b1553b942808256e2f [0,2,0,0,0,0|2,0,0]=4 5349 B12R1.28 CCCNCc1ccnc(c1)Cl 8d578c7e3bd687164cedc285e7a85839 [0,2,0,0,0,0|2,0,0]=4 5350 B12R1.28 CCCNCc1ccnc(c1)F 0764251a219853f8ad12c7dad0b77be7 [0,2,0,0,0,0|2,0,0]=4 5351 B12R1.28 CCCNCc1cncc(c1)Br dd5395a070fe2a754d4e2e6686157366 [0,2,0,0,0,0|2,0,0]=4 5352 B12R1.28 CCCNCc1cncc(c1)C 93f050af005663718449bbd3ede95b01 [0,2,0,0,0,0|2,0,0]=4 5353 B12R1.28 CCCNCc1cncc(c1)Cl a9f078773a7c257d3b42b4fe2c63dd8d [0,2,0,0,0,0|2,0,0]=4 5354 B12R1.28 CCCNCc1cncc(c1)F a41a901c88e12e1540206257502347f5 [0,2,0,0,0,0|2,0,0]=4 5355 B12R1.28 CCCOCc1cc(ccn1)Br 55b245978a87266e978cf80fd37b8760 [0,2,0,0,0,0|2,0,0]=4 5356 B12R1.28 CCCOCc1cc(ccn1)C 437e02001d74ccffa20b468cf3b27583 [0,2,0,0,0,0|2,0,0]=4 5357 B12R1.28 CCCOCc1cc(ccn1)Cl 57147ac72f315e193a33357e27e37a83 [0,2,0,0,0,0|2,0,0]=4 5358 B12R1.28 CCCOCc1cc(ccn1)F 8858345998cbadf17293c5f4134b7123 [0,2,0,0,0,0|2,0,0]=4 5359 B12R1.28 CCCOCc1cc(ccn1)I 52a63e2452a5d464627ee845ec55bee8 [0,2,0,0,0,0|2,0,0]=4 5360 B12R1.28 CCCOCc1cc[nH]c(=O)c1 82206fb059c9c4c36c258eb5d9cc90c9 [0,2,0,0,0,0|2,0,0]=4 5361 B12R1.28 CCCOCc1ccc[n+](c1)[O-] a5e525d8838aa27d20098eb15f253021 [0,2,0,0,0,0|2,0,0]=4 5362 B12R1.28 CCCOCc1cccc(c1)Br 51b265396dee1ad4a9bb63037e020576 [0,2,0,0,0,0|1,0,0]=3 5363 B12R1.28 CCCOCc1cccc(c1)C d8eb8d05914bbe210bfe6d56aae3fe46 [0,2,0,0,0,0|1,0,0]=3 5364 B12R1.28 CCCOCc1cccc(c1)Cl 04967c4422580f79cdb296f010807ced [0,2,0,0,0,0|1,0,0]=3 5365 B12R1.28 CCCOCc1cccc(c1)F 0d807124e5077ad8540130b67a71280a [0,2,0,0,0,0|1,0,0]=3 5366 B12R1.28 CCCOCc1cccc(c1)I 8a2a3d6ad20e441201e59e161816ef78 [0,2,0,0,0,0|1,0,0]=3 5367 B12R1.28 CCCOCc1cccc(n1)Br 5a5029b9d6268213b7c79e92879e6576 [0,2,0,0,0,0|2,0,0]=4 5368 B12R1.28 CCCOCc1cccc(n1)C 108e42919326b113159263e17f8ec3cb [0,2,0,0,0,0|2,0,0]=4 5369 B12R1.28 CCCOCc1cccc(n1)Cl 3837a6848aec96edc567f764a90da8b2 [0,2,0,0,0,0|2,0,0]=4 5370 B12R1.28 CCCOCc1cccc(n1)F c1faf6b0f233e7e9b5654b5be2923e16 [0,2,0,0,0,0|2,0,0]=4 5371 B12R1.28 CCCOCc1cccc(n1)I c8ff9890bec20a11d495514a971eb19a [0,2,0,0,0,0|2,0,0]=4 5372 B12R1.28 CCCOCc1ccnc(c1)Br c7f7b5da6349bbcc876b2af23d30f842 [0,2,0,0,0,0|2,0,0]=4 5373 B12R1.28 CCCOCc1ccnc(c1)C 03df2ec691f193e1ca6cefb2cc28aec4 [0,2,0,0,0,0|2,0,0]=4 5374 B12R1.28 CCCOCc1ccnc(c1)Cl 8dc40d011cb457572b43eb05750f990a [0,2,0,0,0,0|2,0,0]=4 5375 B12R1.28 CCCOCc1ccnc(c1)F 180548efa17c7463918b6585dde9fd6a [0,2,0,0,0,0|2,0,0]=4 5376 B12R1.28 CCCOCc1cncc(c1)Br edd1bdceb7f06ff4f246dd95ac80987c [0,2,0,0,0,0|2,0,0]=4 5377 B12R1.28 CCCOCc1cncc(c1)C bb3d63bafa19bc290e3048469cddbe1d [0,2,0,0,0,0|2,0,0]=4 5378 B12R1.28 CCCOCc1cncc(c1)Cl f70d4a97328b3231fc0b7408c19e7a61 [0,2,0,0,0,0|2,0,0]=4 5379 B12R1.28 CCCOCc1cncc(c1)F 8bc920bf2f1a3562c1cb9628fd8a9828 [0,2,0,0,0,0|2,0,0]=4 5380 B12R1.28 CCCOCc1cncc(c1)I 50ec080ea05aa8d0062dba9e76d8769a [0,2,0,0,0,0|2,0,0]=4 5381 B12R1.28 CCNCCc1cccc(c1)Br 7407aa9054e4fecb39bb7bc51e44c0d3 [0,2,0,0,0,0|1,0,0]=3 5382 B12R1.28 CCNCCc1cccc(c1)C 0b37f05c941770177fcf98d56962ff79 [0,2,0,0,0,0|1,0,0]=3 5383 B12R1.28 CCNCCc1cccc(c1)Cl bb3e937b0c5020373ac596c6a62d7c6c [0,2,0,0,0,0|1,0,0]=3 5384 B12R1.28 CCNCCc1cccc(c1)F b16016975d35bb1c00404543a6d7428f [0,2,0,0,0,0|1,0,0]=3 5385 B12R1.28 CCNCCc1cccc(c1)I b6e52167904a817c188d41fbe58465fb [0,2,0,0,0,0|1,0,0]=3 5386 B12R1.28 CCNCCc1cccc(n1)C 3000329d88efe2a226f3965b3f0354b4 [0,2,0,0,0,0|2,0,0]=4 5387 B12R1.28 CCNCCc1ccnc(c1)C b0eee97d48001267d4883731afd184d6 [0,2,0,0,0,0|2,0,0]=4 5388 B12R1.28 CCNCCc1cncc(c1)F 26f3bd16e308a2630e5283c42fb1b1c0 [0,2,0,0,0,0|2,0,0]=4 5389 B12R1.28 CCOCCc1cc(ccn1)Br 9443eaadded1848b1ec48a92121d84d2 [0,2,0,0,0,0|1,0,0]=3 5390 B12R1.28 CCOCCc1cccc(c1)Br d0f3ea49e7aa78e8012da5ebab2edff3 [0,2,0,0,0,0|0,0,0]=2 5391 B12R1.28 CCOCCc1cccc(c1)C e15d01aec8191a21a4d3b1c3faee8943 [0,2,0,0,0,0|0,0,0]=2 5392 B12R1.28 CCOCCc1cccc(c1)Cl 7d0820bb278ad9103dd8a2b1a1cfa5f9 [0,2,0,0,0,0|0,0,0]=2 5393 B12R1.28 CCOCCc1cccc(c1)F e796a8f4963a7eb406c1cd938057b94f [0,2,0,0,0,0|0,0,0]=2 5394 B12R1.28 CCOCCc1cccc(c1)I 23bb8fca7b33897456b96ef7e6cee085 [0,2,0,0,0,0|0,0,0]=2 5395 B12R1.28 CCOCCc1cccc(n1)Br 9e12569e7cc680edf89a28b25fabeaa5 [0,2,0,0,0,0|1,0,0]=3 5396 B12R1.28 CCOCCc1cccc(n1)C 6a9b5ee2ad20867e1b3d0472855f1891 [0,2,0,0,0,0|1,0,0]=3 5397 B12R1.28 CCOCCc1cccc(n1)Cl 196e1e86d26cd7dae35a23baf851489a [0,2,0,0,0,0|1,0,0]=3 5398 B12R1.28 CCOCCc1ccnc(c1)Cl 110c9b886ad89a3b2bea68ea8c959cf1 [0,2,0,0,0,0|1,0,0]=3 5399 B12R1.28 CCOCCc1cncc(c1)F 3b025a833cca82078668ddbcc40f8614 [0,2,0,0,0,0|1,0,0]=3 5400 B12R1.28 CCOCCc1cncc(n1)Cl bebdee3618169fefb9142581278397d5 [0,2,0,0,0,0|2,0,0]=4 5401 B12R1.28 CCOCNc1cc(ccn1)Br b96bdbd051f259efac3000c136d655c9 [0,2,0,0,0,0|2,0,0]=4 5402 B12R1.28 CCOCNc1cc(ccn1)C 56f78bd464a08458fdc66b26fb670204 [0,2,0,0,0,0|2,0,0]=4 5403 B12R1.28 CCOCNc1cc(ccn1)F e69a54cfd95c6660a372889956c4cc67 [0,2,0,0,0,0|2,0,0]=4 5404 B12R1.28 CCOCNc1cc[nH]c(=S)c1 145347eb69135e185812eb6ef0fa3cac [0,2,0,0,0,0|2,0,0]=4 5405 B12R1.28 CCOCNc1cccc(c1)Br 0ccb51e60749641090e21729194b875a [0,2,0,0,0,0|1,0,0]=3 5406 B12R1.28 CCOCNc1cccc(c1)C 162df6bb26c921cb111acfe1026254c7 [0,2,0,0,0,0|1,0,0]=3 5407 B12R1.28 CCOCNc1cccc(c1)Cl 8824cc617cff1d1fc0ee83eee7763a48 [0,2,0,0,0,0|1,0,0]=3 5408 B12R1.28 CCOCNc1cccc(c1)F 902a3f5d7af769ec952b2e1a49065281 [0,2,0,0,0,0|1,0,0]=3 5409 B12R1.28 CCOCNc1cccc(c1)I fc22ee26d6a8e0a8eaed7b48226b7ddf [0,2,0,0,0,0|1,0,0]=3 5410 B12R1.28 CCOCNc1cccc(c1)S d6453b14e25a1bff2740b140957f26a4 [0,2,0,0,0,0|1,0,0]=3 5411 B12R1.28 CCOCNc1cccc(n1)Br 948a1250c447bc25bc2b2c7cd567785b [0,2,0,0,0,0|2,0,0]=4 5412 B12R1.28 CCOCNc1cccc(n1)C b8a166afd5371f8415501a70e25b6449 [0,2,0,0,0,0|2,0,0]=4 5413 B12R1.28 CCOCNc1cccc(n1)F 111c282efaf21a88c3d32915bfd8dff0 [0,2,0,0,0,0|2,0,0]=4 5414 B12R1.28 CCOCNc1cccc(n1)I 31b433bef758e2843c4d5c05e32b2cc9 [0,2,0,0,0,0|2,0,0]=4 5415 B12R1.28 CCOCNc1ccnc(c1)Br 516d99bdc33440b6ab3ae56feeeb7d3c [0,2,0,0,0,0|2,0,0]=4 5416 B12R1.28 CCOCNc1ccnc(c1)C e1924844617fa303ffffbc107b31870e [0,2,0,0,0,0|2,0,0]=4 5417 B12R1.28 CCOCNc1ccnc(c1)Cl 885beac66b15b5d30698ae3f54611c59 [0,2,0,0,0,0|2,0,0]=4 5418 B12R1.28 CCOCNc1ccnc(c1)F f93577bed539b0f8d855dc7ed897a3a0 [0,2,0,0,0,0|2,0,0]=4 5419 B12R1.28 CCOCNc1ccnc(c1)I a73fd2969279539c97b0be472abc4975 [0,2,0,0,0,0|2,0,0]=4 5420 B12R1.28 CCOCNc1cncc(c1)C 06084c57365a0328e96475a75d377bd4 [0,2,0,0,0,0|2,0,0]=4 5421 B12R1.28 CCOCNc1cncc(c1)Cl 9a08983e61b6b148e49a3b5fc3e3842d [0,2,0,0,0,0|2,0,0]=4 5422 B12R1.28 CCOCNc1cncc(c1)F 90502faf7ec86451560d224c8ae778ea [0,2,0,0,0,0|2,0,0]=4 5423 B12R1.28 CCOCNc1cncc(c1)I 9cc200bd0fcdeaaf417fb2f8d5ce3b4b [0,2,0,0,0,0|2,0,0]=4 5424 B12R1.28 CCOCOc1cc(ccn1)Br 2fedb485e585a8e76cffed5ea80261a3 [0,2,0,0,0,0|2,0,0]=4 5425 B12R1.28 CCOCOc1cc(ccn1)C 4758279579bf133a6080ae53d0b2b300 [0,2,0,0,0,0|2,0,0]=4 5426 B12R1.28 CCOCOc1cc(ccn1)F b8520094bf0b5f5d909ed3c75eb8dac0 [0,2,0,0,0,0|2,0,0]=4 5427 B12R1.28 CCOCOc1cccc(c1)Br 9c820c07659370bda4abf9e35606d1b8 [0,2,0,0,0,0|1,0,0]=3 5428 B12R1.28 CCOCOc1cccc(c1)C 31ccd5439bd157242e4675fa35f1e6b7 [0,2,0,0,0,0|1,0,0]=3 5429 B12R1.28 CCOCOc1cccc(c1)Cl 240c59c898803bd54edd866e61892be5 [0,2,0,0,0,0|1,0,0]=3 5430 B12R1.28 CCOCOc1cccc(c1)F a5c721a2e96fa6032c4f4da63177d9c4 [0,2,0,0,0,0|1,0,0]=3 5431 B12R1.28 CCOCOc1cccc(c1)I bd32b3bb28eaf86d6a585505df5163f4 [0,2,0,0,0,0|1,0,0]=3 5432 B12R1.28 CCOCOc1cccc(c1)S 73f4e2d151548b59a146fc80d1dc0302 [0,2,0,0,0,0|1,0,0]=3 5433 B12R1.28 CCOCOc1cccc(n1)Br 9e6ad8cfd31aa73dce7f71cfa3073495 [0,2,0,0,0,0|2,0,0]=4 5434 B12R1.28 CCOCOc1cccc(n1)C 4ecde237bbe7c1b95edf50a5d5d21b7d [0,2,0,0,0,0|2,0,0]=4 5435 B12R1.28 CCOCOc1cccc(n1)F 7709cb5af1df8195d7ad7f3410c514b6 [0,2,0,0,0,0|2,0,0]=4 5436 B12R1.28 CCOCOc1ccnc(c1)Br 66fefe973548e6ee5a490cb567cc8959 [0,2,0,0,0,0|2,0,0]=4 5437 B12R1.28 CCOCOc1ccnc(c1)C 1b31ef44a8a84607dead39be8f1482a3 [0,2,0,0,0,0|2,0,0]=4 5438 B12R1.28 CCOCOc1ccnc(c1)Cl 53fb7fa80b4be6ee8282caa65fbb094d [0,2,0,0,0,0|2,0,0]=4 5439 B12R1.28 CCOCOc1ccnc(c1)F 4989cb435870ac831c21ae9d4516251a [0,2,0,0,0,0|2,0,0]=4 5440 B12R1.28 CCOCOc1cncc(c1)I e8403218e0f3bc306bda3d4213e014be [0,2,0,0,0,0|2,0,0]=4 5441 B12R1.28 COCCNc1c[n+](ccn1)[O-] 8a4ddb737311d3bffe7c83ab339ca34e [0,2,0,0,0,0|2,0,0]=4 5442 B12R1.28 COCCNc1cc(ccn1)Br ee1d551725be2c9befc37ac5d1283453 [0,2,0,0,0,0|1,0,0]=3 5443 B12R1.28 COCCNc1cc(ccn1)C 85fc408ff8d9f056e577dc9758b32dad [0,2,0,0,0,0|1,0,0]=3 5444 B12R1.28 COCCNc1cc(ccn1)Cl d36458456327e7c28778da93c2109dd2 [0,2,0,0,0,0|1,0,0]=3 5445 B12R1.28 COCCNc1cc(ccn1)F 8e0823a72bbbe95689d3cb62938bb740 [0,2,0,0,0,0|1,0,0]=3 5446 B12R1.28 COCCNc1cc(ccn1)I 7dbd6bf0c1403ce3a4b0204b02747d4d [0,2,0,0,0,0|1,0,0]=3 5447 B12R1.28 COCCNc1cc(ccn1)O 7e7b9aa81faf890f17c56e59f494936e [0,2,0,0,0,0|1,0,0]=3 5448 B12R1.28 COCCNc1cc(cnn1)Br 23817a41da29fdb65fbf2f59f6d1a537 [0,2,0,0,0,0|2,0,0]=4 5449 B12R1.28 COCCNc1cc(cnn1)C 23a0549749b864318b7152d6bd66988d [0,2,0,0,0,0|2,0,0]=4 5450 B12R1.28 COCCNc1cc(cnn1)Cl c469a3f23ff3508cdafdb70afae276d8 [0,2,0,0,0,0|2,0,0]=4 5451 B12R1.28 COCCNc1cc(ncn1)Br 4a76609903003e0a320357fa3ccba8e4 [0,2,0,0,0,0|2,0,0]=4 5452 B12R1.28 COCCNc1cc(ncn1)C 77b0e21953d5117ac903e308b6b5f502 [0,2,0,0,0,0|2,0,0]=4 5453 B12R1.28 COCCNc1cc(ncn1)Cl b57cff79d5b67fa0aea6b45707c9385b [0,2,0,0,0,0|2,0,0]=4 5454 B12R1.28 COCCNc1cc(ncn1)F 4428dea0bbb6adc252f4958736ff1783 [0,2,0,0,0,0|2,0,0]=4 5455 B12R1.28 COCCNc1cc(ncn1)I 01415314e5385ac6e45643a1d1899a22 [0,2,0,0,0,0|2,0,0]=4 5456 B12R1.28 COCCNc1cc[nH]c(=O)n1 529c1f30fe2b8d9e61a628939f43f447 [0,2,0,0,0,0|2,0,0]=4 5457 B12R1.28 COCCNc1cc[nH]c(=S)c1 108efeaf61ec1c3b38a60014f4ffc888 [0,2,0,0,0,0|1,0,0]=3 5458 B12R1.28 COCCNc1ccc[n+](c1)[O-] 5a8f2f9fb7b8f2dabcaaf4fa32da8c66 [0,2,0,0,0,0|1,0,0]=3 5459 B12R1.28 COCCNc1cccc(=O)[nH]1 3aa34b4af1ffe1bbf01fdd97da74fa71 [0,2,0,0,0,0|1,0,0]=3 5460 B12R1.28 COCCNc1cccc(c1)Br 71c77c9c3df6a6c91c314b11ceb1849d [0,2,0,0,0,0|0,0,0]=2 5461 B12R1.28 COCCNc1cccc(c1)C 5ef431b95b6bf510cdcd4f0b49dfc6bc [0,2,0,0,0,0|0,0,0]=2 5462 B12R1.28 COCCNc1cccc(c1)Cl 6598ecbda65ef257fda9088d5594ab03 [0,2,0,0,0,0|0,0,0]=2 5463 B12R1.28 COCCNc1cccc(c1)F 0a10994accbb1998222640a161ec1a85 [0,2,0,0,0,0|0,0,0]=2 5464 B12R1.28 COCCNc1cccc(c1)I e043208ffe523e43da91158a2f9dcbd0 [0,2,0,0,0,0|0,0,0]=2 5465 B12R1.28 COCCNc1cccc(c1)O 800174eec4e3bda203f4052df1e6de1f [0,2,0,0,0,0|0,0,0]=2 5466 B12R1.28 COCCNc1cccc(c1)S 90dc9fa308d381631b78a6cfa68bc57b [0,2,0,0,0,0|0,0,0]=2 5467 B12R1.28 COCCNc1cccc(n1)Br cb9250979eb107d81df46325b40a7e6d [0,2,0,0,0,0|1,0,0]=3 5468 B12R1.28 COCCNc1cccc(n1)C f7dcea4e399d78bbd42358205ed2bc77 [0,2,0,0,0,0|1,0,0]=3 5469 B12R1.28 COCCNc1cccc(n1)Cl 2908ab7a7ed37a11edcea5cdc2075367 [0,2,0,0,0,0|1,0,0]=3 5470 B12R1.28 COCCNc1cccc(n1)F 9836c3d58b7dd7401e24e5150b6f3f0e [0,2,0,0,0,0|1,0,0]=3 5471 B12R1.28 COCCNc1cccc(n1)I 4fa48ae7986ee991138495f48d05ed4b [0,2,0,0,0,0|1,0,0]=3 5472 B12R1.28 COCCNc1ccnc(c1)Br 21a5b23ed08ca99b6dc32c67f3b5529a [0,2,0,0,0,0|1,0,0]=3 5473 B12R1.28 COCCNc1ccnc(c1)C 78e33c7974a5c21444163827e741c650 [0,2,0,0,0,0|1,0,0]=3 5474 B12R1.28 COCCNc1ccnc(c1)Cl dec56055cd9d8365469e1ae94d011334 [0,2,0,0,0,0|1,0,0]=3 5475 B12R1.28 COCCNc1ccnc(c1)F 660d7771ffb58f7efa113c274ccae080 [0,2,0,0,0,0|1,0,0]=3 5476 B12R1.28 COCCNc1ccnc(c1)I 0f7917878fee1ee50b311aa02b78c323 [0,2,0,0,0,0|1,0,0]=3 5477 B12R1.28 COCCNc1ccnc(c1)O 92054a9b05f27538ac4c1d5ca3ac5023 [0,2,0,0,0,0|1,0,0]=3 5478 B12R1.28 COCCNc1ccnc(n1)Br e66e1e15bd9caf90760107bd1ee44255 [0,2,0,0,0,0|2,0,0]=4 5479 B12R1.28 COCCNc1ccnc(n1)C 552ec8b79e2c803bbde9178c42ea7380 [0,2,0,0,0,0|2,0,0]=4 5480 B12R1.28 COCCNc1ccnc(n1)Cl a544307c2c92c11375fb32c81a9b883b [0,2,0,0,0,0|2,0,0]=4 5481 B12R1.28 COCCNc1ccnc(n1)F 2d80f74e5373f12c0f6c8c34e86461cd [0,2,0,0,0,0|2,0,0]=4 5482 B12R1.28 COCCNc1ccnc(n1)S 21d2a1307f338ed2da70f3aab5e13dcb [0,2,0,0,0,0|2,0,0]=4 5483 B12R1.28 COCCNc1cn[nH]c(=O)c1 58eadac15798bf632812d117fe6d73c4 [0,2,0,0,0,0|2,0,0]=4 5484 B12R1.28 COCCNc1cncc(=S)[nH]1 418c22fa732e20613b47024a48c56687 [0,2,0,0,0,0|2,0,0]=4 5485 B12R1.28 COCCNc1cncc(c1)Br a871bb8079147f7552c415855a1b202e [0,2,0,0,0,0|1,0,0]=3 5486 B12R1.28 COCCNc1cncc(c1)C 31db0a425e2050ea74ab0b93f4636e17 [0,2,0,0,0,0|1,0,0]=3 5487 B12R1.28 COCCNc1cncc(c1)Cl f97d7a9633a27cbba6568023465581f8 [0,2,0,0,0,0|1,0,0]=3 5488 B12R1.28 COCCNc1cncc(c1)F 39c1f1315e1cdd6983e3dd0fffdb26c4 [0,2,0,0,0,0|1,0,0]=3 5489 B12R1.28 COCCNc1cncc(c1)I 659b7935f44cd3bc009382557f21a142 [0,2,0,0,0,0|1,0,0]=3 5490 B12R1.28 COCCNc1cncc(c1)O 0c70dc51513e35d30202e6ba4cf1ecbd [0,2,0,0,0,0|1,0,0]=3 5491 B12R1.28 COCCNc1cncc(n1)Br 89855e59698b69f56cd3fc10e18ce201 [0,2,0,0,0,0|2,0,0]=4 5492 B12R1.28 COCCNc1cncc(n1)C 885c9ecb665aa9cdfd9785bb311df172 [0,2,0,0,0,0|2,0,0]=4 5493 B12R1.28 COCCNc1cncc(n1)Cl 1b4ef2240590f5f2f52ee3ca49a5f370 [0,2,0,0,0,0|2,0,0]=4 5494 B12R1.28 COCCNc1cncc(n1)F db41f32a77dfb3172f721fbc66c14719 [0,2,0,0,0,0|2,0,0]=4 5495 B12R1.28 COCCNc1cncc(n1)O 518ce7587d3d5a4947fc2ecc2c45db95 [0,2,0,0,0,0|2,0,0]=4 5496 B12R1.28 COCCNc1cnnc(c1)Cl 90f03f1020b71e319a5b48f10011e764 [0,2,0,0,0,0|2,0,0]=4 5497 B12R1.28 COCCNc1cnnc(c1)F 9908f2fddbe946c805e16f0283bec7fb [0,2,0,0,0,0|2,0,0]=4 5498 B12R1.28 COCCNc1nccc(=O)[nH]1 fdc26e27bda0ece92bdb62695ccb510a [0,2,0,0,0,0|2,0,0]=4 5499 B12R1.28 COCCNc1nccc(n1)Br 82db8d472d4879efe60ca05f1276c9eb [0,2,0,0,0,0|2,0,0]=4 5500 B12R1.28 COCCNc1nccc(n1)C 0985e9c8027466c85d7648b66cd9d8d2 [0,2,0,0,0,0|2,0,0]=4 5501 B12R1.28 COCCNc1nccc(n1)Cl 77847216c41663d4e49b62af694a7449 [0,2,0,0,0,0|2,0,0]=4 5502 B12R1.28 COCCNc1nccc(n1)F 7e370e44f429610e16a896df60d53038 [0,2,0,0,0,0|2,0,0]=4 5503 B12R1.28 COCCNc1nccc(n1)I 4dc6ab156155816d85d7ccc8292e7165 [0,2,0,0,0,0|2,0,0]=4 5504 B12R1.28 COCCNc1nccc(n1)S 239b1783f15f16c339346cb3261bf2a1 [0,2,0,0,0,0|2,0,0]=4 5505 B12R1.28 COCCOc1cc(ccn1)Br 7440a534c6c9b2c7ba635c34687f3bfc [0,2,0,0,0,0|1,0,0]=3 5506 B12R1.28 COCCOc1cc(ccn1)C cee4c5491bbe30d12f3bd1e5bf5e9661 [0,2,0,0,0,0|1,0,0]=3 5507 B12R1.28 COCCOc1cc(ccn1)Cl 78e1491df8e0396d7b0045053e26fb3a [0,2,0,0,0,0|1,0,0]=3 5508 B12R1.28 COCCOc1cc(ccn1)F 8dda2eb8ba05fbe3fa96bf80df27331b [0,2,0,0,0,0|1,0,0]=3 5509 B12R1.28 COCCOc1cc(ncn1)Br cdb154f8ac16714790dbd41fc8afda74 [0,2,0,0,0,0|2,0,0]=4 5510 B12R1.28 COCCOc1cc(ncn1)C 2d2facecff8e63241ad5265dbca573ee [0,2,0,0,0,0|2,0,0]=4 5511 B12R1.28 COCCOc1cc(ncn1)Cl 1a27357b024da952ed5acd49d41cd794 [0,2,0,0,0,0|2,0,0]=4 5512 B12R1.28 COCCOc1ccc[n+](c1)[O-] 4940e6b14a9c82fb539a5450737b2b5c [0,2,0,0,0,0|1,0,0]=3 5513 B12R1.28 COCCOc1cccc(=O)[nH]1 c3e8ecdee4feded6b9db292d2c7128d1 [0,2,0,0,0,0|1,0,0]=3 5514 B12R1.28 COCCOc1cccc(c1)Br 47127a9e4c85bd373a527053864e820c [0,2,0,0,0,0|0,0,0]=2 5515 B12R1.28 COCCOc1cccc(c1)C cd5901f2ef21173701644b3d97a50385 [0,2,0,0,0,0|0,0,0]=2 5516 B12R1.28 COCCOc1cccc(c1)Cl e5978f2ed7da6efb1acfdff8b377cd31 [0,2,0,0,0,0|0,0,0]=2 5517 B12R1.28 COCCOc1cccc(c1)F 2680a1a7a75b0f57b56e4116ce7c123b [0,2,0,0,0,0|0,0,0]=2 5518 B12R1.28 COCCOc1cccc(c1)I 4ac55f904251f043d9bb19c5959fa499 [0,2,0,0,0,0|0,0,0]=2 5519 B12R1.28 COCCOc1cccc(c1)S e22098f19d4e0566337c51f23c7aa555 [0,2,0,0,0,0|0,0,0]=2 5520 B12R1.28 COCCOc1cccc(n1)Br 1fb71bc0878da06ac4795b741636bd1c [0,2,0,0,0,0|1,0,0]=3 5521 B12R1.28 COCCOc1cccc(n1)C 36c0fe9a371109bfd1e5b32be1554b55 [0,2,0,0,0,0|1,0,0]=3 5522 B12R1.28 COCCOc1cccc(n1)F 049c2621e59c939853f3de508dafbe00 [0,2,0,0,0,0|1,0,0]=3 5523 B12R1.28 COCCOc1ccnc(c1)Br 3073b8e060958442a0b0d6e0231c1be2 [0,2,0,0,0,0|1,0,0]=3 5524 B12R1.28 COCCOc1ccnc(c1)C 7879f94767ec31ec58df1511d5249dd3 [0,2,0,0,0,0|1,0,0]=3 5525 B12R1.28 COCCOc1ccnc(c1)Cl b9603b132d5aaffff770e23e756cc79f [0,2,0,0,0,0|1,0,0]=3 5526 B12R1.28 COCCOc1ccnc(c1)F 43980d42c1585ec66efcf8384bc43ab3 [0,2,0,0,0,0|1,0,0]=3 5527 B12R1.28 COCCOc1ccnc(n1)C 4919f0944503499f635ac8c0a69ba908 [0,2,0,0,0,0|2,0,0]=4 5528 B12R1.28 COCCOc1ccnc(n1)Cl 95f229d1087e418dacee58c9f64f5d93 [0,2,0,0,0,0|2,0,0]=4 5529 B12R1.28 COCCOc1cncc(c1)Br c3e5949798885818d742806bba8c7ef5 [0,2,0,0,0,0|1,0,0]=3 5530 B12R1.28 COCCOc1cncc(c1)C 9da29b939f6dbced618bd47e1877a021 [0,2,0,0,0,0|1,0,0]=3 5531 B12R1.28 COCCOc1cncc(c1)Cl 9c42b3219cbd7d62d4cc496e7f2d8c88 [0,2,0,0,0,0|1,0,0]=3 5532 B12R1.28 COCCOc1cncc(c1)F 305d1655ef0b794a515a69dcb42f4793 [0,2,0,0,0,0|1,0,0]=3 5533 B12R1.28 COCCOc1cncc(c1)I 2fb5ce9b9354328460b86dffbaefa3c2 [0,2,0,0,0,0|1,0,0]=3 5534 B12R1.28 COCCOc1cncc(n1)Br dc666c85175d4d2953595a239427425f [0,2,0,0,0,0|2,0,0]=4 5535 B12R1.28 COCCOc1cncc(n1)C 03bf58604a8c84d5e2df3b30a65a2cb0 [0,2,0,0,0,0|2,0,0]=4 5536 B12R1.28 COCCOc1cncc(n1)Cl ba4dece59d6d956959f7af2116e2e50a [0,2,0,0,0,0|2,0,0]=4 5537 B12R1.28 COCCOc1cnnc(c1)Cl 26cf1b16798e80710811987517750351 [0,2,0,0,0,0|2,0,0]=4 5538 B12R1.28 COCCOc1nccc(n1)Cl babf7818996d362b0a9e20a6d855778f [0,2,0,0,0,0|2,0,0]=4 5539 B12R1.28 COCCOc1nccc(n1)S 105f4349fd7c97802d0454b10dad9ff9 [0,2,0,0,0,0|2,0,0]=4 5540 B12R1.28 COCNCc1cc(ccn1)Br dd3945e0927cb37503f7c04a7a982bbc [0,2,0,0,0,0|1,0,0]=3 5541 B12R1.28 COCNCc1cc(ccn1)C d805175601fb6ca8e978fc164e6a5c3f [0,2,0,0,0,0|1,0,0]=3 5542 B12R1.28 COCNCc1cc(ccn1)Cl cb4bae921586d8c2756296d517cff2e8 [0,2,0,0,0,0|1,0,0]=3 5543 B12R1.28 COCNCc1cc[nH]c(=O)c1 3e789cb8cc0deeb6cb5e23247df93ea1 [0,2,0,0,0,0|1,0,0]=3 5544 B12R1.28 COCNCc1cc[nH]c(=O)n1 c2f31f01e72bd7672b65216df2120590 [0,2,0,0,0,0|2,0,0]=4 5545 B12R1.28 COCNCc1ccc[n+](c1)[O-] 70afd1e055f78b59e700b4a505dd342f [0,2,0,0,0,0|1,0,0]=3 5546 B12R1.28 COCNCc1cccc(c1)Br bb26088e9109faf63b2c5aab82a0bab2 [0,2,0,0,0,0|0,0,0]=2 5547 B12R1.28 COCNCc1cccc(c1)C 2a616a68489893ac9fc4786c5bd224bd [0,2,0,0,0,0|0,0,0]=2 5548 B12R1.28 COCNCc1cccc(c1)Cl ca1fb393701eed7a8728da9d87eb9356 [0,2,0,0,0,0|0,0,0]=2 5549 B12R1.28 COCNCc1cccc(c1)F cb55f4e89d5e0d7efcab729f0b524b91 [0,2,0,0,0,0|0,0,0]=2 5550 B12R1.28 COCNCc1cccc(c1)I 5bb13b291c47f5546b24577b4829b678 [0,2,0,0,0,0|0,0,0]=2 5551 B12R1.28 COCNCc1cccc(n1)Br b5ae853ad471104a0e8142f2423589ad [0,2,0,0,0,0|1,0,0]=3 5552 B12R1.28 COCNCc1cccc(n1)C cdab8ec141bcfb97a079f3db879ac9cc [0,2,0,0,0,0|1,0,0]=3 5553 B12R1.28 COCNCc1cccc(n1)Cl ce8b827ea365018cec137ab326f8654f [0,2,0,0,0,0|1,0,0]=3 5554 B12R1.28 COCNCc1cccc(n1)F f44becff6669b8944b23bec591b4884e [0,2,0,0,0,0|1,0,0]=3 5555 B12R1.28 COCNCc1ccnc(c1)Br 228a8396ce69cdbed382335b9eff3a4d [0,2,0,0,0,0|1,0,0]=3 5556 B12R1.28 COCNCc1ccnc(c1)C bc949d5c397fee6bd552846cfaa7b999 [0,2,0,0,0,0|1,0,0]=3 5557 B12R1.28 COCNCc1ccnc(c1)Cl 2f4c03f46b845e8b7fdf944d98729db7 [0,2,0,0,0,0|1,0,0]=3 5558 B12R1.28 COCNCc1ccnc(c1)F de459df490f93dfcc2f5585d3124d3cd [0,2,0,0,0,0|1,0,0]=3 5559 B12R1.28 COCNCc1ccnc(n1)C c618323d8019d7e5de7d49cbfd2c929f [0,2,0,0,0,0|2,0,0]=4 5560 B12R1.28 COCNCc1cncc(c1)Br 253e61862246c55731d63d516f4c83ef [0,2,0,0,0,0|1,0,0]=3 5561 B12R1.28 COCNCc1cncc(c1)C 669b3e6317d330d0f59dc1ee77a93449 [0,2,0,0,0,0|1,0,0]=3 5562 B12R1.28 COCNCc1cncc(c1)Cl a2c28dcf466062bddd29d77c23de31a7 [0,2,0,0,0,0|1,0,0]=3 5563 B12R1.28 COCNCc1cncc(c1)F 61c8c597ae0de05654aeaf0f10619ef1 [0,2,0,0,0,0|1,0,0]=3 5564 B12R1.28 COCNCc1cncc(n1)Cl 94ec9f229057dbcc3f64273850105eca [0,2,0,0,0,0|2,0,0]=4 5565 B12R1.28 COCNCc1nccc(n1)C 34d2a9303eb82a270d76c17ab2d5123d [0,2,0,0,0,0|2,0,0]=4 5566 B12R1.28 COCNCc1nccc(n1)Cl 41cef9a2aa9cb5b316cd5cfdfb526140 [0,2,0,0,0,0|2,0,0]=4 5567 B12R1.28 COCOCc1cc(ccn1)Br a310f049d6055b2642314946d42de21c [0,2,0,0,0,0|1,0,0]=3 5568 B12R1.28 COCOCc1cc(ccn1)C 0c5362de6a2ba86892971dcc793db187 [0,2,0,0,0,0|1,0,0]=3 5569 B12R1.28 COCOCc1cc(ccn1)Cl 0ddac00262a9c8feb431efc74d8795f3 [0,2,0,0,0,0|1,0,0]=3 5570 B12R1.28 COCOCc1cc(ccn1)F f2a6b28a81e694a0670e861cabf96044 [0,2,0,0,0,0|1,0,0]=3 5571 B12R1.28 COCOCc1cc(ccn1)I 1adf91a9a04cbce7cb3eab37ab694e56 [0,2,0,0,0,0|1,0,0]=3 5572 B12R1.28 COCOCc1cc(cnn1)C bd732f4b9817dc86585281815c816add [0,2,0,0,0,0|2,0,0]=4 5573 B12R1.28 COCOCc1cc(ncn1)C bb7c553c3a8a097dc18effcb8dc2af5e [0,2,0,0,0,0|2,0,0]=4 5574 B12R1.28 COCOCc1cc(ncn1)Cl fc13bf98bcd9ad5c36bf4fcf3d0065d1 [0,2,0,0,0,0|2,0,0]=4 5575 B12R1.28 COCOCc1cc[nH]c(=O)c1 9f1ca1aa36256fb4ffecf2aae64ad251 [0,2,0,0,0,0|1,0,0]=3 5576 B12R1.28 COCOCc1ccc[n+](c1)[O-] 15306f3adcba41b63ce3c2c8b89afba2 [0,2,0,0,0,0|1,0,0]=3 5577 B12R1.28 COCOCc1cccc(c1)Br c6cf95c46ea4a77f05562ffd28f5ef20 [0,2,0,0,0,0|0,0,0]=2 5578 B12R1.28 COCOCc1cccc(c1)C 1d01d33a1b21700c4557a3eb1da01433 [0,2,0,0,0,0|0,0,0]=2 5579 B12R1.28 COCOCc1cccc(c1)Cl 725bbbfeda6dcaba43944749d2426b05 [0,2,0,0,0,0|0,0,0]=2 5580 B12R1.28 COCOCc1cccc(c1)F dcd42a5011050a007fb2422fa7534624 [0,2,0,0,0,0|0,0,0]=2 5581 B12R1.28 COCOCc1cccc(c1)I 4b864b485a6df11ced7a4a705c084d98 [0,2,0,0,0,0|0,0,0]=2 5582 B12R1.28 COCOCc1cccc(n1)Br c8a86839a1e3acfaafd34486b37f65d9 [0,2,0,0,0,0|1,0,0]=3 5583 B12R1.28 COCOCc1cccc(n1)C c14c63d4030f3848a09d28e8980375e1 [0,2,0,0,0,0|1,0,0]=3 5584 B12R1.28 COCOCc1cccc(n1)Cl bf7f280c5a1c9adc51c7a49fc21a9128 [0,2,0,0,0,0|1,0,0]=3 5585 B12R1.28 COCOCc1cccc(n1)F 270796bf2c9cfaf699ca24d668152740 [0,2,0,0,0,0|1,0,0]=3 5586 B12R1.28 COCOCc1cccc(n1)I fc0c3570d46fee9100c030de749cbfd6 [0,2,0,0,0,0|1,0,0]=3 5587 B12R1.28 COCOCc1ccnc(=O)[nH]1 e95124cd72d8711e0339c6a925f57582 [0,2,0,0,0,0|2,0,0]=4 5588 B12R1.28 COCOCc1ccnc(c1)Br fd14b2a9bbcb823658baafbe211e6c52 [0,2,0,0,0,0|1,0,0]=3 5589 B12R1.28 COCOCc1ccnc(c1)C 88cc02ffe4103e69ee81471f363612dd [0,2,0,0,0,0|1,0,0]=3 5590 B12R1.28 COCOCc1ccnc(c1)Cl e218febb94a1da7ee378e5f77d9cf366 [0,2,0,0,0,0|1,0,0]=3 5591 B12R1.28 COCOCc1ccnc(c1)F 61b6a1d5dc056ba847f3df4f3bfd3d44 [0,2,0,0,0,0|1,0,0]=3 5592 B12R1.28 COCOCc1ccnc(n1)C adfa32af6c6cda7c0fac3fb457e906c3 [0,2,0,0,0,0|2,0,0]=4 5593 B12R1.28 COCOCc1ccnc(n1)Cl 09fe838a472672a29c50238be9b32edb [0,2,0,0,0,0|2,0,0]=4 5594 B12R1.28 COCOCc1cncc(c1)Br 92ffefa4f4b0c9e06345169b4bbdc151 [0,2,0,0,0,0|1,0,0]=3 5595 B12R1.28 COCOCc1cncc(c1)C 118622b3f20912dabe8f0be207080fff [0,2,0,0,0,0|1,0,0]=3 5596 B12R1.28 COCOCc1cncc(c1)Cl dd38920f4ed9d0f8988cf48f2d973821 [0,2,0,0,0,0|1,0,0]=3 5597 B12R1.28 COCOCc1cncc(c1)F c2011cef3c516c7a3ae745e3482b6c19 [0,2,0,0,0,0|1,0,0]=3 5598 B12R1.28 COCOCc1cncc(c1)I d334f3475ab00a0ef72be323a5a1c434 [0,2,0,0,0,0|1,0,0]=3 5599 B12R1.28 COCOCc1cncc(n1)Br 984dbcf50463511fde7d5ea1768d821e [0,2,0,0,0,0|2,0,0]=4 5600 B12R1.28 COCOCc1cncc(n1)Cl 95ce671b0f763cb7d63eee4023c053bd [0,2,0,0,0,0|2,0,0]=4 5601 B12R1.28 COCOCc1nccc(n1)C 9fb30cb92f772cd92786fa78bb8f0617 [0,2,0,0,0,0|2,0,0]=4 5602 B12R1.28 COCOCc1nccc(n1)Cl b0a33ea221b7070d62094a26888e6be6 [0,2,0,0,0,0|2,0,0]=4 5603 B12R1.28 CSCCNc1cc(ccn1)Br f55ebecf88a6898a74eacd6c75454672 [0,2,0,0,0,0|1,1,0]=4 5604 B12R1.28 CSCCNc1cc(ccn1)C c04c052f88fa57c2da5a8a691a58edbf [0,2,0,0,0,0|1,1,0]=4 5605 B12R1.28 CSCCNc1cc(ccn1)Cl e2e1ecd8f937a18bd1dd9a87a53d1d09 [0,2,0,0,0,0|1,1,0]=4 5606 B12R1.28 CSCCNc1cc(ccn1)F 525b543ca267a821e8df03435f44db1c [0,2,0,0,0,0|1,1,0]=4 5607 B12R1.28 CSCCNc1cc(ccn1)I 9a418a791edfeef13db813b889ada388 [0,2,0,0,0,0|1,1,0]=4 5608 B12R1.28 CSCCNc1cc[nH]c(=S)c1 f4b28a7272fddfb6eccff39b8d371524 [0,2,0,0,0,0|1,1,0]=4 5609 B12R1.28 CSCCNc1cccc(c1)Br 2be2fa3518e1fc60eb8a91ac4eeb1411 [0,2,0,0,0,0|0,1,0]=3 5610 B12R1.28 CSCCNc1cccc(c1)C bc9699ba8d498079a42024ba3e1c7ae3 [0,2,0,0,0,0|0,1,0]=3 5611 B12R1.28 CSCCNc1cccc(c1)Cl 5f0045ca103d5e06a23a5bbfdec86f6f [0,2,0,0,0,0|0,1,0]=3 5612 B12R1.28 CSCCNc1cccc(c1)F 1edcbda664525cbf7d6a7d8f869a6799 [0,2,0,0,0,0|0,1,0]=3 5613 B12R1.28 CSCCNc1cccc(c1)I 6a7d517cf2b82db23cd86cdaa1c0fb7f [0,2,0,0,0,0|0,1,0]=3 5614 B12R1.28 CSCCNc1cccc(c1)S dfae6331ccc7a6ebb67631202e57efeb [0,2,0,0,0,0|0,1,0]=3 5615 B12R1.28 CSCCNc1cccc(n1)Br 8642fec7fbf15294225be5e172cfda57 [0,2,0,0,0,0|1,1,0]=4 5616 B12R1.28 CSCCNc1cccc(n1)C f426c7a570621e4f58e278339592629e [0,2,0,0,0,0|1,1,0]=4 5617 B12R1.28 CSCCNc1cccc(n1)Cl 6c94ca8271cc57fb3f058d693f1d94ef [0,2,0,0,0,0|1,1,0]=4 5618 B12R1.28 CSCCNc1cccc(n1)F aff439da4da37ee4d7ca0f71a0f81826 [0,2,0,0,0,0|1,1,0]=4 5619 B12R1.28 CSCCNc1cccc(n1)I 0474894e0b23646e54ea484560cfba5e [0,2,0,0,0,0|1,1,0]=4 5620 B12R1.28 CSCCNc1ccnc(c1)Br a75f1014daf040ef12fb9821ac29c2ca [0,2,0,0,0,0|1,1,0]=4 5621 B12R1.28 CSCCNc1ccnc(c1)C 9f271763b2f3ddf91e93279cc645ca4f [0,2,0,0,0,0|1,1,0]=4 5622 B12R1.28 CSCCNc1ccnc(c1)Cl 462e3c9b88c528696fe7087c43e2adc2 [0,2,0,0,0,0|1,1,0]=4 5623 B12R1.28 CSCCNc1ccnc(c1)F 55d1d5be435c6f9f848afd212ae2bad3 [0,2,0,0,0,0|1,1,0]=4 5624 B12R1.28 CSCCNc1ccnc(c1)I 2b3284bc5a45794cefcfd9786432e5db [0,2,0,0,0,0|1,1,0]=4 5625 B12R1.28 CSCCNc1cncc(c1)Br f79dcdd105c4d270a41a60d8b08a76a9 [0,2,0,0,0,0|1,1,0]=4 5626 B12R1.28 CSCCNc1cncc(c1)C f4615db907083cfb38f97bd6d19ad5a0 [0,2,0,0,0,0|1,1,0]=4 5627 B12R1.28 CSCCNc1cncc(c1)Cl ff19488e7e6f31f28908831c8b9bf24f [0,2,0,0,0,0|1,1,0]=4 5628 B12R1.28 CSCCNc1cncc(c1)F f07518407dd5021569e00fbaacbfffce [0,2,0,0,0,0|1,1,0]=4 5629 B12R1.28 CSCCNc1cncc(c1)I 5e39a0438e5134d35e41ee9866152768 [0,2,0,0,0,0|1,1,0]=4 5630 B12R1.28 CSCCOc1cc(ccn1)Br f14010427d159a0ba200cd48081c50d1 [0,2,0,0,0,0|1,1,0]=4 5631 B12R1.28 CSCCOc1cc(ccn1)C fc8ea7dd8a41b498e45bb0e7fec224f9 [0,2,0,0,0,0|1,1,0]=4 5632 B12R1.28 CSCCOc1cc(ccn1)Cl ec9c671b287f4955b24a29401a6ca8a9 [0,2,0,0,0,0|1,1,0]=4 5633 B12R1.28 CSCCOc1cc(ccn1)F 438f5f6e0bec4c2eecfd493ed213733e [0,2,0,0,0,0|1,1,0]=4 5634 B12R1.28 CSCCOc1ccc[n+](c1)[O-] 2206d97cdda42236f2626ea7447e1910 [0,2,0,0,0,0|1,1,0]=4 5635 B12R1.28 CSCCOc1cccc(=O)[nH]1 7d2860da65d0f0884849ae4bfe8104bf [0,2,0,0,0,0|1,1,0]=4 5636 B12R1.28 CSCCOc1cccc(c1)Br 22a266b55a442675663ee39f1963e18c [0,2,0,0,0,0|0,1,0]=3 5637 B12R1.28 CSCCOc1cccc(c1)C 2e96c03f657c1253187506863a145fa5 [0,2,0,0,0,0|0,1,0]=3 5638 B12R1.28 CSCCOc1cccc(c1)Cl 493920a961deb1373d6fe513a96a2b82 [0,2,0,0,0,0|0,1,0]=3 5639 B12R1.28 CSCCOc1cccc(c1)F 19057a849912d54d32bc3de85a26e17a [0,2,0,0,0,0|0,1,0]=3 5640 B12R1.28 CSCCOc1cccc(c1)I 697230f0fb8ef2a3cf1830721d34217b [0,2,0,0,0,0|0,1,0]=3 5641 B12R1.28 CSCCOc1cccc(c1)S 36b7c7c9003edf97400f1e25f53ec6c1 [0,2,0,0,0,0|0,1,0]=3 5642 B12R1.28 CSCCOc1cccc(n1)Br 0eb0ffd4a04e46c27546a692af50b2ce [0,2,0,0,0,0|1,1,0]=4 5643 B12R1.28 CSCCOc1cccc(n1)C 6f93f43155425ac78d16777d1b59a1aa [0,2,0,0,0,0|1,1,0]=4 5644 B12R1.28 CSCCOc1cccc(n1)F a9e62f51d879fdf0185d2774135f66bc [0,2,0,0,0,0|1,1,0]=4 5645 B12R1.28 CSCCOc1ccnc(c1)Br 415e70c4fb93eadf89b6b94653a9ce0b [0,2,0,0,0,0|1,1,0]=4 5646 B12R1.28 CSCCOc1ccnc(c1)C e3adbe66e6dc2c1aec8300c829519382 [0,2,0,0,0,0|1,1,0]=4 5647 B12R1.28 CSCCOc1ccnc(c1)Cl bd6f93b886b7c26d69b806cccfba6cb9 [0,2,0,0,0,0|1,1,0]=4 5648 B12R1.28 CSCCOc1ccnc(c1)F 7e88aa8cebc72281f9ae756f7ff4a97c [0,2,0,0,0,0|1,1,0]=4 5649 B12R1.28 CSCCOc1cncc(c1)Br 55accb41631f0aece4804dee9473ec53 [0,2,0,0,0,0|1,1,0]=4 5650 B12R1.28 CSCCOc1cncc(c1)C 3aaa30bb31551fbbc1faf2f2b4744c8d [0,2,0,0,0,0|1,1,0]=4 5651 B12R1.28 CSCCOc1cncc(c1)Cl 5d711d21555419f1a23d0d50e26508f9 [0,2,0,0,0,0|1,1,0]=4 5652 B12R1.28 CSCCOc1cncc(c1)F 4a01b634bef12d54bc6daa4f7dfd12d9 [0,2,0,0,0,0|1,1,0]=4 5653 B12R1.28 CSCCOc1cncc(c1)I 2331a46cc8acbec286e348a099aad4a9 [0,2,0,0,0,0|1,1,0]=4 5654 B12R1.28 CSCNCc1cc(ccn1)Br ac4778f4042e96dbf652a2e02a002c16 [0,2,0,0,0,0|1,1,0]=4 5655 B12R1.28 CSCNCc1cc(ccn1)C f2acce9f98dc996e07e9db0968cf8f76 [0,2,0,0,0,0|1,1,0]=4 5656 B12R1.28 CSCNCc1cc(ccn1)Cl 01b2b97587b416c77fd00040dd41150e [0,2,0,0,0,0|1,1,0]=4 5657 B12R1.28 CSCNCc1cc[nH]c(=O)c1 ad27edc19a5725d3b2a986a221401a87 [0,2,0,0,0,0|1,1,0]=4 5658 B12R1.28 CSCNCc1ccc[n+](c1)[O-] 1a9e35f6ccca2d2bc2e043f91953fd6f [0,2,0,0,0,0|1,1,0]=4 5659 B12R1.28 CSCNCc1cccc(c1)Br f9d3f3c5610d32f15a4cccc9e2ad306a [0,2,0,0,0,0|0,1,0]=3 5660 B12R1.28 CSCNCc1cccc(c1)C 6a6a4f6b666f5b67a7439084c9fcaccb [0,2,0,0,0,0|0,1,0]=3 5661 B12R1.28 CSCNCc1cccc(c1)Cl 222e4156e96d8b1d469c8abc375a9dee [0,2,0,0,0,0|0,1,0]=3 5662 B12R1.28 CSCNCc1cccc(c1)F a17bfd137359dc9e621dd8a626e9d1f1 [0,2,0,0,0,0|0,1,0]=3 5663 B12R1.28 CSCNCc1cccc(c1)I 5225bad32a989b6a0930ae62d876e258 [0,2,0,0,0,0|0,1,0]=3 5664 B12R1.28 CSCNCc1cccc(n1)Br 7f69fdebad4ed872cf3c71f3cac4a8cd [0,2,0,0,0,0|1,1,0]=4 5665 B12R1.28 CSCNCc1cccc(n1)C 388c4a1188fa581f864d80ef7a12c605 [0,2,0,0,0,0|1,1,0]=4 5666 B12R1.28 CSCNCc1cccc(n1)Cl 722cdca9f1307b3f32769f86636d6634 [0,2,0,0,0,0|1,1,0]=4 5667 B12R1.28 CSCNCc1cccc(n1)F adaff31e11c6295a0b89a2b51e9b62c3 [0,2,0,0,0,0|1,1,0]=4 5668 B12R1.28 CSCNCc1ccnc(c1)Br 7166e2ee5a676b69ee662bca1f3b6be9 [0,2,0,0,0,0|1,1,0]=4 5669 B12R1.28 CSCNCc1ccnc(c1)C 8e2ff0c0fd98ce9c5c077d096d6798bf [0,2,0,0,0,0|1,1,0]=4 5670 B12R1.28 CSCNCc1ccnc(c1)Cl db6b006b82512996d0c0372408bc0b5a [0,2,0,0,0,0|1,1,0]=4 5671 B12R1.28 CSCNCc1ccnc(c1)F b043d44a835617af7caf945e6caa3626 [0,2,0,0,0,0|1,1,0]=4 5672 B12R1.28 CSCNCc1cncc(c1)C d65c906eee59b2c43f9fd1406fd19325 [0,2,0,0,0,0|1,1,0]=4 5673 B12R1.28 CSCNCc1cncc(c1)Cl eaca0a1eafe09427b9fc47619bdb7f4b [0,2,0,0,0,0|1,1,0]=4 5674 B12R1.28 CSCNCc1cncc(c1)F 063d4f259e0dc5827014ad454d8d537c [0,2,0,0,0,0|1,1,0]=4 5675 B12R1.28 CSCOCc1cc(ccn1)Br fb3cbe61f6dc9c1f7b68d37b98f1cbf8 [0,2,0,0,0,0|1,1,0]=4 5676 B12R1.28 CSCOCc1cc(ccn1)C c75a11467c2868303042597f1f82d8bb [0,2,0,0,0,0|1,1,0]=4 5677 B12R1.28 CSCOCc1cc(ccn1)Cl 8bbd23df78370483800f12408bd52e5b [0,2,0,0,0,0|1,1,0]=4 5678 B12R1.28 CSCOCc1cc(ccn1)F 26a0d1856be398e8c17f4deddef5cc3c [0,2,0,0,0,0|1,1,0]=4 5679 B12R1.28 CSCOCc1cc(ccn1)I 51198343be16bbd63479d559eeaa0ef2 [0,2,0,0,0,0|1,1,0]=4 5680 B12R1.28 CSCOCc1cc[nH]c(=O)c1 b64141e4b5c7d8baee0d4d67bcd4a4a8 [0,2,0,0,0,0|1,1,0]=4 5681 B12R1.28 CSCOCc1ccc[n+](c1)[O-] 101b58e495dd71888fe71b995137bba2 [0,2,0,0,0,0|1,1,0]=4 5682 B12R1.28 CSCOCc1cccc(c1)Br 09acea27bc86a74f70f0ecb6b1b36467 [0,2,0,0,0,0|0,1,0]=3 5683 B12R1.28 CSCOCc1cccc(c1)C b92fb5422a027ebfba59db2e4c7028a2 [0,2,0,0,0,0|0,1,0]=3 5684 B12R1.28 CSCOCc1cccc(c1)Cl 03ec11799dc23912722d9ec83bd2bc58 [0,2,0,0,0,0|0,1,0]=3 5685 B12R1.28 CSCOCc1cccc(c1)F 90ab928cefee5e8c1de1e196d6909a20 [0,2,0,0,0,0|0,1,0]=3 5686 B12R1.28 CSCOCc1cccc(c1)I 50057e553d005950b6faf0768541a1d9 [0,2,0,0,0,0|0,1,0]=3 5687 B12R1.28 CSCOCc1cccc(n1)Br 11671de6c59084fb78d91ac3dfc4a6b6 [0,2,0,0,0,0|1,1,0]=4 5688 B12R1.28 CSCOCc1cccc(n1)C 07c838f8457a3dba0190ae958e1dc32f [0,2,0,0,0,0|1,1,0]=4 5689 B12R1.28 CSCOCc1cccc(n1)Cl 659db1d5be790a46765ec37e935c4d7b [0,2,0,0,0,0|1,1,0]=4 5690 B12R1.28 CSCOCc1cccc(n1)F 93b2b939cd80c030e0243ec1b45220c2 [0,2,0,0,0,0|1,1,0]=4 5691 B12R1.28 CSCOCc1cccc(n1)I 4ced7832182a857c949f9a60f423bf53 [0,2,0,0,0,0|1,1,0]=4 5692 B12R1.28 CSCOCc1ccnc(c1)Br 6ea8f6b21360e0c5fb07487b1dbd4d82 [0,2,0,0,0,0|1,1,0]=4 5693 B12R1.28 CSCOCc1ccnc(c1)C a53baafd8c88b4149d16e70ea6178a82 [0,2,0,0,0,0|1,1,0]=4 5694 B12R1.28 CSCOCc1ccnc(c1)Cl 1f15e6491ce96b7f602570d84012a549 [0,2,0,0,0,0|1,1,0]=4 5695 B12R1.28 CSCOCc1ccnc(c1)F 0caaf7f9770ce7f62fc770737a437842 [0,2,0,0,0,0|1,1,0]=4 5696 B12R1.28 CSCOCc1cncc(c1)C 3756703bc8e6a28465bdedb2df867e73 [0,2,0,0,0,0|1,1,0]=4 5697 B12R1.28 CSCOCc1cncc(c1)Cl 7ae20008996b83399df032139683325e [0,2,0,0,0,0|1,1,0]=4 5698 B12R1.28 CSCOCc1cncc(c1)F 11dc54421782526c73c767495035ea42 [0,2,0,0,0,0|1,1,0]=4 5699 B12R1.28 CSCOCc1cncc(c1)I 73ba8beb504f95931fc5e7b192d78b21 [0,2,0,0,0,0|1,1,0]=4 5700 B12R1.28 Cc1cc(ccn1)CCNCF 6c459d1ae5f5879744f5dc7d57f141b7 [0,2,0,0,0,0|2,0,0]=4 5701 B12R1.28 Cc1cc(ccn1)CCNCO 4371a528970015919c6574fde45fa974 [0,2,0,0,0,0|2,0,0]=4 5702 B12R1.28 Cc1cc(ccn1)NCCON 697f3395fa9cc58945fb9c2da1c508f6 [0,2,0,0,0,0|2,0,0]=4 5703 B12R1.28 Cc1cccc(c1)CCNC#N c1d1275a5a489531465a38f42b82c752 [0,2,0,0,0,0|1,0,1]=4 5704 B12R1.28 Cc1cccc(c1)CCNC=O 8612d7f8913bad172a89faf2d9f6ab43 [0,2,0,0,0,0|1,0,1]=4 5705 B12R1.28 Cc1cccc(c1)CCNCF d55c688e9678c30b2351e4cbdd7450e3 [0,2,0,0,0,0|1,0,0]=3 5706 B12R1.28 Cc1cccc(c1)CCNCO 93a28a38a3a795fa33735682cc180d19 [0,2,0,0,0,0|1,0,0]=3 5707 B12R1.28 Cc1cccc(c1)CCOCF 51adc91e98de89cba91135d6bf1dd274 [0,2,0,0,0,0|0,0,0]=2 5708 B12R1.28 Cc1cccc(c1)CNCC#N f19e7f613a9352e14f08c7dab0cc18d1 [0,2,0,0,0,0|2,0,0]=4 5709 B12R1.28 Cc1cccc(c1)CNCC=O 3b622a3ea53ee48f7996848d6ab6af52 [0,2,0,0,0,0|2,0,0]=4 5710 B12R1.28 Cc1cccc(c1)CNCCBr 3d16c699f5a0003cb132db328a6a1f86 [0,2,0,0,0,0|2,0,0]=4 5711 B12R1.28 Cc1cccc(c1)CNCCF 17bd3c1f7a7258949baa12b282458bf4 [0,2,0,0,0,0|2,0,0]=4 5712 B12R1.28 Cc1cccc(c1)CNCCI 4c70aa23716d542f76ffcfdb09c9ba53 [0,2,0,0,0,0|2,0,0]=4 5713 B12R1.28 Cc1cccc(c1)CNCCO 8b0e4b8bd6a8c2f5f9d0a2d7f28d8116 [0,2,0,0,0,0|2,0,0]=4 5714 B12R1.28 Cc1cccc(c1)CNCCS 6a17b6589ee9d764e46bc98d6105f564 [0,2,0,0,0,0|2,0,0]=4 5715 B12R1.28 Cc1cccc(c1)COCC#N 39cdd18df24d8e97b3847419114b8a1e [0,2,0,0,0,0|2,0,0]=4 5716 B12R1.28 Cc1cccc(c1)COCC=O a84d033c0f31f81d9ffdca1b412df577 [0,2,0,0,0,0|2,0,0]=4 5717 B12R1.28 Cc1cccc(c1)COCCF 282634da35f199c5d636161a62066198 [0,2,0,0,0,0|2,0,0]=4 5718 B12R1.28 Cc1cccc(c1)COCCS 43a82caf41cdb6cc66e5768facfe490a [0,2,0,0,0,0|2,0,0]=4 5719 B12R1.28 Cc1cccc(c1)NCCC#N 0b3d5772df0cf32c672d1cd7467363d0 [0,2,0,0,0,0|2,0,0]=4 5720 B12R1.28 Cc1cccc(c1)NCCC=O 7c67d7c3bf34b1b10fc1868f03e66b4a [0,2,0,0,0,0|2,0,0]=4 5721 B12R1.28 Cc1cccc(c1)NCCCCl 0c66be29c2ddbeb41e45314daca52e55 [0,2,0,0,0,0|2,0,0]=4 5722 B12R1.28 Cc1cccc(c1)NCCCF e35a42dec1b1763b35d2ce4706c75e8c [0,2,0,0,0,0|2,0,0]=4 5723 B12R1.28 Cc1cccc(c1)NCCCO 6331c0265cdcc1d7fe5e30a546d60d68 [0,2,0,0,0,0|2,0,0]=4 5724 B12R1.28 Cc1cccc(c1)NCCCS 39f4ada09e3aebd3aff579c9d0309860 [0,2,0,0,0,0|2,0,0]=4 5725 B12R1.28 Cc1cccc(c1)NCCON ab68f3976ed9dd578e7533c66a080ffc [0,2,0,0,0,0|1,0,0]=3 5726 B12R1.28 Cc1cccc(c1)OCCC#N 5eaf642c6bbb5b7507224caa93be9539 [0,2,0,0,0,0|2,0,0]=4 5727 B12R1.28 Cc1cccc(c1)OCCC=O 2b8229ed2e66fbd99decd535ce708982 [0,2,0,0,0,0|2,0,0]=4 5728 B12R1.28 Cc1cccc(c1)OCCCF 392809c7bd11ebb7313f38ee4c726962 [0,2,0,0,0,0|2,0,0]=4 5729 B12R1.28 Cc1cccc(c1)OCCCS a9b7aad0970a3fec06a2e6b91591e562 [0,2,0,0,0,0|2,0,0]=4 5730 B12R1.28 Cc1cccc(n1)CCNCF 7e60ec7089ffd5716237ba7ea9cbdca5 [0,2,0,0,0,0|2,0,0]=4 5731 B12R1.28 Cc1cccc(n1)CCNCO ebc11abdc23f379c9b961aa9e165e2f5 [0,2,0,0,0,0|2,0,0]=4 5732 B12R1.28 Cc1cccc(n1)CCOCF 7fdaafd85f6a28954b123ffbfa1a3c95 [0,2,0,0,0,0|1,0,0]=3 5733 B12R1.28 Cc1cccc(n1)NCCON ebbb2fca0268094cf4e4909fde01cad0 [0,2,0,0,0,0|2,0,0]=4 5734 B12R1.28 Cc1ccnc(c1)NCCON 93d834e18d17da7dc6cc81b756f859f0 [0,2,0,0,0,0|2,0,0]=4 5735 B12R1.28 Cc1cncc(c1)NCCON 7e14a7046017fdce2c4a77789ddd87ba [0,2,0,0,0,0|2,0,0]=4 5736 B12R1.28 Clc1cccc(c1)CNCCBr 5cc9fe9b89061896b3b402fdf9473d72 [0,2,0,0,0,0|2,0,0]=4 5737 B12R1.28 Clc1cccc(c1)CNCCI b60e7441994a47c87a4bce06f1ff481f [0,2,0,0,0,0|2,0,0]=4 5738 B12R1.28 FCCCNc1cccc(c1)Br a5e779c5a6e01a7940ef45e25ab8ffe5 [0,2,0,0,0,0|2,0,0]=4 5739 B12R1.28 FCCCNc1cccc(c1)Cl 2e2f7a49672e6223a274afd34e56ccd6 [0,2,0,0,0,0|2,0,0]=4 5740 B12R1.28 FCCCNc1cccc(c1)F 884148387af44d3273857fac2d94011a [0,2,0,0,0,0|2,0,0]=4 5741 B12R1.28 FCCCNc1cccc(c1)I 05facb2243fe352417590e09ec3f00ae [0,2,0,0,0,0|2,0,0]=4 5742 B12R1.28 FCCCNc1cccc(c1)S 9d9097c240ebf472387e6a66e727366f [0,2,0,0,0,0|2,0,0]=4 5743 B12R1.28 FCCCOc1cccc(c1)Br f93da663360a7fce01815877b2ea7f4c [0,2,0,0,0,0|2,0,0]=4 5744 B12R1.28 FCCCOc1cccc(c1)Cl 9f9989d3848ba74e066cf951a1173a5f [0,2,0,0,0,0|2,0,0]=4 5745 B12R1.28 FCCCOc1cccc(c1)F b1ad24f8520f67d0652853b88fb39a17 [0,2,0,0,0,0|2,0,0]=4 5746 B12R1.28 FCCCOc1cccc(c1)I 6c9f8788789d6b83d54430480d289a2c [0,2,0,0,0,0|2,0,0]=4 5747 B12R1.28 FCCCOc1cccc(c1)S ca68aa5dd7281fae8def9ff54c271d26 [0,2,0,0,0,0|2,0,0]=4 5748 B12R1.28 FCCNCc1cccc(c1)Br a3f22b0af0f3c7a2fbd6499b3ebe667b [0,2,0,0,0,0|2,0,0]=4 5749 B12R1.28 FCCNCc1cccc(c1)Cl f15db2fa73a775f1ae5fbfc63c655621 [0,2,0,0,0,0|2,0,0]=4 5750 B12R1.28 FCCNCc1cccc(c1)F 0047a9122fdddadabcda076ea5ec82d2 [0,2,0,0,0,0|2,0,0]=4 5751 B12R1.28 FCCNCc1cccc(c1)I 838a45c5d193552ef6deb99293726a1d [0,2,0,0,0,0|2,0,0]=4 5752 B12R1.28 FCCOCc1cccc(c1)Br 132f95e9b8e1e151e4d44f1ee2326667 [0,2,0,0,0,0|2,0,0]=4 5753 B12R1.28 FCCOCc1cccc(c1)Cl f6dced709428e91168328d103e0ea18c [0,2,0,0,0,0|2,0,0]=4 5754 B12R1.28 FCCOCc1cccc(c1)F f562d08b05eaa436a5cc3c15d63d906e [0,2,0,0,0,0|2,0,0]=4 5755 B12R1.28 FCCOCc1cccc(c1)I 2c636c0a42a80a0fdaf46f0fd79e6db4 [0,2,0,0,0,0|2,0,0]=4 5756 B12R1.28 FCNCCc1cccc(c1)Br 63f95ad9afdafac9c0c58398008d9140 [0,2,0,0,0,0|1,0,0]=3 5757 B12R1.28 FCNCCc1cccc(c1)Cl 1a5022cf19c45426af5ea2234f529088 [0,2,0,0,0,0|1,0,0]=3 5758 B12R1.28 FCNCCc1cccc(c1)F 7803834c60c721df84b912fcbd31c5e3 [0,2,0,0,0,0|1,0,0]=3 5759 B12R1.28 FCNCCc1cccc(c1)I 9ad8ab4dfb25921bc02195f41c6a88d6 [0,2,0,0,0,0|1,0,0]=3 5760 B12R1.28 FCNCCc1cncc(c1)F 1cd018708abefeebf05e07d9ab1e8775 [0,2,0,0,0,0|2,0,0]=4 5761 B12R1.28 FCOCCc1cc(ccn1)Br 1d67ca73e80c287972ef70c072527093 [0,2,0,0,0,0|1,0,0]=3 5762 B12R1.28 FCOCCc1cccc(c1)Br 4ceda77946fa660e1bde11b804bc61bf [0,2,0,0,0,0|0,0,0]=2 5763 B12R1.28 FCOCCc1cccc(c1)Cl c3312cd6c6d4529fd33e4cdbb4ad83ea [0,2,0,0,0,0|0,0,0]=2 5764 B12R1.28 FCOCCc1cccc(c1)F 3aed3878adb707025955cb0be47782c7 [0,2,0,0,0,0|0,0,0]=2 5765 B12R1.28 FCOCCc1cccc(c1)I 555c4e52e5544fe1560ead1fd2baaa04 [0,2,0,0,0,0|0,0,0]=2 5766 B12R1.28 FCOCCc1cccc(n1)Br 9e2f58cfecc65f95e9eb8abf0ac88104 [0,2,0,0,0,0|1,0,0]=3 5767 B12R1.28 FCOCCc1cccc(n1)Cl 7a6d4f4f18125d0fb13ee8adef0de2ed [0,2,0,0,0,0|1,0,0]=3 5768 B12R1.28 FCOCCc1ccnc(c1)Cl 683fb80f0855177002d002b9fe5ee299 [0,2,0,0,0,0|1,0,0]=3 5769 B12R1.28 FCOCCc1cncc(c1)F d791c97a5a61c43b2cf809f073f53838 [0,2,0,0,0,0|1,0,0]=3 5770 B12R1.28 FCOCCc1cncc(n1)Cl 6c2f5d405876b3263d3c1624ce82106d [0,2,0,0,0,0|2,0,0]=4 5771 B12R1.28 Fc1cccc(c1)CNCCBr 506f094ea498024ae966b9d0ba6e14d4 [0,2,0,0,0,0|2,0,0]=4 5772 B12R1.28 Fc1cccc(c1)CNCCI d38c7b33aa5d62a638e183f4f4b82dbf [0,2,0,0,0,0|2,0,0]=4 5773 B12R1.28 Fc1cccc(c1)CNCCS a1f94b181fc0aabeee5680bbd229fcdc [0,2,0,0,0,0|2,0,0]=4 5774 B12R1.28 Fc1cccc(c1)COCCS 8abc65e02dcbf52f4ceee62118cddb07 [0,2,0,0,0,0|2,0,0]=4 5775 B12R1.28 Fc1cccc(c1)NCCCCl 094531d9b3eb8d8a70db119eaf87882b [0,2,0,0,0,0|2,0,0]=4 5776 B12R1.28 Fc1cccc(c1)NCCCS 199ff1ce92a3f647a23e1c1609c39884 [0,2,0,0,0,0|2,0,0]=4 5777 B12R1.28 Fc1cccc(c1)OCCCS 3ff5801d65a6ed1a4402137e97b0da73 [0,2,0,0,0,0|2,0,0]=4 5778 B12R1.28 ICCNCc1cccc(c1)I 84cafd462cbe5b29022c0af33af91f01 [0,2,0,0,0,0|2,0,0]=4 5779 B12R1.28 N#CCCNc1cccc(c1)Br 2b39080b86d4ba190d49381a5bb70ca6 [0,2,0,0,0,0|2,0,0]=4 5780 B12R1.28 N#CCCNc1cccc(c1)Cl c52658b4775ea7a92dff23b220abd75b [0,2,0,0,0,0|2,0,0]=4 5781 B12R1.28 N#CCCNc1cccc(c1)F 83d344b00acb8e101631212a33bf7fd4 [0,2,0,0,0,0|2,0,0]=4 5782 B12R1.28 N#CCCNc1cccc(c1)I e29c12054163ee2ae4b1ff4e16a46797 [0,2,0,0,0,0|2,0,0]=4 5783 B12R1.28 N#CCCNc1cccc(c1)S 18790b0c0aad13937cfbf3e98cb77a0c [0,2,0,0,0,0|2,0,0]=4 5784 B12R1.28 N#CCCOc1cccc(c1)Br 9dca7f86f66d918eb9e716ccbba769e4 [0,2,0,0,0,0|2,0,0]=4 5785 B12R1.28 N#CCCOc1cccc(c1)Cl 52d43a3762e01501bce90a345efe6c4d [0,2,0,0,0,0|2,0,0]=4 5786 B12R1.28 N#CCCOc1cccc(c1)F 215e1d8922003283b10c2205f67ce9f8 [0,2,0,0,0,0|2,0,0]=4 5787 B12R1.28 N#CCCOc1cccc(c1)I 97bd074d327e4842369c879c0acf2fee [0,2,0,0,0,0|2,0,0]=4 5788 B12R1.28 N#CCCOc1cccc(c1)S 17b2e3c71864beb3ec52a77a6d6b2aa2 [0,2,0,0,0,0|2,0,0]=4 5789 B12R1.28 N#CCNCc1cccc(c1)Br 879d2922403e1782ed45c331a89d3886 [0,2,0,0,0,0|2,0,0]=4 5790 B12R1.28 N#CCNCc1cccc(c1)Cl a58c2269647f4fefdffb9321719e5127 [0,2,0,0,0,0|2,0,0]=4 5791 B12R1.28 N#CCNCc1cccc(c1)F 56edcd4e0be78e73a041a16c5bad7b6e [0,2,0,0,0,0|2,0,0]=4 5792 B12R1.28 N#CCNCc1cccc(c1)I 3a3e976cc7243b807688ff31d0bc2dc1 [0,2,0,0,0,0|2,0,0]=4 5793 B12R1.28 N#CCOCc1cccc(c1)Br 88f95e5f5fbed1bf64ebb19ef84f835d [0,2,0,0,0,0|2,0,0]=4 5794 B12R1.28 N#CCOCc1cccc(c1)Cl 7700a6c5dd947a985b1594e143459ada [0,2,0,0,0,0|2,0,0]=4 5795 B12R1.28 N#CCOCc1cccc(c1)F 4f4ef263fbd70f4b9f6d9a22fe65760d [0,2,0,0,0,0|2,0,0]=4 5796 B12R1.28 N#CCOCc1cccc(c1)I ee900fe486c7dc42154b9ad8cf9528e1 [0,2,0,0,0,0|2,0,0]=4 5797 B12R1.28 N#CNCCc1cccc(c1)Br f6e612d0d9943970d6ce083ec1a487a9 [0,2,0,0,0,0|1,0,1]=4 5798 B12R1.28 N#CNCCc1cccc(c1)Cl baf9527724387139669f927602c8f532 [0,2,0,0,0,0|1,0,1]=4 5799 B12R1.28 N#CNCCc1cccc(c1)F 7ce7afac94ec11203951698d20b5fd9e [0,2,0,0,0,0|1,0,1]=4 5800 B12R1.28 NOCCNc1cc(ccn1)F 2b95d7cadab69555c0b11009e29c218b [0,2,0,0,0,0|2,0,0]=4 5801 B12R1.28 NOCCNc1cc(ccn1)O df9f10fba9de1de7ed36ba5253825ad2 [0,2,0,0,0,0|2,0,0]=4 5802 B12R1.28 NOCCNc1cc[nH]c(=O)c1 d3899ee2254b280c430c5712a0047a4f [0,2,0,0,0,0|2,0,0]=4 5803 B12R1.28 NOCCNc1ccc[n+](c1)[O-] fc7fdf20a832ea55e4ea38a1edada716 [0,2,0,0,0,0|2,0,0]=4 5804 B12R1.28 NOCCNc1cccc(=O)[nH]1 fbc46f645869b90ae4dc3a45e85f1246 [0,2,0,0,0,0|2,0,0]=4 5805 B12R1.28 NOCCNc1cccc(c1)F 9a5f4dd9237be9a87b6738f0c2397fd5 [0,2,0,0,0,0|1,0,0]=3 5806 B12R1.28 NOCCNc1cccc(c1)O bec84eb16af067f8a8a72737ac43b7ce [0,2,0,0,0,0|1,0,0]=3 5807 B12R1.28 NOCCNc1cccc(c1)S 0eadd2bb23a4b8b41ae2c23bb73221e6 [0,2,0,0,0,0|1,0,0]=3 5808 B12R1.28 NOCCNc1cccc(n1)F af562833e35f92d87e05f342a37d7b7a [0,2,0,0,0,0|2,0,0]=4 5809 B12R1.28 NOCCNc1ccnc(c1)F d18b9efbc088db82f9d46233ba06b812 [0,2,0,0,0,0|2,0,0]=4 5810 B12R1.28 NOCCNc1cncc(c1)F 14ab871922564bc417e06c85d8646310 [0,2,0,0,0,0|2,0,0]=4 5811 B12R1.28 NOCCNc1cncc(c1)O 01b5598743679203f9cf5a0a10d05614 [0,2,0,0,0,0|2,0,0]=4 5812 B12R1.28 O=CCCNc1cccc(c1)Br 8fbd2ec05e101aedb8eda3334b210049 [0,2,0,0,0,0|2,0,0]=4 5813 B12R1.28 O=CCCNc1cccc(c1)Cl 69c07bf3341c3fc872e468241b5742b7 [0,2,0,0,0,0|2,0,0]=4 5814 B12R1.28 O=CCCNc1cccc(c1)F f2b6f3766f268c3a60c3962e14c5bf3e [0,2,0,0,0,0|2,0,0]=4 5815 B12R1.28 O=CCCNc1cccc(c1)I 8448a7b603a7d40f159d40cc6b788826 [0,2,0,0,0,0|2,0,0]=4 5816 B12R1.28 O=CCCNc1cccc(c1)S 4df843387033e4dd01afdd6aa060a14e [0,2,0,0,0,0|2,0,0]=4 5817 B12R1.28 O=CCCOc1cccc(c1)Br 9bc28d28318a07962b975efd987df531 [0,2,0,0,0,0|2,0,0]=4 5818 B12R1.28 O=CCCOc1cccc(c1)Cl 48a21f948630697c9e81dd7d10a65d25 [0,2,0,0,0,0|2,0,0]=4 5819 B12R1.28 O=CCCOc1cccc(c1)F c871482171b370f790f5718b38007f32 [0,2,0,0,0,0|2,0,0]=4 5820 B12R1.28 O=CCCOc1cccc(c1)I 7f5ca1a3069ab6361e6f3a20ee172683 [0,2,0,0,0,0|2,0,0]=4 5821 B12R1.28 O=CCCOc1cccc(c1)S 64ef8b90a275d22fd358e5e768c45de4 [0,2,0,0,0,0|2,0,0]=4 5822 B12R1.28 O=CCNCc1cccc(c1)Br e0e2ddb37b8621f608eeece3d65ef949 [0,2,0,0,0,0|2,0,0]=4 5823 B12R1.28 O=CCNCc1cccc(c1)Cl 9636f0e9280a051f18b5b13d4ddc2059 [0,2,0,0,0,0|2,0,0]=4 5824 B12R1.28 O=CCNCc1cccc(c1)F 7f0ff82acc95a4829005987346c95f4c [0,2,0,0,0,0|2,0,0]=4 5825 B12R1.28 O=CCNCc1cccc(c1)I cb0cb9fd73bd72c81635c2fa60fd4f54 [0,2,0,0,0,0|2,0,0]=4 5826 B12R1.28 O=CCOCc1cccc(c1)Br 957a3191ce4c923e262fda75cb5ada64 [0,2,0,0,0,0|2,0,0]=4 5827 B12R1.28 O=CCOCc1cccc(c1)Cl 520d92abc13bd13f704a57c5f9eb6295 [0,2,0,0,0,0|2,0,0]=4 5828 B12R1.28 O=CCOCc1cccc(c1)F efd067383b692f41aae9e3ecabed2d6d [0,2,0,0,0,0|2,0,0]=4 5829 B12R1.28 O=CCOCc1cccc(c1)I fda2f44c6254b5be22bdef6cb20aee28 [0,2,0,0,0,0|2,0,0]=4 5830 B12R1.28 O=CNCCc1cccc(c1)Br eefcf700003f9cd109d13836e54f277d [0,2,0,0,0,0|1,0,1]=4 5831 B12R1.28 O=CNCCc1cccc(c1)Cl d4c88b189d7027c20056157eb1525ba4 [0,2,0,0,0,0|1,0,1]=4 5832 B12R1.28 O=CNCCc1cccc(c1)F d22bcc2e6c7014d8034482be1e2e158e [0,2,0,0,0,0|1,0,1]=4 5833 B12R1.28 O=CNCCc1cccc(c1)I 9c45a634df681e333c31a7eeca3a62c8 [0,2,0,0,0,0|1,0,1]=4 5834 B12R1.28 O=CNCCc1cccc(c1)O 1ff03f4f09dd5b246a6e6c59eef84eaa [0,2,0,0,0,0|1,0,1]=4 5835 B12R1.28 OCCCNc1cccc(c1)Br cf69fbba1731c7b7b182d73471a01be4 [0,2,0,0,0,0|2,0,0]=4 5836 B12R1.28 OCCCNc1cccc(c1)Cl 88f10fbe375978effa6eebb8a9188619 [0,2,0,0,0,0|2,0,0]=4 5837 B12R1.28 OCCCNc1cccc(c1)F b882697ea65ee7871f3124f2dd496ace [0,2,0,0,0,0|2,0,0]=4 5838 B12R1.28 OCCCNc1cccc(c1)I 78c4085590617010aec0ba4d6ba6f2fe [0,2,0,0,0,0|2,0,0]=4 5839 B12R1.28 OCCCNc1cccc(c1)O b8a1a453f36dea395f53aa0824bf7c84 [0,2,0,0,0,0|2,0,0]=4 5840 B12R1.28 OCCCNc1cccc(c1)S 9ca3bc3286df08cfa7f628c8e1f2aead [0,2,0,0,0,0|2,0,0]=4 5841 B12R1.28 OCCNCc1cccc(c1)Br 269adac2794c703a867a6cdfbdcc4b31 [0,2,0,0,0,0|2,0,0]=4 5842 B12R1.28 OCCNCc1cccc(c1)Cl 12da828289841255f4989b01d4fb368f [0,2,0,0,0,0|2,0,0]=4 5843 B12R1.28 OCCNCc1cccc(c1)F 4b3f9f0d35d39d22594c2266a910e961 [0,2,0,0,0,0|2,0,0]=4 5844 B12R1.28 OCCNCc1cccc(c1)I dabfb0966332881d2eb3473e30b644ce [0,2,0,0,0,0|2,0,0]=4 5845 B12R1.28 OCNCCc1cccc(c1)Br 3aa38b14d893ea561c6d7be0b882b46e [0,2,0,0,0,0|1,0,0]=3 5846 B12R1.28 OCNCCc1cccc(c1)Cl 10611e4fe6f0ad3695177e63a8cf825e [0,2,0,0,0,0|1,0,0]=3 5847 B12R1.28 OCNCCc1cccc(c1)F 88d3334a709a0b42373bc0c7574dca21 [0,2,0,0,0,0|1,0,0]=3 5848 B12R1.28 OCNCCc1cccc(c1)I 5daf6c5becb322704670a9c1193bd5a3 [0,2,0,0,0,0|1,0,0]=3 5849 B12R1.28 OCNCCc1cncc(c1)F 9a3d41db8a8ffbc99cdca618b1680d94 [0,2,0,0,0,0|2,0,0]=4 5850 B12R1.28 Oc1cccc(c1)NCCCCl de7bfd3663d7e43e0e8f79d6f6f663e8 [0,2,0,0,0,0|2,0,0]=4 5851 B12R1.28 SCCCNc1cccc(c1)Br c5e5a6c29e3438dcb4f6f117c29a1f87 [0,2,0,0,0,0|2,0,0]=4 5852 B12R1.28 SCCCNc1cccc(c1)Cl 7dab5b443edf014f6c5d4a44b2c4ad2a [0,2,0,0,0,0|2,0,0]=4 5853 B12R1.28 SCCCNc1cccc(c1)I 32f6a0335d0e29c8e60b8e6e6b1a46f1 [0,2,0,0,0,0|2,0,0]=4 5854 B12R1.28 SCCCNc1cccc(c1)S 13d71a201fce4434d9fb9f873530dfbe [0,2,0,0,0,0|2,0,0]=4 5855 B12R1.28 SCCCOc1cccc(c1)Br 694c125cbc9b74e234f907bad21e1476 [0,2,0,0,0,0|2,0,0]=4 5856 B12R1.28 SCCCOc1cccc(c1)Cl a659b4da7bb502926693b2463441ff4a [0,2,0,0,0,0|2,0,0]=4 5857 B12R1.28 SCCCOc1cccc(c1)I 77d5bac49fc2e792054051cdea34586a [0,2,0,0,0,0|2,0,0]=4 5858 B12R1.28 SCCCOc1cccc(c1)S 69671bc5e424420434e35c35bf3a6fd8 [0,2,0,0,0,0|2,0,0]=4 5859 B12R1.28 SCCNCc1cccc(c1)Br 5d070a08d4470619e09054ab75a69b02 [0,2,0,0,0,0|2,0,0]=4 5860 B12R1.28 SCCNCc1cccc(c1)Cl fd44b9b3de5f995549bdbe5c45044b5f [0,2,0,0,0,0|2,0,0]=4 5861 B12R1.28 SCCNCc1cccc(c1)I e10eb4f1f6db83bad36826b20d276fa9 [0,2,0,0,0,0|2,0,0]=4 5862 B12R1.28 SCCOCc1cccc(c1)Br 9b0f7e02614b195ce19dbc655b74e8c2 [0,2,0,0,0,0|2,0,0]=4 5863 B12R1.28 SCCOCc1cccc(c1)Cl 3aaede370ad1f6069eaafb0c682e2011 [0,2,0,0,0,0|2,0,0]=4 5864 B12R1.28 SCCOCc1cccc(c1)I 5eeb99910ed72a196d67ee1e0e492959 [0,2,0,0,0,0|2,0,0]=4 5865 B12R1.28 Sc1cccc(c1)NCCCCl 00ff4909bf6ffa253d373787b90982d4 [0,2,0,0,0,0|2,0,0]=4 5866 B12R1.50 CCC(C)Nc1cccc(c1)Br 1d66578ce06ff9734ac9091e085e6a07 [0,2,0,0,0,0|2,0,0]=4 5867 B12R1.50 CCC(C)Nc1cccc(c1)C d7cf6e3b62030f874de6f1eb9d16cf4f [0,2,0,0,0,0|2,0,0]=4 5868 B12R1.50 CCC(C)Nc1cccc(c1)Cl 08bdcd143bf3141bf35886f1a7a48241 [0,2,0,0,0,0|2,0,0]=4 5869 B12R1.50 CCC(C)Nc1cccc(c1)F abc1ee7f668b8358dc6ca8fd4a50a6d5 [0,2,0,0,0,0|2,0,0]=4 5870 B12R1.50 CCC(C)Nc1cccc(c1)I bc6d04f9805b80597b81c6888c542900 [0,2,0,0,0,0|2,0,0]=4 5871 B12R1.50 CCC(C)Nc1cccc(c1)S 2cd18a9ced79be6a90be5bf41232bef9 [0,2,0,0,0,0|2,0,0]=4 5872 B12R1.50 CCC(C)Oc1cccc(c1)Br 11f5b596601cd571c59ff2afebc8ce7a [0,2,0,0,0,0|2,0,0]=4 5873 B12R1.50 CCC(C)Oc1cccc(c1)C 9cbbc47209d16c8e877df0d39e5bcab2 [0,2,0,0,0,0|2,0,0]=4 5874 B12R1.50 CCC(C)Oc1cccc(c1)Cl 3dfa34a86dfbb1225b2fc77d38aaa045 [0,2,0,0,0,0|2,0,0]=4 5875 B12R1.50 CCC(C)Oc1cccc(c1)F 11c1cebedbe6e61c8d433bebe0c72b96 [0,2,0,0,0,0|2,0,0]=4 5876 B12R1.50 CCC(C)Oc1cccc(c1)I 7ed5e0b105802053e06ca681572fa199 [0,2,0,0,0,0|2,0,0]=4 5877 B12R1.50 CCC(C)Oc1cccc(c1)S 4218a788a21d0fc160d2648a272c1309 [0,2,0,0,0,0|2,0,0]=4 5878 B12R1.50 CCN(C)Cc1cccc(c1)Br 0cfb611857c5cb7cc30f39c3873140b0 [0,2,0,0,0,0|2,0,0]=4 5879 B12R1.50 CCN(C)Cc1cccc(c1)C 53ad3a118e4ee122b8b7018696871a03 [0,2,0,0,0,0|2,0,0]=4 5880 B12R1.50 CCN(C)Cc1cccc(c1)Cl e6a716bb03372171d841e30f8f33fb19 [0,2,0,0,0,0|2,0,0]=4 5881 B12R1.50 CCN(C)Cc1cccc(c1)F f82e676ee923805ac44e861b9bf86187 [0,2,0,0,0,0|2,0,0]=4 5882 B12R1.50 CCN(C)Cc1cccc(c1)I e43924ee04038b2970f0d94ad73ebdd0 [0,2,0,0,0,0|2,0,0]=4 5883 B12R1.50 CC[C@@H](C)Nc1cccc(c1)C 45d939f81c7b7d38cc39ca453cc6d8b9 [0,2,0,0,0,0|2,0,0]=4 5884 B12R1.50 CC[C@H](C)Nc1cccc(c1)C 5181036d0ad680b57bb138220216ae0c [0,2,0,0,0,0|2,0,0]=4 5885 B12R1.100 CCCNc1cc(cc(c1)Br)Br 04ffd172ce38774d6bdadd5b6d29b581 [0,2,0,0,0,0|2,0,0]=4 5886 B12R1.100 CCCNc1cc(cc(c1)Br)C 04dab09ca4c3e308e1067188395e8c4e [0,2,0,0,0,0|2,0,0]=4 5887 B12R1.100 CCCNc1cc(cc(c1)Br)Cl 67f0c7e94d3f650cef72b70b7258cab3 [0,2,0,0,0,0|2,0,0]=4 5888 B12R1.100 CCCNc1cc(cc(c1)Br)F daf7408b5535aa80c58eab99dcfa46d0 [0,2,0,0,0,0|2,0,0]=4 5889 B12R1.100 CCCNc1cc(cc(c1)C)C 1fe2c852be043d834883fd91d1697918 [0,2,0,0,0,0|2,0,0]=4 5890 B12R1.100 CCCNc1cc(cc(c1)Cl)C a92562a5c296ad462a3f553259287ec4 [0,2,0,0,0,0|2,0,0]=4 5891 B12R1.100 CCCNc1cc(cc(c1)Cl)Cl 602cb0699dcbddb8031059a7679bef8c [0,2,0,0,0,0|2,0,0]=4 5892 B12R1.100 CCCNc1cc(cc(c1)Cl)F ef26ea131d87df22eb8c5d6647486b4f [0,2,0,0,0,0|2,0,0]=4 5893 B12R1.100 CCCNc1cc(cc(c1)F)C 0c81ed2559673e164ddf34a06ca0db2b [0,2,0,0,0,0|2,0,0]=4 5894 B12R1.100 CCCNc1cc(cc(c1)F)F cd77b43574e3ee91b6aca770a8630233 [0,2,0,0,0,0|2,0,0]=4 5895 B12R1.100 CCCNc1cc(cc(c1)I)Br 1b77d8d6ce1ae34fd7f3cffffeed1785 [0,2,0,0,0,0|2,0,0]=4 5896 B12R1.100 CCCNc1cc(cc(c1)I)C ba1431da73e99f43206ddde0f84e8354 [0,2,0,0,0,0|2,0,0]=4 5897 B12R1.100 CCCNc1cc(cc(c1)I)Cl 7df42e1919cde1e3e020f97bb9617289 [0,2,0,0,0,0|2,0,0]=4 5898 B12R1.100 CCCNc1cc(cc(c1)I)F fb6ba4a6ffd11a0695ffd2fe0c963029 [0,2,0,0,0,0|2,0,0]=4 5899 B12R1.100 CCCNc1cc(cc(c1)I)I fc9cd2cec022ebd024446d3796757ba6 [0,2,0,0,0,0|2,0,0]=4 5900 B12R1.100 CCCNc1cc(cc(c1)S)F aedde32b77d7ef57a08fdf1112685f5b [0,2,0,0,0,0|2,0,0]=4 5901 B12R1.100 CCCOc1cc(cc(c1)Br)Br 863e83c62c2f8f7986d9fa0f361733eb [0,2,0,0,0,0|2,0,0]=4 5902 B12R1.100 CCCOc1cc(cc(c1)Br)C 2903e9f96f84f419dfd033ffca547c1c [0,2,0,0,0,0|2,0,0]=4 5903 B12R1.100 CCCOc1cc(cc(c1)Br)Cl 3649f5614ffc6c8d21a9329354eb494a [0,2,0,0,0,0|2,0,0]=4 5904 B12R1.100 CCCOc1cc(cc(c1)Br)F 4e01128c4ac526000ae6efc3af0a806f [0,2,0,0,0,0|2,0,0]=4 5905 B12R1.100 CCCOc1cc(cc(c1)C)C 134add496cb9c337d3a40fb8121a4488 [0,2,0,0,0,0|2,0,0]=4 5906 B12R1.100 CCCOc1cc(cc(c1)Cl)C 2e7ebe7964c148149ca5148f123b8956 [0,2,0,0,0,0|2,0,0]=4 5907 B12R1.100 CCCOc1cc(cc(c1)Cl)Cl f86cfe1b94d33b32a8975183a728d95a [0,2,0,0,0,0|2,0,0]=4 5908 B12R1.100 CCCOc1cc(cc(c1)Cl)F af07993dee062fcccb43a2f22555f783 [0,2,0,0,0,0|2,0,0]=4 5909 B12R1.100 CCCOc1cc(cc(c1)F)C 374b08781a5e1cb24854fd3bc0d1b6af [0,2,0,0,0,0|2,0,0]=4 5910 B12R1.100 CCCOc1cc(cc(c1)F)F 8795b0a38109c02dc49af00912040b00 [0,2,0,0,0,0|2,0,0]=4 5911 B12R1.100 CCCOc1cc(cc(c1)I)Br c4359c07b07267dde11907a2db44558f [0,2,0,0,0,0|2,0,0]=4 5912 B12R1.100 CCCOc1cc(cc(c1)I)C 7ca9d693223a2f91815c373955ef3739 [0,2,0,0,0,0|2,0,0]=4 5913 B12R1.100 CCCOc1cc(cc(c1)I)Cl 5d790671d58d00e5a954196ba9bfc690 [0,2,0,0,0,0|2,0,0]=4 5914 B12R1.100 CCCOc1cc(cc(c1)I)F be64c05866ef923a0e213fbcf42bdf56 [0,2,0,0,0,0|2,0,0]=4 5915 B12R1.100 CCNCc1cc(cc(c1)Br)Br 6b348b727fc72aae052ad83343aa1584 [0,2,0,0,0,0|2,0,0]=4 5916 B12R1.100 CCNCc1cc(cc(c1)Br)C 642a721aca05c20e139770b89150792c [0,2,0,0,0,0|2,0,0]=4 5917 B12R1.100 CCNCc1cc(cc(c1)Br)Cl df31e6140ad5cf1ffa8d9b10efcaf13b [0,2,0,0,0,0|2,0,0]=4 5918 B12R1.100 CCNCc1cc(cc(c1)Br)F 76c42562a71200fc821d0ecbf2e7620e [0,2,0,0,0,0|2,0,0]=4 5919 B12R1.100 CCNCc1cc(cc(c1)C)C 1b4b6106416b3fe5470c41cb0b87dae2 [0,2,0,0,0,0|2,0,0]=4 5920 B12R1.100 CCNCc1cc(cc(c1)Cl)C 10b24f0f962b22d37dac720a931411e2 [0,2,0,0,0,0|2,0,0]=4 5921 B12R1.100 CCNCc1cc(cc(c1)Cl)Cl 1d0da723067a8afc95d2814ea5311a6c [0,2,0,0,0,0|2,0,0]=4 5922 B12R1.100 CCNCc1cc(cc(c1)Cl)F da21231daec75047d11f2da85baff5dc [0,2,0,0,0,0|2,0,0]=4 5923 B12R1.100 CCNCc1cc(cc(c1)F)C 62e77066dff655349908ea6c5bff8351 [0,2,0,0,0,0|2,0,0]=4 5924 B12R1.100 CCNCc1cc(cc(c1)F)F 5d364f70ad78bd6d8ffc81399bcdb55c [0,2,0,0,0,0|2,0,0]=4 5925 B12R1.100 CCOCc1cc(cc(c1)Br)Br 1f5ecfd0f2ad6f316450ebae07754e14 [0,2,0,0,0,0|2,0,0]=4 5926 B12R1.100 CCOCc1cc(cc(c1)Br)C 01f5f56b538ea7bc2d477c1d711d0c9d [0,2,0,0,0,0|2,0,0]=4 5927 B12R1.100 CCOCc1cc(cc(c1)Br)Cl 19e3564b821f26ed4fc08f1f889a9e38 [0,2,0,0,0,0|2,0,0]=4 5928 B12R1.100 CCOCc1cc(cc(c1)Br)F 7d03fa5d75a8a575ac4a1413274fe633 [0,2,0,0,0,0|2,0,0]=4 5929 B12R1.100 CCOCc1cc(cc(c1)C)C c48435aacec65995984bddb5b48de10b [0,2,0,0,0,0|2,0,0]=4 5930 B12R1.100 CCOCc1cc(cc(c1)Cl)C f4329fdded9bcaec588b4fd25937dd83 [0,2,0,0,0,0|2,0,0]=4 5931 B12R1.100 CCOCc1cc(cc(c1)Cl)Cl add5612dc24387378182d9c18ac31630 [0,2,0,0,0,0|2,0,0]=4 5932 B12R1.100 CCOCc1cc(cc(c1)Cl)F 4ba7f732a9b04ade87875d4f054866ce [0,2,0,0,0,0|2,0,0]=4 5933 B12R1.100 CCOCc1cc(cc(c1)F)C 12b3c4e02bef889f60d5f11ea82f6bb7 [0,2,0,0,0,0|2,0,0]=4 5934 B12R1.100 CCOCc1cc(cc(c1)F)F 8691f1f8d5567a5de21e4068f4b425ff [0,2,0,0,0,0|2,0,0]=4 5935 B12R1.100 CCOCc1cc(cc(c1)I)Br 4e7ab607768544b91453b3315f8a2be7 [0,2,0,0,0,0|2,0,0]=4 5936 B12R1.100 CCOCc1cc(cc(c1)I)C 1f327318a6da35a92e975ae23d419ad7 [0,2,0,0,0,0|2,0,0]=4 5937 B12R1.100 CCOCc1cc(cc(c1)I)Cl 9c97b005035fab639fd68c322aa80992 [0,2,0,0,0,0|2,0,0]=4 5938 B12R1.100 CCOCc1cc(cc(c1)I)F 3da8b2d2efe1c0f5eb3a9880f5ddba56 [0,2,0,0,0,0|2,0,0]=4 5939 B12R1.100 CCOCc1cc(cc(c1)I)I 1ba71f8cf73d213f2e42a4cc7a05e4ab [0,2,0,0,0,0|2,0,0]=4 5940 B12R1.100 COCNc1cc([nH]c(=O)c1)F 858f1acb3c180009722540159fbbbf21 [0,2,0,0,0,0|2,0,0]=4 5941 B12R1.100 COCNc1cc(cc(c1)Br)Br aaa920c1a2c364b460ab3cb3bd6c7987 [0,2,0,0,0,0|1,0,0]=3 5942 B12R1.100 COCNc1cc(cc(c1)Br)C c4a4192acf7bcbc233fa28ec0b97de4b [0,2,0,0,0,0|1,0,0]=3 5943 B12R1.100 COCNc1cc(cc(c1)Br)Cl 875ab1853b03f20290a98d579a7954ed [0,2,0,0,0,0|1,0,0]=3 5944 B12R1.100 COCNc1cc(cc(c1)Br)F 965796e8b9e12415a309993987e7dd15 [0,2,0,0,0,0|1,0,0]=3 5945 B12R1.100 COCNc1cc(cc(c1)C)C 454af0c6b4114ba89bcebbb934ff4fd7 [0,2,0,0,0,0|1,0,0]=3 5946 B12R1.100 COCNc1cc(cc(c1)Cl)C 5e28e96144356b9269ab47623f58fa18 [0,2,0,0,0,0|1,0,0]=3 5947 B12R1.100 COCNc1cc(cc(c1)Cl)Cl d476df5cf8ee424159a38612784e8286 [0,2,0,0,0,0|1,0,0]=3 5948 B12R1.100 COCNc1cc(cc(c1)Cl)F 94161e73bad1f1ca4759cad9c385c096 [0,2,0,0,0,0|1,0,0]=3 5949 B12R1.100 COCNc1cc(cc(c1)F)C 8a206c003bff047c2ccf7f5cab349681 [0,2,0,0,0,0|1,0,0]=3 5950 B12R1.100 COCNc1cc(cc(c1)F)F ec9afe90aa8f9995b76c235ac3f0d9c1 [0,2,0,0,0,0|1,0,0]=3 5951 B12R1.100 COCNc1cc(cc(c1)I)Br 1edbdadfb75db86fc318abca532c8bc6 [0,2,0,0,0,0|1,0,0]=3 5952 B12R1.100 COCNc1cc(cc(c1)I)C 55ecd5f3b9e7030768ead8ae72cd1c78 [0,2,0,0,0,0|1,0,0]=3 5953 B12R1.100 COCNc1cc(cc(c1)I)Cl 31ae5c6f0e234cc42056df829f2bcad6 [0,2,0,0,0,0|1,0,0]=3 5954 B12R1.100 COCNc1cc(cc(c1)I)F 40bc5d3bac576edbaee0472bf67d61c3 [0,2,0,0,0,0|1,0,0]=3 5955 B12R1.100 COCNc1cc(cc(c1)I)I 1117484d64ef4c2b6040ace63583bbf7 [0,2,0,0,0,0|1,0,0]=3 5956 B12R1.100 COCNc1cc(cc(n1)Br)Br 278f9bd1d48f00f7e1779cc57e4837ce [0,2,0,0,0,0|2,0,0]=4 5957 B12R1.100 COCNc1cc(cc(n1)Br)C 4469135f181ac5167a70d18ebb65e231 [0,2,0,0,0,0|2,0,0]=4 5958 B12R1.100 COCNc1cc(cc(n1)Br)Cl f1d90d4a93f8996a65796e0dc3bdc565 [0,2,0,0,0,0|2,0,0]=4 5959 B12R1.100 COCNc1cc(cc(n1)C)Br 50b8f8d2f5d0ed37d148f8c79116c134 [0,2,0,0,0,0|2,0,0]=4 5960 B12R1.100 COCNc1cc(cc(n1)C)C e1ef05504cce43289b236e2221650aaa [0,2,0,0,0,0|2,0,0]=4 5961 B12R1.100 COCNc1cc(cc(n1)C)Cl 6a95f6495060ff592839e10cec52b272 [0,2,0,0,0,0|2,0,0]=4 5962 B12R1.100 COCNc1cc(cc(n1)Cl)Br ad49d213f2af7b21fd1952bd70ebee5d [0,2,0,0,0,0|2,0,0]=4 5963 B12R1.100 COCNc1cc(cc(n1)Cl)C 9a819d41aeb9938ee191395f137da09a [0,2,0,0,0,0|2,0,0]=4 5964 B12R1.100 COCNc1cc(cc(n1)Cl)Cl ee9fdb973cd67b6e7bb13625bd3a302d [0,2,0,0,0,0|2,0,0]=4 5965 B12R1.100 COCNc1cc(cc(n1)Cl)F 91dfd964ccb3ce462b7d9f8eda3b3145 [0,2,0,0,0,0|2,0,0]=4 5966 B12R1.100 COCNc1cc(cc(n1)Cl)I 57422c2ab5f285eaeec5fb61b41ec011 [0,2,0,0,0,0|2,0,0]=4 5967 B12R1.100 COCNc1cc(cc(n1)F)Br 6ff4705da1800693e3650ce39b1f627f [0,2,0,0,0,0|2,0,0]=4 5968 B12R1.100 COCNc1cc(cc(n1)F)C 6355589ec7b474115cbc60d5a9ba815d [0,2,0,0,0,0|2,0,0]=4 5969 B12R1.100 COCNc1cc(nc(c1)Br)Br 98a4195a206a8da1d58b54f472ffd9f9 [0,2,0,0,0,0|2,0,0]=4 5970 B12R1.100 COCNc1cc(nc(c1)Br)C 489477244b72f6b291f9efa9be5dba87 [0,2,0,0,0,0|2,0,0]=4 5971 B12R1.100 COCNc1cc(nc(c1)Br)Cl af45df5b1636f9b8579377e5e7b79224 [0,2,0,0,0,0|2,0,0]=4 5972 B12R1.100 COCNc1cc(nc(c1)C)C 758a473fac35b21ca2930aff9d0c3158 [0,2,0,0,0,0|2,0,0]=4 5973 B12R1.100 COCNc1cc(nc(c1)Cl)C afb939f3264379535ea1d9596a950073 [0,2,0,0,0,0|2,0,0]=4 5974 B12R1.100 COCNc1cc(nc(c1)Cl)Cl b4cde75e05c4f67801ecddaa3cb335b4 [0,2,0,0,0,0|2,0,0]=4 5975 B12R1.100 COCNc1cc(nc(c1)Cl)F 1a918ecefc694717c584a22b2ddc6919 [0,2,0,0,0,0|2,0,0]=4 5976 B12R1.100 COCNc1cc(nc(c1)F)C e7177fffc57cbc293ceb74698dda3ce3 [0,2,0,0,0,0|2,0,0]=4 5977 B12R1.100 COCNc1cc(nc(c1)F)F 44f318179bc9923d277ad16fa7b0e8c9 [0,2,0,0,0,0|2,0,0]=4 5978 B12R1.100 COCNc1cc(oc(=O)c1)C 7d4f72dde746115c0f3b43bd54573e8c [0,2,0,0,0,0|2,0,0]=4 5979 B12R1.100 COCOc1cc(=O)cc(o1)C bef1a6e899e09e7e3f296277cda5cd44 [0,2,0,0,0,0|2,0,0]=4 5980 B12R1.100 COCOc1cc(cc(c1)Br)Br bfdc28d84455625fffc0f54bb33580e9 [0,2,0,0,0,0|1,0,0]=3 5981 B12R1.100 COCOc1cc(cc(c1)Br)C 207139a781a6276c8bf615d67a7ac13f [0,2,0,0,0,0|1,0,0]=3 5982 B12R1.100 COCOc1cc(cc(c1)Br)Cl f101cccb2ad95873aea7ff7a8dddd30c [0,2,0,0,0,0|1,0,0]=3 5983 B12R1.100 COCOc1cc(cc(c1)Br)F eddf95623cacd3d8a3f57b90bebba217 [0,2,0,0,0,0|1,0,0]=3 5984 B12R1.100 COCOc1cc(cc(c1)C)C e491e7ddac874511a3dd21767baefc00 [0,2,0,0,0,0|1,0,0]=3 5985 B12R1.100 COCOc1cc(cc(c1)Cl)C f4aa1e019ebe5cd7a78359ab0a373771 [0,2,0,0,0,0|1,0,0]=3 5986 B12R1.100 COCOc1cc(cc(c1)Cl)Cl 6e3ec8019292d316684729105ca0f580 [0,2,0,0,0,0|1,0,0]=3 5987 B12R1.100 COCOc1cc(cc(c1)Cl)F 0f57a677a571df85c3c8cd13e090c35f [0,2,0,0,0,0|1,0,0]=3 5988 B12R1.100 COCOc1cc(cc(c1)F)C 0c02fdd94245278ce44492cca5b92844 [0,2,0,0,0,0|1,0,0]=3 5989 B12R1.100 COCOc1cc(cc(c1)F)F 2b79b1a446ebe6e96626e73f257f7942 [0,2,0,0,0,0|1,0,0]=3 5990 B12R1.100 COCOc1cc(cc(c1)I)Br afe3d239c0742e580da8e068cfa0d427 [0,2,0,0,0,0|1,0,0]=3 5991 B12R1.100 COCOc1cc(cc(c1)I)C 031d08137c164b77c77d3b644505f370 [0,2,0,0,0,0|1,0,0]=3 5992 B12R1.100 COCOc1cc(cc(c1)I)Cl 8afa20ded57bc8f34474d6ae5266a606 [0,2,0,0,0,0|1,0,0]=3 5993 B12R1.100 COCOc1cc(cc(c1)I)F 18d89575a5dce5423d236e4a23215a41 [0,2,0,0,0,0|1,0,0]=3 5994 B12R1.100 COCOc1cc(cc(n1)Br)C 95a2b9c5257362e67392b25bc5299d50 [0,2,0,0,0,0|2,0,0]=4 5995 B12R1.100 COCOc1cc(cc(n1)C)Br c1024b43f14bcc0d26ef5b4b680188ed [0,2,0,0,0,0|2,0,0]=4 5996 B12R1.100 COCOc1cc(cc(n1)C)C 51be7745a507d2a91853202229dbd86d [0,2,0,0,0,0|2,0,0]=4 5997 B12R1.100 COCOc1cc(cc(n1)C)Cl e57d304f674ae78d4b976ecf11e0f831 [0,2,0,0,0,0|2,0,0]=4 5998 B12R1.100 COCOc1cc(cc(n1)C)F f5d62c96a1e488329c781413b7380e5d [0,2,0,0,0,0|2,0,0]=4 5999 B12R1.100 COCOc1cc(cc(n1)Cl)Br 04c201d2e61c326974c9cc79d59f7ac3 [0,2,0,0,0,0|2,0,0]=4 6000 B12R1.100 COCOc1cc(cc(n1)Cl)C 61e335289b0cde63d81e43b9905b62b9 [0,2,0,0,0,0|2,0,0]=4 6001 B12R1.100 COCOc1cc(cc(n1)Cl)Cl ef00075e7931be6a5cf47af99bce1780 [0,2,0,0,0,0|2,0,0]=4 6002 B12R1.100 COCOc1cc(nc(c1)Br)Br d81f8ba66828550f3ba2c6dfd2b53c08 [0,2,0,0,0,0|2,0,0]=4 6003 B12R1.100 COCOc1cc(nc(c1)Cl)C 707b2a48ca0ee5bd1b2d81f6f125090b [0,2,0,0,0,0|2,0,0]=4 6004 B12R1.100 COCOc1cc(nc(c1)Cl)Cl 7f14fcd3234c449bdd1360bd13debe32 [0,2,0,0,0,0|2,0,0]=4 6005 B12R1.100 COCOc1cc(nc(c1)Cl)F 533f23267655d169a131056e2c6d7cc6 [0,2,0,0,0,0|2,0,0]=4 6006 B12R1.100 COCOc1cc(nc(c1)F)F e335a20c384a0b4429080c7d437537db [0,2,0,0,0,0|2,0,0]=4 6007 B12R1.100 COCOc1cc(oc(=O)c1)C f3be0015fd9a27a78365d8aaf27747d7 [0,2,0,0,0,0|2,0,0]=4 6008 B12R1.100 CSCNc1cc(cc(c1)Br)Br 6968af56087fa12b90aef4552e9c9cf4 [0,2,0,0,0,0|1,1,0]=4 6009 B12R1.100 CSCNc1cc(cc(c1)Br)C 950524d574d72fbbbeb514b89b95c716 [0,2,0,0,0,0|1,1,0]=4 6010 B12R1.100 CSCNc1cc(cc(c1)Br)Cl 2182af4b8e255ae06d53d29564c414dc [0,2,0,0,0,0|1,1,0]=4 6011 B12R1.100 CSCNc1cc(cc(c1)Br)F c39828ef82cd23868b679a206f301c2c [0,2,0,0,0,0|1,1,0]=4 6012 B12R1.100 CSCNc1cc(cc(c1)C)C d3b498b7cdaee367fa0657b0d0a7c770 [0,2,0,0,0,0|1,1,0]=4 6013 B12R1.100 CSCNc1cc(cc(c1)Cl)C bbcb3d07f0cd7f6284767d5afd3514a5 [0,2,0,0,0,0|1,1,0]=4 6014 B12R1.100 CSCNc1cc(cc(c1)Cl)Cl 910a5a987b9972ac1827d185d12db480 [0,2,0,0,0,0|1,1,0]=4 6015 B12R1.100 CSCNc1cc(cc(c1)Cl)F a03b64c0f3b642659bf6e3c9407477b8 [0,2,0,0,0,0|1,1,0]=4 6016 B12R1.100 CSCNc1cc(cc(c1)F)C ee4212cc57764dc4877aab3ae1f14a51 [0,2,0,0,0,0|1,1,0]=4 6017 B12R1.100 CSCNc1cc(cc(c1)F)F 126065a1abd7c713bb4375be09ad245e [0,2,0,0,0,0|1,1,0]=4 6018 B12R1.100 CSCNc1cc(cc(c1)I)Br 2613197c17edde8ba70d6c36377a07eb [0,2,0,0,0,0|1,1,0]=4 6019 B12R1.100 CSCNc1cc(cc(c1)I)C 32f4f56c42565d0ddaaa67251bd48c17 [0,2,0,0,0,0|1,1,0]=4 6020 B12R1.100 CSCNc1cc(cc(c1)I)Cl 9be3f12b2efbcf350c44d632e56ce009 [0,2,0,0,0,0|1,1,0]=4 6021 B12R1.100 CSCNc1cc(cc(c1)I)F af849b5fa6470073105a1277c79702b3 [0,2,0,0,0,0|1,1,0]=4 6022 B12R1.100 CSCNc1cc(cc(c1)I)I 7e6fe45a958184d9c0331e315870aced [0,2,0,0,0,0|1,1,0]=4 6023 B12R1.100 CSCOc1cc(cc(c1)Br)Br 09edb4383c36e6844534f80f61160d4a [0,2,0,0,0,0|1,1,0]=4 6024 B12R1.100 CSCOc1cc(cc(c1)Br)C c555c1e62f22ee7a7be8784369e5e61b [0,2,0,0,0,0|1,1,0]=4 6025 B12R1.100 CSCOc1cc(cc(c1)Br)Cl a344545df8a5ec2afeff7a9e9e463b6f [0,2,0,0,0,0|1,1,0]=4 6026 B12R1.100 CSCOc1cc(cc(c1)Br)F f2e76898ca1433ed54c012cf07a0f7c2 [0,2,0,0,0,0|1,1,0]=4 6027 B12R1.100 CSCOc1cc(cc(c1)C)C f747daddbdccb608ae966e94371f1a1a [0,2,0,0,0,0|1,1,0]=4 6028 B12R1.100 CSCOc1cc(cc(c1)Cl)C 455f6682369e62475b2d622eb068a7de [0,2,0,0,0,0|1,1,0]=4 6029 B12R1.100 CSCOc1cc(cc(c1)Cl)Cl 7b8bd11f3dd22703447d4b185445ea54 [0,2,0,0,0,0|1,1,0]=4 6030 B12R1.100 CSCOc1cc(cc(c1)Cl)F 4c95d8c4932f7df5e52c1313e9a47712 [0,2,0,0,0,0|1,1,0]=4 6031 B12R1.100 CSCOc1cc(cc(c1)F)C ab4d5e5ae2cdf8671f715760e2c14b06 [0,2,0,0,0,0|1,1,0]=4 6032 B12R1.100 CSCOc1cc(cc(c1)F)F 110b6eb4b3de313f494acdacc665fa04 [0,2,0,0,0,0|1,1,0]=4 6033 B12R1.100 CSCOc1cc(cc(c1)I)Br 941cbcf7a78058bcf0bd2a68f8f1c89a [0,2,0,0,0,0|1,1,0]=4 6034 B12R1.100 CSCOc1cc(cc(c1)I)C b566a960381b513f311f5745cfbb75ba [0,2,0,0,0,0|1,1,0]=4 6035 B12R1.100 CSCOc1cc(cc(c1)I)Cl 9d8394922b7f42ba3c205a660eeda8e4 [0,2,0,0,0,0|1,1,0]=4 6036 B12R1.100 CSCOc1cc(cc(c1)I)F 7ace030bca75dbac253911d0876e44d5 [0,2,0,0,0,0|1,1,0]=4 6037 B12R1.226 C=C(C)CNc1cccc(c1)Br de1e76ede883aee85cbcf5339a7f8f25 [0,2,0,0,0,0|2,0,0]=4 6038 B12R1.226 C=C(C)CNc1cccc(c1)C 0f8e64f7c75a7af21f7e45d5d7851656 [0,2,0,0,0,0|2,0,0]=4 6039 B12R1.226 C=C(C)CNc1cccc(c1)Cl 34927e69a4522517159f6f62ef580aec [0,2,0,0,0,0|2,0,0]=4 6040 B12R1.226 C=C(C)CNc1cccc(c1)F e57cadd3f881c2b4adb44901fb57d5ad [0,2,0,0,0,0|2,0,0]=4 6041 B12R1.226 C=C(C)CNc1cccc(c1)I 26a6f07a6c1f09cf7f9c9ba1e22512f8 [0,2,0,0,0,0|2,0,0]=4 6042 B12R1.226 C=C(C)CNc1cccc(c1)S a2bb3bbb8593e8517ca2355f15a3da0d [0,2,0,0,0,0|2,0,0]=4 6043 B12R1.226 C=C(C)COc1cccc(c1)Br 270e0e9cec9d46a473b1bc9a8dcff70c [0,2,0,0,0,0|2,0,0]=4 6044 B12R1.226 C=C(C)COc1cccc(c1)C 9b7f8a285f7e1ff408aa84ad50ead534 [0,2,0,0,0,0|2,0,0]=4 6045 B12R1.226 C=C(C)COc1cccc(c1)Cl 4a4b3322147858a73bc9162445708e27 [0,2,0,0,0,0|2,0,0]=4 6046 B12R1.226 C=C(C)COc1cccc(c1)F 8939a2d27aa59e5b53fcf26c7a2c6fcb [0,2,0,0,0,0|2,0,0]=4 6047 B12R1.226 C=C(C)COc1cccc(c1)I c7035a9fe74ceb65e4fb7171f5f2ff65 [0,2,0,0,0,0|2,0,0]=4 6048 B12R1.226 C=C(C)COc1cccc(c1)S e177be72ee62f401e97990216337270e [0,2,0,0,0,0|2,0,0]=4 6049 B12R1.226 CC(=O)CNc1cccc(c1)C 33e32618ff2915ad648437dd5dce6cbd [0,2,0,0,0,0|2,0,0]=4 6050 B12R1.226 CC(=O)CNc1cccc(c1)F 1b1aeadc0fd3e934a52dcdc2c9f88ad3 [0,2,0,0,0,0|2,0,0]=4 6051 B12R1.226 CC(=O)CNc1cccc(c1)O 58381ec1392288e974af170ef04a232f [0,2,0,0,0,0|2,0,0]=4 6052 B12R1.226 CC(=O)CNc1cccc(c1)S d6d61e3f91394fcd573c1e423d8034bd [0,2,0,0,0,0|2,0,0]=4 6053 B12R1.226 CC(=O)NCc1cccc(c1)Br de12b91af74adce6491e684ee046a109 [0,2,0,0,0,0|2,0,0]=4 6054 B12R1.226 CC(=O)NCc1cccc(c1)C 2a897b53ee5ae4ee12831959238615eb [0,2,0,0,0,0|2,0,0]=4 6055 B12R1.226 CC(=O)NCc1cccc(c1)Cl 41ca11020cbae0363ca80ce2470c3eaa [0,2,0,0,0,0|2,0,0]=4 6056 B12R1.226 CC(=O)NCc1cccc(c1)F 01d6391ca1042cdbb55ba2e4912ec579 [0,2,0,0,0,0|2,0,0]=4 6057 B12R1.226 CC(=O)NCc1cccc(c1)I 5fa08dbe9ba4e88c69d843155ffafe98 [0,2,0,0,0,0|2,0,0]=4 6058 B12R1.226 CC(=O)NCc1cccc(c1)O c305a8cebe934755e5a41fc4c98fdcfd [0,2,0,0,0,0|2,0,0]=4 6059 B12R1.226 CC(C)CNc1cccc(c1)Br 47f96ede91384a2957a9f738bcf7cbb7 [0,2,0,0,0,0|2,0,0]=4 6060 B12R1.226 CC(C)CNc1cccc(c1)Cl b77efea477419bad137ef23a5b33cfdb [0,2,0,0,0,0|2,0,0]=4 6061 B12R1.226 CC(C)CNc1cccc(c1)F 4fe892f19d398f74f696f31fe8fec9d4 [0,2,0,0,0,0|2,0,0]=4 6062 B12R1.226 CC(C)CNc1cccc(c1)I a713b158e8d2e866fe5954e27f6736a8 [0,2,0,0,0,0|2,0,0]=4 6063 B12R1.226 CC(C)CNc1cccc(c1)S d8df0c59c2a95482a973f3e4b2ca8288 [0,2,0,0,0,0|2,0,0]=4 6064 B12R1.226 CC(C)COc1cccc(c1)Br 78b9893bdd66fbb7fd676a9f9d9a6b5c [0,2,0,0,0,0|2,0,0]=4 6065 B12R1.226 CC(C)COc1cccc(c1)Cl 17fc81f1248afd3345d318121f9a6be5 [0,2,0,0,0,0|2,0,0]=4 6066 B12R1.226 CC(C)COc1cccc(c1)F 952f6b6f6d9d7e5903334a6085f9ca2b [0,2,0,0,0,0|2,0,0]=4 6067 B12R1.226 CC(C)COc1cccc(c1)I 825de32ad6ba816c4a9b0b15d9f5b09d [0,2,0,0,0,0|2,0,0]=4 6068 B12R1.226 CC(C)COc1cccc(c1)S 1e2cf6d2ce302e2dbeb13d96800a69ca [0,2,0,0,0,0|2,0,0]=4 6069 B12R1.226 CC(C)NCc1cccc(c1)Br 1c3c944c566959e7eef7efc9a8c8251c [0,2,0,0,0,0|2,0,0]=4 6070 B12R1.226 CC(C)NCc1cccc(c1)Cl 9dbc94fad7d16f41b15b3aebc8ca545b [0,2,0,0,0,0|2,0,0]=4 6071 B12R1.226 CC(C)NCc1cccc(c1)F 3787b7b4f5a6fda7587bfa332950191c [0,2,0,0,0,0|2,0,0]=4 6072 B12R1.226 CC(C)NCc1cccc(c1)I d4cf7394a008619606fd5e038404d76e [0,2,0,0,0,0|2,0,0]=4 6073 B12R1.226 CC(C)OCc1cccc(c1)Br 879562350b15275860c09e604131f21c [0,2,0,0,0,0|2,0,0]=4 6074 B12R1.226 CC(C)OCc1cccc(c1)Cl c3629f30972b60636a5bcff8690532c9 [0,2,0,0,0,0|2,0,0]=4 6075 B12R1.226 CC(C)OCc1cccc(c1)F 9a739aed0fdfe4226f0a5132088c54a0 [0,2,0,0,0,0|2,0,0]=4 6076 B12R1.226 CC(C)OCc1cccc(c1)I bf4c5f71e0f6d55a1580b32357b1183d [0,2,0,0,0,0|2,0,0]=4 6077 B12R1.226 CC(O)CNc1cccc(c1)Br 1313cc150d07e3249eb16f742927aba5 [0,2,0,0,0,0|2,0,0]=4 6078 B12R1.226 CC(O)CNc1cccc(c1)Cl b0b36293e53ebea3215e5b365b1c91a1 [0,2,0,0,0,0|2,0,0]=4 6079 B12R1.226 CC(O)CNc1cccc(c1)F 7b51f8f85220316ed6f71fbb6c6e04a1 [0,2,0,0,0,0|2,0,0]=4 6080 B12R1.226 CC(O)CNc1cccc(c1)I e3b39e215b46b137d14817575c01ba24 [0,2,0,0,0,0|2,0,0]=4 6081 B12R1.226 CC(O)CNc1cccc(c1)S 78e49f113d0630c078debe2e470f3646 [0,2,0,0,0,0|2,0,0]=4 6082 B12R1.226 CN(C)CNc1cccc(c1)Br a9db52ec4d18e43fd5f8052a16d9b2f5 [0,2,0,0,0,0|2,0,0]=4 6083 B12R1.226 CN(C)CNc1cccc(c1)Cl b91ebc3860602b7d435fbc25bba120c0 [0,2,0,0,0,0|2,0,0]=4 6084 B12R1.226 CN(C)CNc1cccc(c1)F fabc161cc8935ed63e4bf8f7340eeb1b [0,2,0,0,0,0|2,0,0]=4 6085 B12R1.226 CN(C)CNc1cccc(c1)I 73b573d1bee26bd55249f0d50a8760e1 [0,2,0,0,0,0|2,0,0]=4 6086 B12R1.226 CN(C)CNc1cccc(c1)S 8b408beb2995a69d831e59e74ceea8c7 [0,2,0,0,0,0|2,0,0]=4 6087 B12R1.226 CN(C)COc1cccc(c1)Br 58f441b0ca3290c7f2d4537ec22a4d7a [0,2,0,0,0,0|2,0,0]=4 6088 B12R1.226 CN(C)COc1cccc(c1)Cl a81bc88b54f5005184b834642d9d3f86 [0,2,0,0,0,0|2,0,0]=4 6089 B12R1.226 CN(C)COc1cccc(c1)F 58b8398ab333a20e468588e9a1f2ba62 [0,2,0,0,0,0|2,0,0]=4 6090 B12R1.226 CN(C)COc1cccc(c1)I d82dc4d136e4cc08f2e0c8e654992b65 [0,2,0,0,0,0|2,0,0]=4 6091 B12R1.226 CN(C)COc1cccc(c1)S bcd4099b9a40b45e56f4b34dede1ec79 [0,2,0,0,0,0|2,0,0]=4 6092 B12R1.226 C[C@@H](O)CNc1cccc(c1)Br 7f47c7e325073bbe1ddb7b38bff8b932 [0,2,0,0,0,0|2,0,0]=4 6093 B12R1.226 C[C@@H](O)CNc1cccc(c1)Cl 8246dcd52dcd9ed0dbef7338a7f127b3 [0,2,0,0,0,0|2,0,0]=4 6094 B12R1.226 C[C@@H](O)CNc1cccc(c1)F e736be531156c2b7166ca634fb8a70ce [0,2,0,0,0,0|2,0,0]=4 6095 B12R1.226 C[C@@H](O)CNc1cccc(c1)I 4db71a0fd089913b0233a85b00396803 [0,2,0,0,0,0|2,0,0]=4 6096 B12R1.226 C[C@H](O)CNc1cccc(c1)Br a49c8030ae048c6affea28034df1531a [0,2,0,0,0,0|2,0,0]=4 6097 B12R1.226 C[C@H](O)CNc1cccc(c1)Cl 2370f8fa6414cdc9dd596258b1f50ab7 [0,2,0,0,0,0|2,0,0]=4 6098 B12R1.226 C[C@H](O)CNc1cccc(c1)F 81dcc6ac1cc4da1e70d103a206dd18af [0,2,0,0,0,0|2,0,0]=4 6099 B12R1.226 C[C@H](O)CNc1cccc(c1)I f90f80969bfd6ec1423e67f3dd3ecafa [0,2,0,0,0,0|2,0,0]=4 6100 B12R1.226 C[C@H](O)CNc1cccc(c1)S 0421b4bf0fcc630d12159982ed02f691 [0,2,0,0,0,0|2,0,0]=4 6101 B12R1.226 Cc1cccc(c1)CNC(C)C 409614b24510f7aec784aa24e2d29ef2 [0,2,0,0,0,0|2,0,0]=4 6102 B12R1.226 Cc1cccc(c1)COC(C)C ac14bed03bb08492372420f353b99c52 [0,2,0,0,0,0|2,0,0]=4 6103 B12R1.226 Cc1cccc(c1)NCC(C)C 4d0c9075dc953be03bb974637f4ee812 [0,2,0,0,0,0|2,0,0]=4 6104 B12R1.226 Cc1cccc(c1)NCC(C)O 6ec20ee81cd6564f027fad7c9046635a [0,2,0,0,0,0|2,0,0]=4 6105 B12R1.226 Cc1cccc(c1)NCN(C)C f60eeb0a22d178d4adde33f0517fefb6 [0,2,0,0,0,0|2,0,0]=4 6106 B12R1.226 Cc1cccc(c1)NC[C@@H](C)O b7ae52517241209d5ba2933489a9a337 [0,2,0,0,0,0|2,0,0]=4 6107 B12R1.226 Cc1cccc(c1)NC[C@H](C)O 1a909dc0c3197c842cec2d227814451e [0,2,0,0,0,0|2,0,0]=4 6108 B12R1.226 Cc1cccc(c1)OCC(C)C a573d64150ab49ed03c4bef1c7ab030b [0,2,0,0,0,0|2,0,0]=4 6109 B12R1.226 Cc1cccc(c1)OCN(C)C c8f371c842f7e29ba772757895b8b2d4 [0,2,0,0,0,0|2,0,0]=4 6110 B12R1.382 C#Cc1cc(ccn1)NCOC 4b3704d27e16db6e19e0945fd2e270a7 [0,2,0,0,0,0|2,0,0]=4 6111 B12R1.382 C#Cc1cccc(c1)CNCC 817f8c79d5ab46f56c030498585bba27 [0,2,0,0,0,0|2,0,0]=4 6112 B12R1.382 C#Cc1cccc(c1)COCC 0aefc46aa3bedf4fffaf0aca59b2af8f [0,2,0,0,0,0|2,0,0]=4 6113 B12R1.382 C#Cc1cccc(c1)NCCC 48cb5fd6f15463f0eecd350ea224d5ed [0,2,0,0,0,0|2,0,0]=4 6114 B12R1.382 C#Cc1cccc(c1)NCOC 8f72c799731c9c5ba90e689b5c751d35 [0,2,0,0,0,0|1,0,0]=3 6115 B12R1.382 C#Cc1cccc(c1)NCSC 300d8307e4c7428cb9bfa2f5baaa8e06 [0,2,0,0,0,0|1,1,0]=4 6116 B12R1.382 C#Cc1cccc(c1)OCCC e802ba880defb96a8a52b892f1515404 [0,2,0,0,0,0|2,0,0]=4 6117 B12R1.382 C#Cc1cccc(c1)OCOC ebe47240b0cec622f06f59637523abf9 [0,2,0,0,0,0|1,0,0]=3 6118 B12R1.382 C#Cc1cccc(c1)OCSC 39717921a80204037f90c34c061d7dda [0,2,0,0,0,0|1,1,0]=4 6119 B12R1.382 C#Cc1cccc(n1)NCOC 39c77777467c875c57d042c5b161c870 [0,2,0,0,0,0|2,0,0]=4 6120 B12R1.382 C#Cc1ccnc(c1)NCOC ac728078c6fc2f10db93ded736501f65 [0,2,0,0,0,0|2,0,0]=4 6121 B12R1.382 C#Cc1cncc(c1)NCOC 7ea71020490e8aea1ca2aee483411073 [0,2,0,0,0,0|2,0,0]=4 6122 B12R1.382 C#Cc1cncc(c1)OCOC 0c8d98ee502d6fb485cf63138a4b17fb [0,2,0,0,0,0|2,0,0]=4 6123 B12R1.382 C=Cc1cc(ccn1)NCOC 250058d7447db293a51318b2c5ee6953 [0,2,0,0,0,0|2,0,0]=4 6124 B12R1.382 C=Cc1cccc(c1)COCC ab7097d3cc7fbef14952297b4960b713 [0,2,0,0,0,0|2,0,0]=4 6125 B12R1.382 C=Cc1cccc(c1)NCCC ba02dca6552e93f25052165b0e6277cb [0,2,0,0,0,0|2,0,0]=4 6126 B12R1.382 C=Cc1cccc(c1)NCOC b1a61b55a6afbac5aa4c88f5f408ae09 [0,2,0,0,0,0|1,0,0]=3 6127 B12R1.382 C=Cc1cccc(c1)NCSC 000ad7107451744c886b7b4acef24e9c [0,2,0,0,0,0|1,1,0]=4 6128 B12R1.382 C=Cc1cccc(c1)OCCC 17035cc7a5f79f5722c9102a227ed3d6 [0,2,0,0,0,0|2,0,0]=4 6129 B12R1.382 C=Cc1cccc(c1)OCOC 6c67d4f7fedeb60f0fcb89dc44720a7d [0,2,0,0,0,0|1,0,0]=3 6130 B12R1.382 C=Cc1cccc(c1)OCSC 73b171fea849d5d076ef4914159be231 [0,2,0,0,0,0|1,1,0]=4 6131 B12R1.382 CCCNc1cccc(c1)C#N a2eb5b352059d7a9f0087f055aa7dca0 [0,2,0,0,0,0|2,0,0]=4 6132 B12R1.382 CCCNc1cccc(c1)C=O 86db3c7624ad38ce56be3bba817833bd [0,2,0,0,0,0|2,0,0]=4 6133 B12R1.382 CCCNc1cccc(c1)CBr 8df2f1b37b7ed9bbd65c2fc377c80d53 [0,2,0,0,0,0|2,0,0]=4 6134 B12R1.382 CCCNc1cccc(c1)CC 61552c9dbea55b0507de0d62bd637cf4 [0,2,0,0,0,0|2,0,0]=4 6135 B12R1.382 CCCNc1cccc(c1)CF 25c29314c04fb6497dfa07090da80763 [0,2,0,0,0,0|2,0,0]=4 6136 B12R1.382 CCCNc1cccc(c1)CO b9bfec98c4c18aa7e2b2505fe0f0fa2f [0,2,0,0,0,0|2,0,0]=4 6137 B12R1.382 CCCNc1cccc(c1)CS 841a5c78f4e1b6d3c2314372314e5fd7 [0,2,0,0,0,0|2,0,0]=4 6138 B12R1.382 CCCNc1cccc(c1)OC 796ed24fdd9f08a548b117ecbe4d9026 [0,2,0,0,0,0|2,0,0]=4 6139 B12R1.382 CCCNc1cccc(c1)ON 9864d8eccf3700966a241b152147731a [0,2,0,0,0,0|2,0,0]=4 6140 B12R1.382 CCCNc1cccc(c1)SC 0519ac730415516920cf28b38885fce7 [0,2,0,0,0,0|2,0,0]=4 6141 B12R1.382 CCCOc1cccc(c1)C#N 21c0f09b4edb490bd5ce77af8b4d2ba2 [0,2,0,0,0,0|2,0,0]=4 6142 B12R1.382 CCCOc1cccc(c1)C=O 21f91abf3f9aa4f00ed6592132e8491a [0,2,0,0,0,0|2,0,0]=4 6143 B12R1.382 CCCOc1cccc(c1)CC ffb15cc2ed39bd20514d6a2afc6a39c6 [0,2,0,0,0,0|2,0,0]=4 6144 B12R1.382 CCCOc1cccc(c1)OC f3db11136b3cbf782c2286c6e3ca943e [0,2,0,0,0,0|2,0,0]=4 6145 B12R1.382 CCCOc1cccc(c1)SC ad41ee52aa0a583b4d47f6e588d6185f [0,2,0,0,0,0|2,0,0]=4 6146 B12R1.382 CCNCc1cccc(c1)C#N 34f68bfb6c1581c3e55f4f91a9e059e4 [0,2,0,0,0,0|2,0,0]=4 6147 B12R1.382 CCNCc1cccc(c1)CC 5eaa260b3d0d999df37ca3bdff8d70cd [0,2,0,0,0,0|2,0,0]=4 6148 B12R1.382 CCNCc1cccc(c1)CO b99393bf72a32cd83525a4c7f2eb0594 [0,2,0,0,0,0|2,0,0]=4 6149 B12R1.382 CCNCc1cccc(c1)OC d05423d998f2bee005b62c5b32cff4a4 [0,2,0,0,0,0|2,0,0]=4 6150 B12R1.382 CCNCc1cccc(c1)SC 9a346411aa4b7630fb76d07cff593047 [0,2,0,0,0,0|2,0,0]=4 6151 B12R1.382 CCOCc1cccc(c1)C#N 0e4786b32b8eb00b2fe888cc0869f568 [0,2,0,0,0,0|2,0,0]=4 6152 B12R1.382 CCOCc1cccc(c1)C=O c456bcdabdece2523f46d420d0823e08 [0,2,0,0,0,0|2,0,0]=4 6153 B12R1.382 CCOCc1cccc(c1)CC a10b7fc60b0542d0179ffe953fd82eb5 [0,2,0,0,0,0|2,0,0]=4 6154 B12R1.382 CCOCc1cccc(c1)OC 78fd4a0b593b5164575c02afa53f8542 [0,2,0,0,0,0|2,0,0]=4 6155 B12R1.382 CCOCc1cccc(c1)SC 48b4eefaff5189e77715acb2a4c3e18b [0,2,0,0,0,0|2,0,0]=4 6156 B12R1.382 CCc1cc(ccn1)NCOC 8ff300d6c2c07d06e5d521ec7c874302 [0,2,0,0,0,0|2,0,0]=4 6157 B12R1.382 CCc1cccc(c1)NCOC c5f8737e1d1efe0ac4acef532aa30673 [0,2,0,0,0,0|1,0,0]=3 6158 B12R1.382 CCc1cccc(c1)NCSC 5eefac2b481d63997609a470944c26b5 [0,2,0,0,0,0|1,1,0]=4 6159 B12R1.382 CCc1cccc(c1)OCOC 5b91874ca3295ec1f6368fa2e0d4d4f1 [0,2,0,0,0,0|1,0,0]=3 6160 B12R1.382 CCc1cccc(c1)OCSC eefd14da38fc878461191fa86c92e33e [0,2,0,0,0,0|1,1,0]=4 6161 B12R1.382 CCc1cccc(n1)NCOC 0f6570930b35a7dc448bf8940c1af5bc [0,2,0,0,0,0|2,0,0]=4 6162 B12R1.382 CCc1ccnc(c1)NCOC 48da6ec157c4dfdc4b3a216ec6c5f156 [0,2,0,0,0,0|2,0,0]=4 6163 B12R1.382 CCc1cncc(c1)NCOC eed3f75c6eb34d236882eddc6a4eef63 [0,2,0,0,0,0|2,0,0]=4 6164 B12R1.382 CCc1cncc(c1)OCOC 5ed4a41610b11b15054f8c2eb20e27e2 [0,2,0,0,0,0|2,0,0]=4 6165 B12R1.382 COCNc1cc(ccn1)C#N dc3a242f7e6e3b9797b28bd35b15d2df [0,2,0,0,0,0|2,0,0]=4 6166 B12R1.382 COCNc1cc(ccn1)CCl 38792bb7b636f8fa36504f43aefe2618 [0,2,0,0,0,0|2,0,0]=4 6167 B12R1.382 COCNc1cc(ccn1)CO ad8fc3768f8c3a8829d2ca4700698ae7 [0,2,0,0,0,0|2,0,0]=4 6168 B12R1.382 COCNc1cc(ccn1)OC 07bcf326a8fefecfae046ae0963192fb [0,2,0,0,0,0|2,0,0]=4 6169 B12R1.382 COCNc1cccc(c1)C#N 52d599ff4deed8de92797172e4ea1db6 [0,2,0,0,0,0|1,0,0]=3 6170 B12R1.382 COCNc1cccc(c1)CBr 1587e69387c71ed7468a3a7ad01f06e4 [0,2,0,0,0,0|1,0,0]=3 6171 B12R1.382 COCNc1cccc(c1)CF 46f8bcdbd1572a40743928231bf6041e [0,2,0,0,0,0|1,0,0]=3 6172 B12R1.382 COCNc1cccc(c1)CO cd7cf88cab2a39cc07ac14daa3704847 [0,2,0,0,0,0|1,0,0]=3 6173 B12R1.382 COCNc1cccc(c1)OC 7d43fcca4f8c1b3fe4407ce26664dc9b [0,2,0,0,0,0|1,0,0]=3 6174 B12R1.382 COCNc1cccc(c1)SC df130763c9beed8041729f7a0bacdeab [0,2,0,0,0,0|1,0,0]=3 6175 B12R1.382 COCNc1cccc(n1)C#N 5d03127b7636caf03ccf8920975b5b0b [0,2,0,0,0,0|2,0,0]=4 6176 B12R1.382 COCNc1cccc(n1)C=O cb95b41990cc7daee1b93f0be117adcf [0,2,0,0,0,0|2,0,0]=4 6177 B12R1.382 COCNc1cccc(n1)CO 123c490790a82f4fbe90b0b6d025ab75 [0,2,0,0,0,0|2,0,0]=4 6178 B12R1.382 COCNc1cccc(n1)OC 26f767b3119f32cfbe7faa29537b25ac [0,2,0,0,0,0|2,0,0]=4 6179 B12R1.382 COCNc1cccc(n1)SC 55ed88dacdf68a1049db1d14455215a3 [0,2,0,0,0,0|2,0,0]=4 6180 B12R1.382 COCNc1ccnc(c1)C#N 8757d41eb8feb6bc968f0bed2f29be49 [0,2,0,0,0,0|2,0,0]=4 6181 B12R1.382 COCNc1ccnc(c1)CO e5d563a0af853d956d42cbdecdcc93c9 [0,2,0,0,0,0|2,0,0]=4 6182 B12R1.382 COCNc1ccnc(c1)OC f27dc4f311435dbd5d62ffeee34ab7dc [0,2,0,0,0,0|2,0,0]=4 6183 B12R1.382 COCNc1ccnc(c1)SC 9ed0afd3d6e1972dfaddbfdf5e2ea5d4 [0,2,0,0,0,0|2,0,0]=4 6184 B12R1.382 COCNc1cncc(c1)C#N 7b80d0ce40a908184fccd4c272c6fb8d [0,2,0,0,0,0|2,0,0]=4 6185 B12R1.382 COCNc1cncc(c1)CCl b777d6f7b6d15c15f0dd0bcd5dbd7674 [0,2,0,0,0,0|2,0,0]=4 6186 B12R1.382 COCNc1cncc(c1)CO 380c356f3450d96b4d5652701e661c46 [0,2,0,0,0,0|2,0,0]=4 6187 B12R1.382 COCNc1cncc(c1)OC a9f0614fd1b0373766b4b440f6e553e0 [0,2,0,0,0,0|2,0,0]=4 6188 B12R1.382 COCOc1cc(ccn1)C#N f28710222d940cdd9b6a3ba65d0e07ca [0,2,0,0,0,0|2,0,0]=4 6189 B12R1.382 COCOc1cc(ccn1)C=O 66fa1321f013a198d4f3a14d43f977d5 [0,2,0,0,0,0|2,0,0]=4 6190 B12R1.382 COCOc1cc(ccn1)OC 157fe9d033e84de334b1b1085a4cc8cd [0,2,0,0,0,0|2,0,0]=4 6191 B12R1.382 COCOc1cccc(c1)C#N e2e30a2c32ff0542f281cdb922732468 [0,2,0,0,0,0|1,0,0]=3 6192 B12R1.382 COCOc1cccc(c1)C=O 5074b96e45484625057f70042708e203 [0,2,0,0,0,0|1,0,0]=3 6193 B12R1.382 COCOc1cccc(c1)OC dfbbb1686556705bf6dcd9f552619401 [0,2,0,0,0,0|1,0,0]=3 6194 B12R1.382 COCOc1cccc(c1)SC c1e6134946a42854ef52cb2d9ca3ebc6 [0,2,0,0,0,0|1,0,0]=3 6195 B12R1.382 COCOc1cccc(n1)C#N 28c61d6a97c66572bb20f454cc8a8743 [0,2,0,0,0,0|2,0,0]=4 6196 B12R1.382 COCOc1ccnc(c1)C#N 6ad1a22dc1cbc29d56f03a3646f3845a [0,2,0,0,0,0|2,0,0]=4 6197 B12R1.382 COCOc1ccnc(c1)OC 52ef1ca1accfe42c75b4484cc286e72a [0,2,0,0,0,0|2,0,0]=4 6198 B12R1.382 COCOc1ccnc(c1)SC 98fc974afff5e3d71e890fbd7d60e449 [0,2,0,0,0,0|2,0,0]=4 6199 B12R1.382 COCOc1cncc(c1)C#N 88a94aa3d9f9b5749e086d7fc522923c [0,2,0,0,0,0|2,0,0]=4 6200 B12R1.382 COCOc1cncc(c1)C=O 61a3fba52ecb35fb18cc8dd26b80aed3 [0,2,0,0,0,0|2,0,0]=4 6201 B12R1.382 COCOc1cncc(c1)OC 4c1efefa9ad67f28e2131cbdf048fb37 [0,2,0,0,0,0|2,0,0]=4 6202 B12R1.382 COCOc1cncc(c1)SC 9f5bb6f2dc760e8075bf6d77fc2427a8 [0,2,0,0,0,0|2,0,0]=4 6203 B12R1.382 COc1cccc(c1)NCSC da6189c23e534486efb2e03bd7ec59dd [0,2,0,0,0,0|1,1,0]=4 6204 B12R1.382 COc1cccc(c1)OCSC 11f6a9cad0d226b3fdf31452b8fabb39 [0,2,0,0,0,0|1,1,0]=4 6205 B12R1.382 CSCNc1cccc(c1)C#N 4237ff8b37f1412af5728725518399bb [0,2,0,0,0,0|1,1,0]=4 6206 B12R1.382 CSCNc1cccc(c1)CBr 341e9082e4c2f633670e1b448e96fbd6 [0,2,0,0,0,0|1,1,0]=4 6207 B12R1.382 CSCNc1cccc(c1)CF 283a3add539936498b283ec0cc9403b0 [0,2,0,0,0,0|1,1,0]=4 6208 B12R1.382 CSCNc1cccc(c1)CO dbf0174919471cd2252a344f9b7be5db [0,2,0,0,0,0|1,1,0]=4 6209 B12R1.382 CSCNc1cccc(c1)SC 617e75e818013ef2b17f993de22fd22f [0,2,0,0,0,0|1,1,0]=4 6210 B12R1.382 CSCOc1cccc(c1)C#N 1c547660a593914c50918fe59d22f4ec [0,2,0,0,0,0|1,1,0]=4 6211 B12R1.382 CSCOc1cccc(c1)C=O 6c497b7a4bcd038761dfbc473fb468b0 [0,2,0,0,0,0|1,1,0]=4 6212 B12R1.382 CSCOc1cccc(c1)SC 9d9582222efc6659b267b8cf7a940cc6 [0,2,0,0,0,0|1,1,0]=4 6213 B12R1.8 BrCCNCCc1ccccc1 44438bbdc203ba2a96e00daceba19cdb [0,2,0,0,0,0|1,0,0]=3 6214 B12R1.8 BrCCNCCc1ccccn1 9a06bde2821ec808c3f7baa49dbbb136 [0,2,0,0,0,0|2,0,0]=4 6215 B12R1.8 BrCCNCCc1cccnc1 d7f4e91980611b9c6a9d67fde3f5b289 [0,2,0,0,0,0|2,0,0]=4 6216 B12R1.8 BrCCNCCc1ccncc1 ba1243a8e4e9a5eab4ccd20a3c98cc85 [0,2,0,0,0,0|2,0,0]=4 6217 B12R1.8 BrCCNCSc1ccccc1 b2e3f633ef77399c1c780c49854458d2 [0,2,0,0,0,0|2,0,0]=4 6218 B12R1.8 C#CCCCNc1ccccc1 74fc175421dbc3b424699e770c0c2fc6 [0,2,0,0,0,0|1,0,1]=4 6219 B12R1.8 C#CCCNCc1ccccc1 9efcf95ab875a3743cf2704fb10ab2d7 [0,2,0,0,0,0|1,0,1]=4 6220 B12R1.8 C#CCCOCc1ccccc1 97bbe114df19205ca39f984806a809da [0,2,0,0,0,0|1,0,1]=4 6221 B12R1.8 C#CCNCCc1ccccc1 92e5ef2f7dd8ca50296fc5c10a5e2140 [0,2,0,0,0,0|1,0,0]=3 6222 B12R1.8 C#CCNCCc1ccccn1 e1cf6dd033aadde6da07434202745395 [0,2,0,0,0,0|2,0,0]=4 6223 B12R1.8 C#CCNCCc1cccnc1 e60b4d1abf32bb9fd8746da8f436489d [0,2,0,0,0,0|2,0,0]=4 6224 B12R1.8 C#CCNCCc1ccncc1 c64471921438c4519b11dff9e39caf1f [0,2,0,0,0,0|2,0,0]=4 6225 B12R1.8 C#CCOCCc1ccccc1 1e82b640f7f45e3a6d3d3fcd5bd127f6 [0,2,0,0,0,0|0,0,0]=2 6226 B12R1.8 C#CCOCCc1ccccn1 9893f75bd965843947744e3b27cc7da1 [0,2,0,0,0,0|1,0,0]=3 6227 B12R1.8 C#CCOCCc1cccnc1 d7ccc976f9d62df6e2aab2082fe6ddfb [0,2,0,0,0,0|1,0,0]=3 6228 B12R1.8 C#CCOCCc1ccncc1 5e03604e158db99f11ef01f90386ed59 [0,2,0,0,0,0|1,0,0]=3 6229 B12R1.8 C#CCOCCc1ccncn1 87b3a8a13c87a922e679fc14528dff24 [0,2,0,0,0,0|2,0,0]=4 6230 B12R1.8 C#CCOCCc1cnccn1 c48b6a2cc36801d1d3d27a27fcc9f75d [0,2,0,0,0,0|2,0,0]=4 6231 B12R1.8 C#CCOCCc1cncnc1 d6ee84e9d55feaef049ed9eb0f120123 [0,2,0,0,0,0|2,0,0]=4 6232 B12R1.8 C#CCOCCc1ncccn1 a4d7a429f2d51d242dad9b390799705a [0,2,0,0,0,0|2,0,0]=4 6233 B12R1.8 C/C=C/CNCc1ccccc1 696910dabaeed0573317ce9dc7d987f1 [0,2,0,0,0,0|1,0,0]=3 6234 B12R1.8 C/C=C/CNCc1ccccn1 65bbf7422c72780ea452fbab5779da40 [0,2,0,0,0,0|2,0,0]=4 6235 B12R1.8 C/C=C/CNCc1cccnc1 b511eecbf879219de16aab9d10bab88f [0,2,0,0,0,0|2,0,0]=4 6236 B12R1.8 C/C=C/CNCc1ccncc1 c05a4fe8f53f1e0fb0df097dba65e4f0 [0,2,0,0,0,0|2,0,0]=4 6237 B12R1.8 C/C=C/COCc1ccccc1 bedaf623f7df2efe6975ff88cd723c7c [0,2,0,0,0,0|1,0,0]=3 6238 B12R1.8 C/C=C/COCc1ccccn1 c318922f83e5d7127687e5bc80479da0 [0,2,0,0,0,0|2,0,0]=4 6239 B12R1.8 C/C=C/COCc1cccnc1 3904bcc1beac04d1910ece31bfb74cfd [0,2,0,0,0,0|2,0,0]=4 6240 B12R1.8 C/C=C/COCc1ccncc1 618449254ded2bf4d640e33d4387e335 [0,2,0,0,0,0|2,0,0]=4 6241 B12R1.8 C/C=C\CNCc1ccccc1 fd8d6b82f6381d759806df05cfd6b008 [0,2,0,0,0,0|1,0,0]=3 6242 B12R1.8 C/C=C\CNCc1ccccn1 410751982b21beea4a6a179c42faf08f [0,2,0,0,0,0|2,0,0]=4 6243 B12R1.8 C/C=C\CNCc1cccnc1 3c6555ad1f6c7de1cd594bc8f511bab7 [0,2,0,0,0,0|2,0,0]=4 6244 B12R1.8 C/C=C\CNCc1ccncc1 46618b5aa25fbdd3b5ce2777916da134 [0,2,0,0,0,0|2,0,0]=4 6245 B12R1.8 C/C=C\COCc1ccccc1 bb9ff25480a2f7ddd7050e8b042c0009 [0,2,0,0,0,0|1,0,0]=3 6246 B12R1.8 C/C=C\COCc1ccccn1 6d3bdb5e61e8c1aff7e72df2faab90c1 [0,2,0,0,0,0|2,0,0]=4 6247 B12R1.8 C/C=C\COCc1cccnc1 d6bd296a3be9f946635bf2d657e7a37e [0,2,0,0,0,0|2,0,0]=4 6248 B12R1.8 C/C=C\COCc1ccncc1 4cf574d2fddab5c2b11afa63cf997593 [0,2,0,0,0,0|2,0,0]=4 6249 B12R1.8 C=CCCCNc1ccccc1 1d0bca19d381bcc4d59024edc1b06712 [0,2,0,0,0,0|1,0,1]=4 6250 B12R1.8 C=CCCNCc1ccccc1 7be44c4294c0af7fca2ca0fbee344b88 [0,2,0,0,0,0|1,0,1]=4 6251 B12R1.8 C=CCCOCc1ccccc1 000cda704ecf3c98644bbc2e7f9bf607 [0,2,0,0,0,0|1,0,1]=4 6252 B12R1.8 C=CCNCCc1ccccc1 e4db187976e48a8658dbc174b43f52d7 [0,2,0,0,0,0|1,0,0]=3 6253 B12R1.8 C=CCNCCc1ccccn1 550ce1388b16ef35cb65525117331fc9 [0,2,0,0,0,0|2,0,0]=4 6254 B12R1.8 C=CCNCCc1cccnc1 f98eee683f799eff06b2337ea980f7f3 [0,2,0,0,0,0|2,0,0]=4 6255 B12R1.8 C=CCNCCc1ccncc1 ad6c7a7cf72d4cce0392e7cb64360c80 [0,2,0,0,0,0|2,0,0]=4 6256 B12R1.8 C=CCOCCc1ccccc1 173678d3e3d21c00d8c7f5a8565ba584 [0,2,0,0,0,0|0,0,0]=2 6257 B12R1.8 C=CCOCCc1ccccn1 28adb9ab585b603d110dbc02f096f29c [0,2,0,0,0,0|1,0,0]=3 6258 B12R1.8 C=CCOCCc1cccnc1 317fc51bbefe02d6eba4d9c58adb99c3 [0,2,0,0,0,0|1,0,0]=3 6259 B12R1.8 C=CCOCCc1ccncc1 168fd21bb8ad1506f0ade4f0cca9b157 [0,2,0,0,0,0|1,0,0]=3 6260 B12R1.8 C=CCOCCc1ccncn1 3601f2d70ede18d72f99dfee8d5e326c [0,2,0,0,0,0|2,0,0]=4 6261 B12R1.8 C=CCOCCc1cnccn1 48677f9500929073e7f80e4a5af2e579 [0,2,0,0,0,0|2,0,0]=4 6262 B12R1.8 C=CCOCCc1cncnc1 994dc0d675779422ac6572cd2e059f92 [0,2,0,0,0,0|2,0,0]=4 6263 B12R1.8 C=CCOCCc1ncccn1 4c2b75a29ef54d4e86e249391fec465c [0,2,0,0,0,0|2,0,0]=4 6264 B12R1.8 C=COCCNc1ccccc1 3a1f98f63177a0d5afcfdcd488fa8e7f [0,2,0,0,0,0|0,0,1]=3 6265 B12R1.8 C=COCCNc1ccccn1 d058c97108c98511d70ae23f12f7359e [0,2,0,0,0,0|1,0,1]=4 6266 B12R1.8 C=COCCNc1cccnc1 b34671aad62ff8e345a45320b03e3aba [0,2,0,0,0,0|1,0,1]=4 6267 B12R1.8 C=COCCNc1ccncc1 fa29dcc6bd1fa99630ee792625ae4d48 [0,2,0,0,0,0|1,0,1]=4 6268 B12R1.8 CC#CCNCc1ccccc1 8c1f08f42380d385ee55fb616f0806b5 [0,2,0,0,0,0|1,0,0]=3 6269 B12R1.8 CC#CCNCc1ccccn1 8a8af7603e8e7a621462b7ac30be28b6 [0,2,0,0,0,0|2,0,0]=4 6270 B12R1.8 CC#CCNCc1cccnc1 339d3959f81f44e4b3a38752d07e62d2 [0,2,0,0,0,0|2,0,0]=4 6271 B12R1.8 CC#CCOCc1ccccc1 2b91241b0f7d27af23601ef3b65fea8e [0,2,0,0,0,0|1,0,0]=3 6272 B12R1.8 CC#CCOCc1ccccn1 04d64074535ea808a208cc29a543808a [0,2,0,0,0,0|2,0,0]=4 6273 B12R1.8 CC#CCOCc1cccnc1 7f6d94dcac7e746c80215571270d31ac [0,2,0,0,0,0|2,0,0]=4 6274 B12R1.8 CC/C=C/CNc1ccccc1 ae4615a47949f31d5764aa26c0be3c5c [0,2,0,0,0,0|1,0,1]=4 6275 B12R1.8 CC=CCNCc1ccccc1 ccb966671e75f827f9356a0f248353fa [0,2,0,0,0,0|1,0,0]=3 6276 B12R1.8 CC=CCNCc1ccccn1 52a404d965cda1a058976d3644d6610b [0,2,0,0,0,0|2,0,0]=4 6277 B12R1.8 CC=CCNCc1cccnc1 fd1dd231ecd09d84c8e61446b852d10b [0,2,0,0,0,0|2,0,0]=4 6278 B12R1.8 CC=CCOCc1ccccc1 dcaa6de30aada804690dc36fa942dd3d [0,2,0,0,0,0|1,0,0]=3 6279 B12R1.8 CC=CCOCc1ccccn1 01d3b11f6fb9777af0814506ac5db2f3 [0,2,0,0,0,0|2,0,0]=4 6280 B12R1.8 CC=CCOCc1cccnc1 d8e42da77c7f45a2d209d19bdf8b236a [0,2,0,0,0,0|2,0,0]=4 6281 B12R1.8 CCCCCNc1ccccc1 91c03911249f1a729a636c2485e854e3 [0,2,0,0,0,0|1,0,0]=3 6282 B12R1.8 CCCCCNc1ccccn1 585f24212680e3bfc425e0aec0b439c2 [0,2,0,0,0,0|2,0,0]=4 6283 B12R1.8 CCCCCNc1cccnc1 5fa826aa2d84f836457483e84a27413b [0,2,0,0,0,0|2,0,0]=4 6284 B12R1.8 CCCCCNc1ccncc1 c8c0d07b57d58f944b73cd42db77f640 [0,2,0,0,0,0|2,0,0]=4 6285 B12R1.8 CCCCCOc1ccccn1 c51e7a702fec97dea4ed5e55e57ef936 [0,2,0,0,0,0|2,0,0]=4 6286 B12R1.8 CCCCCOc1cccnc1 42835187bb2a96f147e75f8d7bf5c0be [0,2,0,0,0,0|2,0,0]=4 6287 B12R1.8 CCCCCOc1ccncc1 3d667a33e0f6f9349f26cd5c20bf8187 [0,2,0,0,0,0|2,0,0]=4 6288 B12R1.8 CCCCNCc1ccccc1 0ab7d34979c69bc4acd6ef46bb666f9a [0,2,0,0,0,0|1,0,0]=3 6289 B12R1.8 CCCCNCc1ccccn1 1dacaf15214ef41cb3c2f1c9818fbd94 [0,2,0,0,0,0|2,0,0]=4 6290 B12R1.8 CCCCNCc1cccnc1 f62a7991eabce63e2457be2a93ae29e8 [0,2,0,0,0,0|2,0,0]=4 6291 B12R1.8 CCCCNCc1ccncc1 d7fdf09c2c934be58dbd6e9ec30494ab [0,2,0,0,0,0|2,0,0]=4 6292 B12R1.8 CCCCOCc1ccccc1 e7a2ea9d8e76018a19cac6b1863869f7 [0,2,0,0,0,0|1,0,0]=3 6293 B12R1.8 CCCCOCc1ccccn1 bdbee8dba51183bb4dac05ec623e6fd7 [0,2,0,0,0,0|2,0,0]=4 6294 B12R1.8 CCCCOCc1cccnc1 e919bcaf101899d0377d8f05c8edc329 [0,2,0,0,0,0|2,0,0]=4 6295 B12R1.8 CCCCOCc1ccncc1 5c9bdd1b1ccd1eb8838682c13573b707 [0,2,0,0,0,0|2,0,0]=4 6296 B12R1.8 CCCNCCc1ccccc1 de4634a5b10be0583379bf36a55fd975 [0,2,0,0,0,0|1,0,0]=3 6297 B12R1.8 CCCNCCc1ccccn1 db4179a8136b988593f56bef0e41421d [0,2,0,0,0,0|2,0,0]=4 6298 B12R1.8 CCCNCCc1cccnc1 1e462df2b0ae672e64302eccd1ccbf55 [0,2,0,0,0,0|2,0,0]=4 6299 B12R1.8 CCCNCCc1ccncc1 75fa7087d9d322d4fb962981385838e0 [0,2,0,0,0,0|2,0,0]=4 6300 B12R1.8 CCCOCCc1ccccc1 6ff048bac0fc069e37a7f6359e53917a [0,2,0,0,0,0|0,0,0]=2 6301 B12R1.8 CCCOCCc1ccccn1 495b2e5857432868e8dc4db07751a420 [0,2,0,0,0,0|1,0,0]=3 6302 B12R1.8 CCCOCCc1cccnc1 04113a7c0c0fc7a249f8441dcdeb4b99 [0,2,0,0,0,0|1,0,0]=3 6303 B12R1.8 CCCOCCc1ccncc1 528887ae5600fb3f47428d9b5b2b2fc5 [0,2,0,0,0,0|1,0,0]=3 6304 B12R1.8 CCCOCCc1ccncn1 72928c6fa0d97cd8b24b7c5567183baa [0,2,0,0,0,0|2,0,0]=4 6305 B12R1.8 CCCOCCc1cnccn1 00b7a2df7c13ee5b18982acf7edc2094 [0,2,0,0,0,0|2,0,0]=4 6306 B12R1.8 CCCOCCc1cncnc1 353c17e7bf9336b34e387d6c94e762da [0,2,0,0,0,0|2,0,0]=4 6307 B12R1.8 CCCOCCc1ncccn1 85b59f6e28cb48774a8562b89a016222 [0,2,0,0,0,0|2,0,0]=4 6308 B12R1.8 CCNC/C=C/c1ccccc1 c4e37c1c9c7a04432ce233e4ac762fd0 [0,2,0,0,0,0|1,0,1]=4 6309 B12R1.8 CCNCCCc1ccccc1 b7715a69dd85035a729bcc3298689ab5 [0,2,0,0,0,0|1,0,0]=3 6310 B12R1.8 CCNCCCc1ccccn1 048a807537b42fb54187509210f6e12c [0,2,0,0,0,0|2,0,0]=4 6311 B12R1.8 CCNCCCc1cccnc1 3373f8695160430ad61e1df554bf48e4 [0,2,0,0,0,0|2,0,0]=4 6312 B12R1.8 CCNCCCc1ccncc1 1312ae4c95d1a1c5d3e95a7869565a5a [0,2,0,0,0,0|2,0,0]=4 6313 B12R1.8 CCNCCOc1ccccc1 d5ddae3ded59ed35e9c0403b52d833f2 [0,2,0,0,0,0|1,0,0]=3 6314 B12R1.8 CCNCCOc1ccccn1 f517badbab06764c0d778d5166959ef7 [0,2,0,0,0,0|2,0,0]=4 6315 B12R1.8 CCNCCOc1cccnc1 adb1131ba5508d4c001efaf388a270f7 [0,2,0,0,0,0|2,0,0]=4 6316 B12R1.8 CCOC/C=C/c1ccccc1 6f0f2808fd7750fbafef94eda36a57cc [0,2,0,0,0,0|0,0,1]=3 6317 B12R1.8 CCOC/C=C/c1ccccn1 cae7eddd94e24a2fc38c25988d14a995 [0,2,0,0,0,0|1,0,1]=4 6318 B12R1.8 CCOC/C=C/c1cccnc1 88b23bea7e643597f969c1228e1a54be [0,2,0,0,0,0|1,0,1]=4 6319 B12R1.8 CCOC/C=C/c1ccncc1 a85220369c0857cf467a9814f9c2b138 [0,2,0,0,0,0|1,0,1]=4 6320 B12R1.8 CCOC/C=C\c1ccccc1 718b8db828f50aaf9df65554f6d18358 [0,2,0,0,0,0|0,0,1]=3 6321 B12R1.8 CCOC/C=C\c1ccncc1 2f796047611b5751847f128bf590337a [0,2,0,0,0,0|1,0,1]=4 6322 B12R1.8 CCOCC#Cc1ccccc1 a3a92c3f297e8d8da3f37815c5bdf50e [0,2,0,0,0,0|0,0,1]=3 6323 B12R1.8 CCOCC#Cc1ccccn1 d099d7fcee7b6f886602239aa2c8b779 [0,2,0,0,0,0|1,0,1]=4 6324 B12R1.8 CCOCC#Cc1cccnc1 c14db000c7f939744ecf27b0d65d09ff [0,2,0,0,0,0|1,0,1]=4 6325 B12R1.8 CCOCC#Cc1ccncc1 0d84f352276abf4a38b15ca4944b7366 [0,2,0,0,0,0|1,0,1]=4 6326 B12R1.8 CCOCC=Cc1ccccc1 ea6af70ca1c55ffae7ca4fca9bfef55c [0,2,0,0,0,0|0,0,1]=3 6327 B12R1.8 CCOCC=Cc1ccncc1 44591ab096d4482fa48976b72a312de8 [0,2,0,0,0,0|1,0,1]=4 6328 B12R1.8 CCOCCCC1=CCC=CC1 c736e524db2f6bc6d387404d01ab523e [0,2,0,0,0,0|0,0,2]=4 6329 B12R1.8 CCOCCCc1ccccc1 95c4d5e38aabc377fa248d955f0dc679 [0,2,0,0,0,0|0,0,0]=2 6330 B12R1.8 CCOCCCc1ccccn1 859085eeaedc4a3c650b307e46d76a73 [0,2,0,0,0,0|1,0,0]=3 6331 B12R1.8 CCOCCCc1cccnc1 5173637fbf4b8276cf79cd9d0837d422 [0,2,0,0,0,0|1,0,0]=3 6332 B12R1.8 CCOCCCc1ccncc1 48fe4d63de940c0c26169b537e6586f9 [0,2,0,0,0,0|1,0,0]=3 6333 B12R1.8 CCOCCCc1cnccn1 96377e577044f54d4eefcfd8ca347005 [0,2,0,0,0,0|2,0,0]=4 6334 B12R1.8 CCOCCCc1ncccn1 91b7e5dbb1003691bde7168b7868a4b2 [0,2,0,0,0,0|2,0,0]=4 6335 B12R1.8 CCOCCNc1ccccc1 d4241708f39fbdf3b0b47b3411df7d4e [0,2,0,0,0,0|0,0,0]=2 6336 B12R1.8 CCOCCNc1ccccn1 c924cdaad90ee79ffea92abd5325e8fd [0,2,0,0,0,0|1,0,0]=3 6337 B12R1.8 CCOCCNc1cccnc1 1e5823b67f834b1b6e334c78d0ca748a [0,2,0,0,0,0|1,0,0]=3 6338 B12R1.8 CCOCCNc1cccnn1 6e0438c3ae5589ce67ed194d095dd8ed [0,2,0,0,0,0|2,0,0]=4 6339 B12R1.8 CCOCCNc1ccncc1 260b7c9e21e5dbc4931cda801e5b3f25 [0,2,0,0,0,0|1,0,0]=3 6340 B12R1.8 CCOCCNc1ccncn1 cf3f60ddf1ebcd296dc9bfa8dbb85a0b [0,2,0,0,0,0|2,0,0]=4 6341 B12R1.8 CCOCCNc1ccnnc1 707bbef2fef48620dace715dbab76bdf [0,2,0,0,0,0|2,0,0]=4 6342 B12R1.8 CCOCCNc1cnccn1 7a3dbea716592a3e2f32a8bc18b0e703 [0,2,0,0,0,0|2,0,0]=4 6343 B12R1.8 CCOCCNc1cncnc1 6349642c45d677d1d12c619b7248f339 [0,2,0,0,0,0|2,0,0]=4 6344 B12R1.8 CCOCCNc1ncccn1 f2cb7c887ea1a94a935bae6f924c81e6 [0,2,0,0,0,0|2,0,0]=4 6345 B12R1.8 CCOCCOc1ccccc1 7cc50880b35d5d523b8ebe021571ca68 [0,2,0,0,0,0|0,0,0]=2 6346 B12R1.8 CCOCCOc1ccccn1 f5da0aa9fa2ad7dc4a95c1eb6c04963e [0,2,0,0,0,0|1,0,0]=3 6347 B12R1.8 CCOCCOc1cccnc1 90da2abbb29c3a2804fd3529fe27903c [0,2,0,0,0,0|1,0,0]=3 6348 B12R1.8 CCOCCOc1ccncc1 58cc63725af75927174d6514028cc9ba [0,2,0,0,0,0|1,0,0]=3 6349 B12R1.8 CCOCCOc1ccnnc1 51257613ba28cb78ce5293f9f40aabbf [0,2,0,0,0,0|2,0,0]=4 6350 B12R1.8 CCOCCOc1cnccn1 d992c38f9e68fc07ae1eee251c5f42fe [0,2,0,0,0,0|2,0,0]=4 6351 B12R1.8 CCOCCOc1cncnc1 c30bb9e933741dcce2b41f650c5ee1f7 [0,2,0,0,0,0|2,0,0]=4 6352 B12R1.8 CCOCCOc1ncccn1 e689ee34ee6845bb24cf93548264b2e7 [0,2,0,0,0,0|2,0,0]=4 6353 B12R1.8 CCOCCSc1ccccc1 673ed7aececbd7276e2d946a99a864ba [0,2,0,0,0,0|0,0,0]=2 6354 B12R1.8 CCOCCSc1ccccn1 39f6195046a78c2bf820f28d6480fc87 [0,2,0,0,0,0|1,0,0]=3 6355 B12R1.8 CCOCNCc1ccccc1 ad1ac49e8362d6c3a7ef7f4bc168f4ac [0,2,0,0,0,0|0,0,0]=2 6356 B12R1.8 CCOCNCc1ccccn1 ee5ecc87187447710671c4e404ab5d67 [0,2,0,0,0,0|1,0,0]=3 6357 B12R1.8 CCOCNCc1cccnc1 77dc363b01d495a6518051d104958a2f [0,2,0,0,0,0|1,0,0]=3 6358 B12R1.8 CCOCNCc1cccnn1 ceaf7071dbc13f3f22d89fcf44347a7f [0,2,0,0,0,0|2,0,0]=4 6359 B12R1.8 CCOCNCc1ccncc1 030d2e2cead04e3196eb6c2ccd092890 [0,2,0,0,0,0|1,0,0]=3 6360 B12R1.8 CCOCNCc1ccncn1 b4cdb03b996166d4cdfca3eb0ed14ad5 [0,2,0,0,0,0|2,0,0]=4 6361 B12R1.8 CCOCNCc1ccnnc1 f494f0ff1ba354d01faf7735f37e8f40 [0,2,0,0,0,0|2,0,0]=4 6362 B12R1.8 CCOCNCc1cnccn1 ce2ae80bcbedd3c655264d5e80cfb517 [0,2,0,0,0,0|2,0,0]=4 6363 B12R1.8 CCOCNCc1ncccn1 4f5a83040c005533fe5709e2b55783f9 [0,2,0,0,0,0|2,0,0]=4 6364 B12R1.8 CCOCOCc1ccccn1 14f99fa0e6d24bdb50dcb8c7585da890 [0,2,0,0,0,0|1,0,0]=3 6365 B12R1.8 CCOCOCc1cccnn1 29e61339796337936c01d738db3a854b [0,2,0,0,0,0|2,0,0]=4 6366 B12R1.8 CCOCOCc1ccncn1 5011fe252b8e59d8a7e664705a511c68 [0,2,0,0,0,0|2,0,0]=4 6367 B12R1.8 CCOCOCc1ccnnc1 b779abe03285be9c6b23e65a635a19d1 [0,2,0,0,0,0|2,0,0]=4 6368 B12R1.8 CCOCOCc1ncccn1 d4558727a8361d465bbd3aba4eb55245 [0,2,0,0,0,0|2,0,0]=4 6369 B12R1.8 CCSCCNc1ccccc1 3aa28a6af03561c4dff60fa2d0f2630b [0,2,0,0,0,0|0,1,0]=3 6370 B12R1.8 CCSCCNc1ccccn1 9ac125fe19f7981ccaa6c3050039d522 [0,2,0,0,0,0|1,1,0]=4 6371 B12R1.8 CCSCCNc1cccnc1 a626c8afe0b69622b1713a0faff348bc [0,2,0,0,0,0|1,1,0]=4 6372 B12R1.8 CCSCCNc1ccncc1 c0b412122d4dc80e66e392673c31ad9c [0,2,0,0,0,0|1,1,0]=4 6373 B12R1.8 CCSCCOc1ccccn1 fb856e4b8d5fc3246866ee7d11418749 [0,2,0,0,0,0|1,1,0]=4 6374 B12R1.8 CCSCCOc1cccnc1 7a1b433bc628cddad8cf57c9341a16cf [0,2,0,0,0,0|1,1,0]=4 6375 B12R1.8 CCSCCOc1ccncc1 39d2441591cd99866c275069dfb9b929 [0,2,0,0,0,0|1,1,0]=4 6376 B12R1.8 COCCCNc1ccccc1 3df3fc4fbaedb1dd760b4a37be035630 [0,2,0,0,0,0|0,0,0]=2 6377 B12R1.8 COCCCNc1ccccn1 b3704682ea886739d8d3ef30bc747ee7 [0,2,0,0,0,0|1,0,0]=3 6378 B12R1.8 COCCCNc1cccnc1 f137f9251ed366e53ff206e14110778d [0,2,0,0,0,0|1,0,0]=3 6379 B12R1.8 COCCCNc1cccnn1 0867dbc8a1e919f5687237df8b00ee39 [0,2,0,0,0,0|2,0,0]=4 6380 B12R1.8 COCCCNc1ccncc1 c41a6489b75ed922ab6364283a988c83 [0,2,0,0,0,0|1,0,0]=3 6381 B12R1.8 COCCCNc1ccncn1 23de1961866255004167f81da3017c08 [0,2,0,0,0,0|2,0,0]=4 6382 B12R1.8 COCCCNc1ccnnc1 482d48d22282b092d142b326295e5759 [0,2,0,0,0,0|2,0,0]=4 6383 B12R1.8 COCCCNc1cnccn1 90e3e9e86ab90ed9e921777b834fa746 [0,2,0,0,0,0|2,0,0]=4 6384 B12R1.8 COCCCNc1cncnc1 7ce6f66e60b032ca0a02dd16d577dba6 [0,2,0,0,0,0|2,0,0]=4 6385 B12R1.8 COCCCNc1ncccn1 480c5a81b857b38c618cd05b3f52a0d1 [0,2,0,0,0,0|2,0,0]=4 6386 B12R1.8 COCCCOc1ccccn1 43bfda6a85c42f66b9ce84c1adba5682 [0,2,0,0,0,0|1,0,0]=3 6387 B12R1.8 COCCCOc1cccnc1 ec958672fe26ba1a178ae65969d24489 [0,2,0,0,0,0|1,0,0]=3 6388 B12R1.8 COCCCOc1ccncc1 e5daa8a0ea56b79b7618cce89f1cbf45 [0,2,0,0,0,0|1,0,0]=3 6389 B12R1.8 COCCCOc1ccnnc1 de835978fbdf9eda775885fc2041c619 [0,2,0,0,0,0|2,0,0]=4 6390 B12R1.8 COCCCOc1cnccn1 4f95f96243168ed43dbf37c4d9fe539d [0,2,0,0,0,0|2,0,0]=4 6391 B12R1.8 COCCCOc1cncnc1 c2af0f3c2761f8294132e0cfd27af0ba [0,2,0,0,0,0|2,0,0]=4 6392 B12R1.8 COCCCOc1ncccn1 d66ba8a7816f55b7cd98f4a77a3b6b45 [0,2,0,0,0,0|2,0,0]=4 6393 B12R1.8 COCCNCc1ccccc1 8a36d3044a8140246d8590cb65467526 [0,2,0,0,0,0|0,0,0]=2 6394 B12R1.8 COCCNCc1ccccn1 3f19c45c0ff011efc1b5c3ee20b6b35e [0,2,0,0,0,0|1,0,0]=3 6395 B12R1.8 COCCNCc1cccnc1 daeeb1b2dd3039141ded10f95692d744 [0,2,0,0,0,0|1,0,0]=3 6396 B12R1.8 COCCNCc1cccnn1 a3daf10b8adf2cf4d79827dc7ea4a6f3 [0,2,0,0,0,0|2,0,0]=4 6397 B12R1.8 COCCNCc1ccncc1 92207752fd88ce5ce5c8380c92f4a083 [0,2,0,0,0,0|1,0,0]=3 6398 B12R1.8 COCCNCc1ccncn1 0d6b868d49b753831674cc5f72e15b3d [0,2,0,0,0,0|2,0,0]=4 6399 B12R1.8 COCCNCc1ccnnc1 97877682aba2997329d71d8db4517a75 [0,2,0,0,0,0|2,0,0]=4 6400 B12R1.8 COCCNCc1cnccn1 d0b6464b1143809f82269d8dad799fee [0,2,0,0,0,0|2,0,0]=4 6401 B12R1.8 COCCNCc1cncnc1 dfc8973741d21af3b66e8a5a334d4a29 [0,2,0,0,0,0|2,0,0]=4 6402 B12R1.8 COCCNCc1ncccn1 3fc29e851ff60de01e407a1881432eb4 [0,2,0,0,0,0|2,0,0]=4 6403 B12R1.8 COCCOCc1ccccc1 b9f846e77ac1098b75510b938c502133 [0,2,0,0,0,0|0,0,0]=2 6404 B12R1.8 COCCOCc1ccccn1 86c9ea446a5f0c2dbf739a9c1ec4af6f [0,2,0,0,0,0|1,0,0]=3 6405 B12R1.8 COCCOCc1cccnc1 317f931a4364675768525b7f79270a0e [0,2,0,0,0,0|1,0,0]=3 6406 B12R1.8 COCCOCc1cccnn1 6408daff7922ff99d328664433bb04e5 [0,2,0,0,0,0|2,0,0]=4 6407 B12R1.8 COCCOCc1ccncc1 777776af9843b5789a5e9b603c11672b [0,2,0,0,0,0|1,0,0]=3 6408 B12R1.8 COCCOCc1ccncn1 59ec7095bcafcd2ebc843842861ad8b2 [0,2,0,0,0,0|2,0,0]=4 6409 B12R1.8 COCCOCc1ccnnc1 f7c7ecd9a959a29af49aff3bfc077589 [0,2,0,0,0,0|2,0,0]=4 6410 B12R1.8 COCCOCc1cnccn1 02c82acf474fda95b7a7a381228a4ada [0,2,0,0,0,0|2,0,0]=4 6411 B12R1.8 COCCOCc1cncnc1 1823843e1e532cf8f5b2bd4dceb2b802 [0,2,0,0,0,0|2,0,0]=4 6412 B12R1.8 COCCOCc1ncccn1 04048f4ff54770269cf5dda97ff92668 [0,2,0,0,0,0|2,0,0]=4 6413 B12R1.8 COCNCCc1ccccc1 a912e7467b1cfbc21e322d32a6dcd9f6 [0,2,0,0,0,0|0,0,0]=2 6414 B12R1.8 COCNCCc1ccccn1 d2388531e21389a0bbeb6695b6cea49d [0,2,0,0,0,0|1,0,0]=3 6415 B12R1.8 COCNCCc1cccnc1 3064a84f6232ed938ac5d787283e4e47 [0,2,0,0,0,0|1,0,0]=3 6416 B12R1.8 COCNCCc1ccncc1 6b569331b6ff5ac4e281457fad47a423 [0,2,0,0,0,0|1,0,0]=3 6417 B12R1.8 COCNCCc1ccncn1 1a854ed5d386c0daae0e95e611f8fdfc [0,2,0,0,0,0|2,0,0]=4 6418 B12R1.8 COCNCCc1cnccn1 bf87a3331ba42ace588710d5b4856175 [0,2,0,0,0,0|2,0,0]=4 6419 B12R1.8 COCNCCc1ncccn1 8fba07c89cace42bbb581fd44efdd301 [0,2,0,0,0,0|2,0,0]=4 6420 B12R1.8 COCOCCc1ccccc1 770adb91b0343cd94d912838fb402d30 [0,2,0,0,0,0|0,0,0]=2 6421 B12R1.8 COCOCCc1ccccn1 844ec6012059e3e290cbbc2ae5f59230 [0,2,0,0,0,0|1,0,0]=3 6422 B12R1.8 COCOCCc1cccnc1 9d4fdcdb68f5067a05286e77e6f5164f [0,2,0,0,0,0|1,0,0]=3 6423 B12R1.8 COCOCCc1ccncc1 2305f86484e3fbdb87c5f93fceb814cd [0,2,0,0,0,0|1,0,0]=3 6424 B12R1.8 COCOCCc1ccncn1 748dcf5b02a15aaeacebf409cccd24eb [0,2,0,0,0,0|2,0,0]=4 6425 B12R1.8 COCOCCc1cnccn1 5608489fa47adaf76825900029a862da [0,2,0,0,0,0|2,0,0]=4 6426 B12R1.8 COCOCCc1cncnc1 460c7b5d38cd9aea31f9dc754bb3a431 [0,2,0,0,0,0|2,0,0]=4 6427 B12R1.8 COCOCCc1ncccn1 d724c05e27dfc7afdcc3f434b6962bf3 [0,2,0,0,0,0|2,0,0]=4 6428 B12R1.8 CSCCCNc1ccccc1 4e1411f18abc16ae61e9748ad3fe9913 [0,2,0,0,0,0|0,1,0]=3 6429 B12R1.8 CSCCCNc1ccccn1 80fd9025455749dcd8da4ebce8a4f0a8 [0,2,0,0,0,0|1,1,0]=4 6430 B12R1.8 CSCCCNc1cccnc1 a65744a1c0bfc4ffc8f90d3d751e8fd9 [0,2,0,0,0,0|1,1,0]=4 6431 B12R1.8 CSCCCNc1ccncc1 8937538f26cbfac38fa144dc16ba30f6 [0,2,0,0,0,0|1,1,0]=4 6432 B12R1.8 CSCCCOc1ccccn1 3ffe432bdcd1a250a9ca21e1fd86b1e9 [0,2,0,0,0,0|1,1,0]=4 6433 B12R1.8 CSCCCOc1cccnc1 86df670b3262b86521b899f8575ac879 [0,2,0,0,0,0|1,1,0]=4 6434 B12R1.8 CSCCCOc1ccncc1 55e2a767f068d3518a4625983214ce1a [0,2,0,0,0,0|1,1,0]=4 6435 B12R1.8 CSCCNCc1ccccc1 0d4e7f51d968ec32ec790202ae2a515e [0,2,0,0,0,0|0,1,0]=3 6436 B12R1.8 CSCCNCc1ccccn1 1637bb4fe5437c10ef5060198d868124 [0,2,0,0,0,0|1,1,0]=4 6437 B12R1.8 CSCCNCc1cccnc1 ecfab7d8e375ad1f8b77b31b8d0610f7 [0,2,0,0,0,0|1,1,0]=4 6438 B12R1.8 CSCCNCc1ccncc1 51ffe14c2037889bed6c70473f493ea0 [0,2,0,0,0,0|1,1,0]=4 6439 B12R1.8 CSCCOCc1ccccc1 84c183c4a4472a4f34bccedb678bad7b [0,2,0,0,0,0|0,1,0]=3 6440 B12R1.8 CSCCOCc1ccccn1 4347aa5a5271fb25a5cc77c30dfa8a82 [0,2,0,0,0,0|1,1,0]=4 6441 B12R1.8 CSCCOCc1cccnc1 2805e860271ae018830b9c6b9d160171 [0,2,0,0,0,0|1,1,0]=4 6442 B12R1.8 CSCCOCc1ccncc1 da1bc6e1cdfc850ef0acdf1a6cc8da23 [0,2,0,0,0,0|1,1,0]=4 6443 B12R1.8 CSCNCCc1ccccc1 8cb9946ee650f17d4a684e0a1795e862 [0,2,0,0,0,0|0,1,0]=3 6444 B12R1.8 CSCNCCc1ccccn1 1805bded532b1b9756c352b14606e2a1 [0,2,0,0,0,0|1,1,0]=4 6445 B12R1.8 CSCNCCc1cccnc1 a572540020592b533113991945b4ad18 [0,2,0,0,0,0|1,1,0]=4 6446 B12R1.8 CSCNCCc1ccncc1 03b3401fdb1cdeb25dbd38f4797d54c8 [0,2,0,0,0,0|1,1,0]=4 6447 B12R1.8 CSCOCCc1ccccc1 ae45fc1dadd522ae78b6ec0b53b58cbe [0,2,0,0,0,0|0,0,0]=2 6448 B12R1.8 CSCOCCc1ccccn1 40581d5eea60828490877c6330a8a9e0 [0,2,0,0,0,0|1,0,0]=3 6449 B12R1.8 CSCOCCc1cccnc1 f9735501f5c0f5766f3d2359d2e2e003 [0,2,0,0,0,0|1,0,0]=3 6450 B12R1.8 CSCOCCc1ccncc1 0eb83f8787ae71ed3ae7d5be71f64369 [0,2,0,0,0,0|1,0,0]=3 6451 B12R1.8 CSCOCCc1ccncn1 ef80479e687f6fb7a2dba6d3c9d17608 [0,2,0,0,0,0|2,0,0]=4 6452 B12R1.8 CSCOCCc1cnccn1 c2c51c11dbe1d014169515e71f2ee355 [0,2,0,0,0,0|2,0,0]=4 6453 B12R1.8 CSCOCCc1cncnc1 505441d05de2c3f0b76dbdf8179850ed [0,2,0,0,0,0|2,0,0]=4 6454 B12R1.8 CSCOCCc1ncccn1 91aec60b933bcc3edc5c4b2fcf2322f4 [0,2,0,0,0,0|2,0,0]=4 6455 B12R1.8 Cl/C=C/CNCc1ccccc1 a8bbb089bed3b2a5f6790add18c02ea9 [0,2,0,0,0,0|1,0,1]=4 6456 B12R1.8 Cl/C=C/COCc1ccccc1 39b96fd9c849369483b32d20bd300028 [0,2,0,0,0,0|1,0,1]=4 6457 B12R1.8 Cl/C=C\CNCc1ccccc1 e1a2a29c75c0d3cbf63e02bd9dd9f68f [0,2,0,0,0,0|1,0,1]=4 6458 B12R1.8 Cl/C=C\COCc1ccccc1 469db4a6443d937d123185062feb7af0 [0,2,0,0,0,0|1,0,1]=4 6459 B12R1.8 ClC=CCOCc1ccccc1 c5abd2a914006a75903d903e7480679b [0,2,0,0,0,0|1,0,1]=4 6460 B12R1.8 ClCCCCNc1ccccc1 8d4b10d9b5325336494f2a30a6b84cc2 [0,2,0,0,0,0|1,0,0]=3 6461 B12R1.8 ClCCCCNc1ccccn1 91d68bf25a8019630edf3def244c8724 [0,2,0,0,0,0|2,0,0]=4 6462 B12R1.8 ClCCCCNc1cccnc1 b8f5fa4e5c888fdc44d8ce08412f3c22 [0,2,0,0,0,0|2,0,0]=4 6463 B12R1.8 ClCCCCNc1ccncc1 cb55373bcc657a348b8951479b216fc6 [0,2,0,0,0,0|2,0,0]=4 6464 B12R1.8 ClCCCNCc1ccccc1 8f799c9e441fd632be62e26270cf2f35 [0,2,0,0,0,0|1,0,0]=3 6465 B12R1.8 ClCCCNCc1ccccn1 96ae9d70c035a2cbcba2fe24aaa3ffdc [0,2,0,0,0,0|2,0,0]=4 6466 B12R1.8 ClCCCNCc1cccnc1 fcf275c1364e995d69fad995850b6783 [0,2,0,0,0,0|2,0,0]=4 6467 B12R1.8 FCCCCNc1ccccc1 8c2145855632f0dc060333e90dbf6d6e [0,2,0,0,0,0|1,0,0]=3 6468 B12R1.8 FCCCCNc1ccccn1 3356af4d3cce46c847f383ba1fe33929 [0,2,0,0,0,0|2,0,0]=4 6469 B12R1.8 FCCCCNc1cccnc1 b306cc7c8a3a8e54e4f76d4c4c74a414 [0,2,0,0,0,0|2,0,0]=4 6470 B12R1.8 FCCCCNc1ccncc1 17fb431f81c580930a43fc057d4535ce [0,2,0,0,0,0|2,0,0]=4 6471 B12R1.8 FCCCCOc1ccccn1 e938132a19c063e02459ae67d61d9932 [0,2,0,0,0,0|2,0,0]=4 6472 B12R1.8 FCCCCOc1cccnc1 92a78db328bafeeb72a2e3ae6c8f7d1f [0,2,0,0,0,0|2,0,0]=4 6473 B12R1.8 FCCCCOc1ccncc1 221ca4fd54d414d4099f0fe213bb84d9 [0,2,0,0,0,0|2,0,0]=4 6474 B12R1.8 FCCCNCc1ccccc1 6d1372e4372415cb5d41d01b1ced7571 [0,2,0,0,0,0|1,0,0]=3 6475 B12R1.8 FCCCNCc1ccccn1 bebe8fe2bd3d1beb1ac8cad20fd3191a [0,2,0,0,0,0|2,0,0]=4 6476 B12R1.8 FCCCNCc1cccnc1 3a0a9a1e19f91aff9afdabecf3e6a9e9 [0,2,0,0,0,0|2,0,0]=4 6477 B12R1.8 FCCCNCc1ccncc1 d030deda5d995fc17634727b2c2c397b [0,2,0,0,0,0|2,0,0]=4 6478 B12R1.8 FCCCOCc1ccccc1 ec8c223bdd42642bcadc9c3ef97f9c25 [0,2,0,0,0,0|1,0,0]=3 6479 B12R1.8 FCCCOCc1ccccn1 528370285b3b5e280a7693ede1e62dba [0,2,0,0,0,0|2,0,0]=4 6480 B12R1.8 FCCCOCc1cccnc1 6f562313b06d2fd995c9386f7d544539 [0,2,0,0,0,0|2,0,0]=4 6481 B12R1.8 FCCCOCc1ccncc1 b7003999f3576cc06c45595be50b086d [0,2,0,0,0,0|2,0,0]=4 6482 B12R1.8 FCCNCCc1ccccc1 361355d651ba3401fa85cac238cfdb0b [0,2,0,0,0,0|1,0,0]=3 6483 B12R1.8 FCCNCCc1ccccn1 29c8a9f54fc2a477b50973596a269acb [0,2,0,0,0,0|2,0,0]=4 6484 B12R1.8 FCCNCCc1cccnc1 58b2ab7fc620968122c80079c047b73c [0,2,0,0,0,0|2,0,0]=4 6485 B12R1.8 FCCNCCc1ccncc1 3811375e5c5f5ffb86663c4d7bd351e7 [0,2,0,0,0,0|2,0,0]=4 6486 B12R1.8 FCCNCSc1ccccc1 b99d60c0fc5df8022ed05538b8ad6f86 [0,2,0,0,0,0|2,0,0]=4 6487 B12R1.8 FCCOCCc1ccccc1 3b5b20f3626d4389ca61c96c4166e57a [0,2,0,0,0,0|0,0,0]=2 6488 B12R1.8 FCCOCCc1ccccn1 656fc26896d540955c618d694ea4c322 [0,2,0,0,0,0|1,0,0]=3 6489 B12R1.8 FCCOCCc1cccnc1 957482671423f2e3d0589e435774cdc9 [0,2,0,0,0,0|1,0,0]=3 6490 B12R1.8 FCCOCCc1ccncc1 8f3402e3aabc7209bdcae575065e4e1c [0,2,0,0,0,0|1,0,0]=3 6491 B12R1.8 FCCOCCc1ccncn1 48aeec81c3b497e7d254b1c6ec46d51e [0,2,0,0,0,0|2,0,0]=4 6492 B12R1.8 FCCOCCc1cnccn1 f2f7c6a84c38a85148564be41afc3927 [0,2,0,0,0,0|2,0,0]=4 6493 B12R1.8 FCCOCCc1cncnc1 33bd97071d703df544d1b386a9e209fc [0,2,0,0,0,0|2,0,0]=4 6494 B12R1.8 FCCOCCc1ncccn1 50045bd0e3ff889f53e25d7c9410181f [0,2,0,0,0,0|2,0,0]=4 6495 B12R1.8 FCNC/C=C/c1ccccc1 2bd6454aefec602d932c676852044d0c [0,2,0,0,0,0|1,0,1]=4 6496 B12R1.8 FCNCC#Cc1ccccc1 80dd9405d00768793c93791da63566d4 [0,2,0,0,0,0|1,0,1]=4 6497 B12R1.8 FCNCCCc1ccccc1 36413a7a64ebaf0c06144ade57dac471 [0,2,0,0,0,0|1,0,0]=3 6498 B12R1.8 FCNCCCc1ccccn1 540e815b69c598f8c06e83b81e832380 [0,2,0,0,0,0|2,0,0]=4 6499 B12R1.8 FCNCCCc1cccnc1 14b609c05aa718f62169111db8c3db9d [0,2,0,0,0,0|2,0,0]=4 6500 B12R1.8 FCNCCCc1ccncc1 7f07567512e5a743ace3f4492421eca1 [0,2,0,0,0,0|2,0,0]=4 6501 B12R1.8 FCNCCOc1ccccc1 614b328619e3beb87099bb0fb4ee3fbb [0,2,0,0,0,0|1,0,0]=3 6502 B12R1.8 FCNCCOc1ccccn1 8fef6c9e6106f1034aa0e60b7ac4c87c [0,2,0,0,0,0|2,0,0]=4 6503 B12R1.8 FCNCCOc1cccnc1 71ce51564f6ee9c66c19ccbcc27b3a08 [0,2,0,0,0,0|2,0,0]=4 6504 B12R1.8 FCOC/C=C/c1ccccc1 a4ace31f3457e43155aba22e2e859991 [0,2,0,0,0,0|0,0,1]=3 6505 B12R1.8 FCOC/C=C/c1ccccn1 380d259ba986729daf278c6438aba24c [0,2,0,0,0,0|1,0,1]=4 6506 B12R1.8 FCOC/C=C/c1cccnc1 9531422fc25528cbd3766494779ba4ab [0,2,0,0,0,0|1,0,1]=4 6507 B12R1.8 FCOC/C=C/c1ccncc1 7e656ffb84540dec997a15c52c10bb35 [0,2,0,0,0,0|1,0,1]=4 6508 B12R1.8 FCOC/C=C\c1ccccc1 a5a4d25cd2921992c3f2dc18a83060fd [0,2,0,0,0,0|0,0,1]=3 6509 B12R1.8 FCOC/C=C\c1ccncc1 694cd0cfc8702a980e3e2f78654fcec4 [0,2,0,0,0,0|1,0,1]=4 6510 B12R1.8 FCOCC#Cc1ccccc1 c9130dfcc2836a2b12a5478aa9ea4062 [0,2,0,0,0,0|0,0,1]=3 6511 B12R1.8 FCOCC#Cc1ccccn1 1f9f4afc4ebf0e267d23470dd251d8f8 [0,2,0,0,0,0|1,0,1]=4 6512 B12R1.8 FCOCC#Cc1cccnc1 decb8cc443e960c18e871ce379441d6e [0,2,0,0,0,0|1,0,1]=4 6513 B12R1.8 FCOCC#Cc1ccncc1 b026be8158ec76c7e5f085c9ed000baf [0,2,0,0,0,0|1,0,1]=4 6514 B12R1.8 FCOCC=Cc1ccccc1 bab31968052d6c59ffd956383ce13de4 [0,2,0,0,0,0|0,0,1]=3 6515 B12R1.8 FCOCC=Cc1ccncc1 e460d7a98719065382f6a01a34995496 [0,2,0,0,0,0|1,0,1]=4 6516 B12R1.8 FCOCCCC1=CCC=CC1 1294cfccca94eb93dcc9ddacbc4f99bf [0,2,0,0,0,0|0,0,2]=4 6517 B12R1.8 FCOCCCc1ccccc1 337af886dc35840fb3b320f6a2c82837 [0,2,0,0,0,0|0,0,0]=2 6518 B12R1.8 FCOCCCc1ccccn1 2e559e01a296a0de86a304e4360dee8e [0,2,0,0,0,0|1,0,0]=3 6519 B12R1.8 FCOCCCc1cccnc1 f5369d800374823eaa516c7467969e5a [0,2,0,0,0,0|1,0,0]=3 6520 B12R1.8 FCOCCCc1ccncc1 466da5d2d1e40cb9128dbe68f0c0cf6c [0,2,0,0,0,0|1,0,0]=3 6521 B12R1.8 FCOCCCc1cnccn1 1acdc5c948d16d48f25b61dcd252d6d5 [0,2,0,0,0,0|2,0,0]=4 6522 B12R1.8 FCOCCCc1ncccn1 54706bbc33e999a8038b2346d9e3ee82 [0,2,0,0,0,0|2,0,0]=4 6523 B12R1.8 FCOCCOc1ccccc1 f1abda8c43f206c81b6519331a77e9c9 [0,2,0,0,0,0|0,0,0]=2 6524 B12R1.8 FCOCCOc1cccnc1 63d5c53b289a490c3dc2320772db4d74 [0,2,0,0,0,0|1,0,0]=3 6525 B12R1.8 FCOCCOc1ccncc1 c9a59edb4c51aa54314ea4ee27540b28 [0,2,0,0,0,0|1,0,0]=3 6526 B12R1.8 FCOCCSc1ccccc1 ccf72dbc5c74c757f9876ec0c6e08012 [0,2,0,0,0,0|0,0,0]=2 6527 B12R1.8 FCOCCSc1ccccn1 40bbc0f60728ea96d5ae43f17a068fff [0,2,0,0,0,0|1,0,0]=3 6528 B12R1.8 IC#CCOCc1ccccc1 3a5655442d34ea5643fd66afc2663d8e [0,2,0,0,0,0|1,0,1]=4 6529 B12R1.8 ICCNCCc1ccccc1 3d43af0eb4bc8ed1c19be50fd2591b44 [0,2,0,0,0,0|1,0,0]=3 6530 B12R1.8 ICCNCCc1ccccn1 3a2513367ab7cf9a5f37f82491c73a54 [0,2,0,0,0,0|2,0,0]=4 6531 B12R1.8 ICCNCCc1cccnc1 9a37b912cff3420349bcdd29b8da0796 [0,2,0,0,0,0|2,0,0]=4 6532 B12R1.8 ICCNCCc1ccncc1 693c40e0cf7891ad91fdd11c327b86d3 [0,2,0,0,0,0|2,0,0]=4 6533 B12R1.8 N#CCCCNc1ccccc1 b63d3fad690b955214294824bdee6b3a [0,2,0,0,0,0|1,0,1]=4 6534 B12R1.8 N#CCCNCc1ccccc1 4d72f08df781a4a97f9c75c6cad34723 [0,2,0,0,0,0|1,0,1]=4 6535 B12R1.8 N#CCCOCc1ccccc1 ee4f67be7b7a1f02f3abb23db1d228e3 [0,2,0,0,0,0|1,0,1]=4 6536 B12R1.8 N#CCNCCc1ccccc1 196965f1ea9924e72f23b610f5ed5162 [0,2,0,0,0,0|1,0,0]=3 6537 B12R1.8 N#CCNCCc1ccccn1 163b09df21cb199dae55caf11c578544 [0,2,0,0,0,0|2,0,0]=4 6538 B12R1.8 N#CCNCCc1cccnc1 16954d72667e4e911286fe1fd74ebb45 [0,2,0,0,0,0|2,0,0]=4 6539 B12R1.8 N#CCNCCc1ccncc1 f33c4f1b8764efe9a51017b3091f844f [0,2,0,0,0,0|2,0,0]=4 6540 B12R1.8 N#CCOCCc1ccccc1 f710fd753c514569a7e1cf024d236cec [0,2,0,0,0,0|0,0,0]=2 6541 B12R1.8 N#CCOCCc1ccccn1 bafea33941ce33ee97bd85bc178ec803 [0,2,0,0,0,0|1,0,0]=3 6542 B12R1.8 N#CCOCCc1cccnc1 a4b9574a0b1ee7ba313ef820951e599b [0,2,0,0,0,0|1,0,0]=3 6543 B12R1.8 N#CCOCCc1ccncc1 dec3d816ca7a83e94887dcead2c5e606 [0,2,0,0,0,0|1,0,0]=3 6544 B12R1.8 N#CCOCCc1ccncn1 b6832822bb637f965be004efa3f4dfa0 [0,2,0,0,0,0|2,0,0]=4 6545 B12R1.8 N#CCOCCc1cnccn1 a9feb7b5d615a0a1cce476e22891a04b [0,2,0,0,0,0|2,0,0]=4 6546 B12R1.8 N#CCOCCc1cncnc1 fb74110596e8053fd2fb9bb2ce51af54 [0,2,0,0,0,0|2,0,0]=4 6547 B12R1.8 N#CCOCCc1ncccn1 738c0e36bc4e69fb0a91524b39eefe73 [0,2,0,0,0,0|2,0,0]=4 6548 B12R1.8 N#CNCCCc1ccccc1 c15a86ec4727013e594da04c9a6943f6 [0,2,0,0,0,0|1,0,1]=4 6549 B12R1.8 N#CNCCOc1ccccc1 370aac6fd6825ccf4ffebf30b2c8d324 [0,2,0,0,0,0|1,0,1]=4 6550 B12R1.8 N#CNCCSc1ccccc1 8e4cbfdfd619fcaee033a00c63065969 [0,2,0,0,0,0|1,0,1]=4 6551 B12R1.8 N#CSCNCc1ccccc1 15907aa219680e609c9dcf7b05128d0a [0,2,0,0,0,0|0,1,1]=4 6552 B12R1.8 N#CSCOCc1ccccc1 c07dfa541610d51d167cd19caa0ddf16 [0,2,0,0,0,0|0,1,1]=4 6553 B12R1.8 NOCCNCc1ccccc1 c44b16f502caeb4e0911ea1065c9b2b0 [0,2,0,0,0,0|1,0,0]=3 6554 B12R1.8 NOCCNCc1ccccn1 165a31a3ac0fc53401699a7491732285 [0,2,0,0,0,0|2,0,0]=4 6555 B12R1.8 NOCCNCc1cccnc1 111a2fd5342dcf2c1ab9382f67cce52f [0,2,0,0,0,0|2,0,0]=4 6556 B12R1.8 O/C=C\CNCc1ccccc1 cc7ffd2c4974e7fdfe8e66473dde0504 [0,2,0,0,0,0|1,0,1]=4 6557 B12R1.8 O=CCCCNc1ccccc1 2c85f0734b2940921a92b997758dfb5d [0,2,0,0,0,0|1,0,1]=4 6558 B12R1.8 O=CCCNCc1ccccc1 c74469b4a98525e28c41fd68e9d4e654 [0,2,0,0,0,0|1,0,1]=4 6559 B12R1.8 O=CCCOCc1ccccc1 ac3f888cccae65d1996a84a27a558161 [0,2,0,0,0,0|1,0,1]=4 6560 B12R1.8 O=CCNCCc1ccccc1 7b8a13082bcfdef296ce3280285f19f6 [0,2,0,0,0,0|1,0,0]=3 6561 B12R1.8 O=CCNCCc1ccccn1 2ac86c7ddc23dc7a650d74729fdd57a5 [0,2,0,0,0,0|2,0,0]=4 6562 B12R1.8 O=CCNCCc1cccnc1 10a21dad833997173ac6ff2da6f2fff7 [0,2,0,0,0,0|2,0,0]=4 6563 B12R1.8 O=CCNCCc1ccncc1 e5023107192b9af110dd8c385e94dc72 [0,2,0,0,0,0|2,0,0]=4 6564 B12R1.8 O=CCOCCc1ccccc1 2441de9de85249e6953e55d007d8182d [0,2,0,0,0,0|0,0,0]=2 6565 B12R1.8 O=CCOCCc1ccccn1 0361d1c3b5a1b9e1a7dbd5d2dbfa21cd [0,2,0,0,0,0|1,0,0]=3 6566 B12R1.8 O=CCOCCc1cccnc1 b120f3118bc37a8fece5520b578800cd [0,2,0,0,0,0|1,0,0]=3 6567 B12R1.8 O=CCOCCc1ccncc1 055376845214955ee414dd345ed69eb9 [0,2,0,0,0,0|1,0,0]=3 6568 B12R1.8 O=CCOCCc1ccncn1 26aa8422f214298cceb729eafc5e748d [0,2,0,0,0,0|2,0,0]=4 6569 B12R1.8 O=CCOCCc1cnccn1 d1a156923fa243fa3e5a73ec915203c4 [0,2,0,0,0,0|2,0,0]=4 6570 B12R1.8 O=CCOCCc1cncnc1 bcd836d04fea1e25bdd4643c6718acb2 [0,2,0,0,0,0|2,0,0]=4 6571 B12R1.8 O=CCOCCc1ncccn1 5b24bc3455d7be677b74a9d0b3768327 [0,2,0,0,0,0|2,0,0]=4 6572 B12R1.8 O=CNCCCc1ccccc1 538cecde6b0a6e38513d6c405409a280 [0,2,0,0,0,0|1,0,1]=4 6573 B12R1.8 O=CNCCOc1ccccc1 1ad225f0f5fffc295476e6f5e4bf57b0 [0,2,0,0,0,0|1,0,1]=4 6574 B12R1.8 OCC#CCNc1ccccc1 ad3ab414545e40c96a0f226567b3debc [0,2,0,0,0,0|1,0,1]=4 6575 B12R1.8 OCCCCNc1ccccc1 2154e665ebfa9ee647e239d5a23b3bbd [0,2,0,0,0,0|1,0,0]=3 6576 B12R1.8 OCCCCNc1ccccn1 13b989e40aa07edcb6de17c9446b591d [0,2,0,0,0,0|2,0,0]=4 6577 B12R1.8 OCCCCNc1cccnc1 27a79c461a1ee6618a6e7fe3cc1d992b [0,2,0,0,0,0|2,0,0]=4 6578 B12R1.8 OCCCCNc1ccncc1 39bc0436bd73ae73ff6d2c17ccd5c512 [0,2,0,0,0,0|2,0,0]=4 6579 B12R1.8 OCCCNCc1ccccc1 1f43a365b69733d9fd54c3f1367679b4 [0,2,0,0,0,0|1,0,0]=3 6580 B12R1.8 OCCCNCc1ccccn1 2db74cd30f61e8e3f9c52c7133bf4507 [0,2,0,0,0,0|2,0,0]=4 6581 B12R1.8 OCCCNCc1cccnc1 b48c3c866d05056f01b31ecc1dce4b1c [0,2,0,0,0,0|2,0,0]=4 6582 B12R1.8 OCCCNCc1ccncc1 66e831e14b2dc2dae28ad5f265bc1c0f [0,2,0,0,0,0|2,0,0]=4 6583 B12R1.8 OCCNCCc1ccccc1 6832b0d8880be8700c4d8c29ed63036c [0,2,0,0,0,0|1,0,0]=3 6584 B12R1.8 OCCNCCc1ccccn1 192e21053d8ac918db362a708882a85e [0,2,0,0,0,0|2,0,0]=4 6585 B12R1.8 OCCNCCc1cccnc1 5891d48f724f9c6f3ad1caf0a25a85fd [0,2,0,0,0,0|2,0,0]=4 6586 B12R1.8 OCCNCCc1ccncc1 b842232cc5675331ff05fecfcbf14339 [0,2,0,0,0,0|2,0,0]=4 6587 B12R1.8 OCCNCSc1ccccc1 973e07915013e23c41bc74a1aa466e19 [0,2,0,0,0,0|2,0,0]=4 6588 B12R1.8 OCNC/C=C/c1ccccc1 520f7b9ffc5cf2723b4b289848e239a6 [0,2,0,0,0,0|1,0,1]=4 6589 B12R1.8 OCNCCCc1ccccc1 4af827ec2909e74315445a370a932107 [0,2,0,0,0,0|1,0,0]=3 6590 B12R1.8 OCNCCCc1ccccn1 b4b77985940d9e7029052ba013ff39f2 [0,2,0,0,0,0|2,0,0]=4 6591 B12R1.8 OCNCCCc1cccnc1 5d17832d95f3d6e1e2dbe7e755d7ff68 [0,2,0,0,0,0|2,0,0]=4 6592 B12R1.8 OCNCCCc1ccncc1 fa6c58ba5a5ca30c3e77a7d188a18ade [0,2,0,0,0,0|2,0,0]=4 6593 B12R1.8 OCNCCOc1ccccc1 641239c62160a991f896e082b9cc08e2 [0,2,0,0,0,0|1,0,0]=3 6594 B12R1.8 OCNCCOc1ccccn1 06ebb48d83e2a20777eb8509019ff344 [0,2,0,0,0,0|2,0,0]=4 6595 B12R1.8 OCNCCOc1cccnc1 5fb6f2320c7a223c545e251e709be8a9 [0,2,0,0,0,0|2,0,0]=4 6596 B12R1.8 SCCCCNc1ccccc1 ed2d9d7f95071d0803e58eb2622dd581 [0,2,0,0,0,0|1,0,0]=3 6597 B12R1.8 SCCCCNc1ccccn1 8db86b31e92529d8508911c90bd3155e [0,2,0,0,0,0|2,0,0]=4 6598 B12R1.8 SCCCCNc1cccnc1 1a880ae57e783a38d52938eda41c5ac3 [0,2,0,0,0,0|2,0,0]=4 6599 B12R1.8 SCCCCNc1ccncc1 ec85506b4432e39a7976426b643d3271 [0,2,0,0,0,0|2,0,0]=4 6600 B12R1.8 SCCCNCc1ccccc1 66312e7d4ce4f899347700206744a721 [0,2,0,0,0,0|1,0,0]=3 6601 B12R1.8 SCCCNCc1ccccn1 bc507d54c38f34dd3e4362708255f752 [0,2,0,0,0,0|2,0,0]=4 6602 B12R1.8 SCCCNCc1cccnc1 f92b68cac5fbfc6a7a8fb20332d0deca [0,2,0,0,0,0|2,0,0]=4 6603 B12R1.8 SCCCNCc1ccncc1 930f1152ea81b6ce28440b05e77d9e15 [0,2,0,0,0,0|2,0,0]=4 6604 B12R1.8 SCCCOCc1ccccc1 a40983423638d779f7a71c708a989b8f [0,2,0,0,0,0|1,0,0]=3 6605 B12R1.8 SCCCOCc1ccccn1 89b32eb12d51f5c6bc232ac75f5b9e1c [0,2,0,0,0,0|2,0,0]=4 6606 B12R1.8 SCCCOCc1cccnc1 29020307926ad4edbc3f8479d71e5a01 [0,2,0,0,0,0|2,0,0]=4 6607 B12R1.8 SCCCOCc1ccncc1 292b1f66d09671e748170d605ae04b81 [0,2,0,0,0,0|2,0,0]=4 6608 B12R1.8 SCCNCCc1ccccc1 77f9cf13a4d370b17f1b8a888b3044b3 [0,2,0,0,0,0|1,0,0]=3 6609 B12R1.8 SCCNCCc1ccccn1 ee52ad5cacea42a063542560ca02c6c5 [0,2,0,0,0,0|2,0,0]=4 6610 B12R1.8 SCCNCCc1cccnc1 f05b013db913ccc909ff89417846b387 [0,2,0,0,0,0|2,0,0]=4 6611 B12R1.8 SCCNCCc1ccncc1 ccb9121d287104528c39ff9698fecd48 [0,2,0,0,0,0|2,0,0]=4 6612 B12R1.8 SCCOCCc1ccccc1 622b11be5805e98ac28331a5544396fa [0,2,0,0,0,0|0,0,0]=2 6613 B12R1.8 SCCOCCc1ccccn1 820fc7c612ac0b816564f27a6a32eeec [0,2,0,0,0,0|1,0,0]=3 6614 B12R1.8 SCCOCCc1cccnc1 25c35e21ef3282518885c7aefe7967bd [0,2,0,0,0,0|1,0,0]=3 6615 B12R1.8 SCCOCCc1ccncc1 8cfdbbc980fddb3908df97d939253c99 [0,2,0,0,0,0|1,0,0]=3 6616 B12R1.8 SCCOCCc1ccncn1 37d4d60151c9b43d6c1039a8fea54f51 [0,2,0,0,0,0|2,0,0]=4 6617 B12R1.8 SCCOCCc1cnccn1 905f6f0a986510af20c208e3d896fdee [0,2,0,0,0,0|2,0,0]=4 6618 B12R1.8 SCCOCCc1cncnc1 0ad356678d2efaf22eb096c1f72cfa36 [0,2,0,0,0,0|2,0,0]=4 6619 B12R1.8 SCCOCCc1ncccn1 0b0b23bd933e93d7832f3287ded9ee9d [0,2,0,0,0,0|2,0,0]=4 6620 B12R1.27 BrCC(Br)CNc1ccccc1 e7e12b5e4c30a5d2720e1014017ec37c [0,2,0,0,0,0|2,0,0]=4 6621 B12R1.27 C#CC(C)NCc1ccccc1 0c823c8410acc72523ada4697880703b [0,2,0,0,0,0|1,0,1]=4 6622 B12R1.27 C#CC(C)OCc1ccccc1 f6359202a87cde289007d81369eaa165 [0,2,0,0,0,0|1,0,1]=4 6623 B12R1.27 C#C[C@@H](C)NCc1ccccc1 51fd06b5dc99f337c53516eb04becf75 [0,2,0,0,0,0|1,0,1]=4 6624 B12R1.27 C#C[C@@H](C)OCc1ccccc1 5a1f683c3ddc74682e7065902596ab4b [0,2,0,0,0,0|1,0,1]=4 6625 B12R1.27 C#C[C@H](C)NCc1ccccc1 5c0b47a0f6d5613da204666041aaf216 [0,2,0,0,0,0|1,0,1]=4 6626 B12R1.27 C#C[C@H](C)OCc1ccccc1 760d62af860bc17bf4194987b15f5245 [0,2,0,0,0,0|1,0,1]=4 6627 B12R1.27 C=C(CC)CNc1ccccc1 109c052abdb53f9ddab28ed347d98fd8 [0,2,0,0,0,0|1,0,1]=4 6628 B12R1.27 C=C(CNc1ccccc1)OC bb949f54d2f54d3e6e888faf57686f4e [0,2,0,0,0,0|0,0,1]=3 6629 B12R1.27 C=C(CNc1ccccn1)OC 3de7e001df09be3a86b7985205b8d232 [0,2,0,0,0,0|1,0,1]=4 6630 B12R1.27 C=C(CNc1cccnc1)OC 16f5c6a181503e92db9c7517f408c15a [0,2,0,0,0,0|1,0,1]=4 6631 B12R1.27 C=C(CNc1ccncc1)OC 749bc4377b5a09f0ab82893ce238a124 [0,2,0,0,0,0|1,0,1]=4 6632 B12R1.27 C=C(CO)CNc1ccccc1 6dd075951d15cc232b8e7770860ee4cb [0,2,0,0,0,0|2,0,0]=4 6633 B12R1.27 C=C(COc1ccccn1)OC a43bd483ae573d6cfa4f8d7b75d98ff8 [0,2,0,0,0,0|1,0,1]=4 6634 B12R1.27 C=C(COc1cccnc1)OC 3ff9797a1ba9a3ae1d012481d7824603 [0,2,0,0,0,0|1,0,1]=4 6635 B12R1.27 C=C(COc1ccncc1)OC 339d1dd8bae57e1176953c4d9117eedb [0,2,0,0,0,0|1,0,1]=4 6636 B12R1.27 C=CC(C)NCc1ccccc1 a2d84df39e96bf4d63bb9a0f31cf21bd [0,2,0,0,0,0|1,0,1]=4 6637 B12R1.27 C=CC(C)OCc1ccccc1 5eba3aa739773a1c08ab0c58859512d1 [0,2,0,0,0,0|1,0,1]=4 6638 B12R1.27 C=CC(O)CNc1ccccc1 e6108fb7cfe75301d4d656a5d5d31162 [0,2,0,0,0,0|1,0,1]=4 6639 B12R1.27 C=C[C@H](C)OCc1ccccc1 723c5fd60a5c4ba97fa272fb1c420579 [0,2,0,0,0,0|1,0,1]=4 6640 B12R1.27 CC(C#N)CNc1ccccc1 bca83eb9ab77da1cbd259e8c3d4283ee [0,2,0,0,0,0|2,0,0]=4 6641 B12R1.27 CC(C#N)NCc1ccccc1 a297cbe65f4070e0226da02d61e71151 [0,2,0,0,0,0|2,0,0]=4 6642 B12R1.27 CC(C=O)NCc1ccccc1 52acbe8f861a146c2fae15c546c154ce [0,2,0,0,0,0|2,0,0]=4 6643 B12R1.27 CC(C=O)OCc1ccccc1 dab13d83530825bb9c7bbbb7bc6908d9 [0,2,0,0,0,0|2,0,0]=4 6644 B12R1.27 CC(CF)OCc1ccccc1 c18da580e3dabe7992624a35c25d53e8 [0,2,0,0,0,0|2,0,0]=4 6645 B12R1.27 CC(CO)CNc1ccccc1 f07a32871260f72c2fb2363a7f611104 [0,2,0,0,0,0|2,0,0]=4 6646 B12R1.27 CC(CO)NCc1ccccc1 8f2e7b2c99e7f1ec8ee06bbaf841b37c [0,2,0,0,0,0|2,0,0]=4 6647 B12R1.27 CC(CS)OCc1ccccc1 bf9173a456888d57225f0e1203a32c5e [0,2,0,0,0,0|2,0,0]=4 6648 B12R1.27 CCC(=O)CNc1ccccc1 8a00a9b87cff2992f22bb204b9e2670f [0,2,0,0,0,0|1,0,1]=4 6649 B12R1.27 CCC(=O)NCc1ccccc1 cd109163e80059e2763660343f9dbe36 [0,2,0,0,0,0|1,0,1]=4 6650 B12R1.27 CCC(C)CNc1ccccc1 fb8ee4288bf8853fd57c8a217184507f [0,2,0,0,0,0|1,0,0]=3 6651 B12R1.27 CCC(C)CNc1ccccn1 6f2b4521dfa3e14ebf77bc9e288b8c6c [0,2,0,0,0,0|2,0,0]=4 6652 B12R1.27 CCC(C)CNc1cccnc1 799d2535ec95c75adc3efc07c94a55e6 [0,2,0,0,0,0|2,0,0]=4 6653 B12R1.27 CCC(C)CNc1ccncc1 1d114bdb53eb8bc5873d9cc0853c5acf [0,2,0,0,0,0|2,0,0]=4 6654 B12R1.27 CCC(C)COc1ccccn1 068a7be24dc7922a67d6964a1394c7d6 [0,2,0,0,0,0|2,0,0]=4 6655 B12R1.27 CCC(C)COc1cccnc1 0c32f61d8566e65294b7d65adcb5b70b [0,2,0,0,0,0|2,0,0]=4 6656 B12R1.27 CCC(C)COc1ccncc1 60b90e0040b7a2f08da03a263d76f7dc [0,2,0,0,0,0|2,0,0]=4 6657 B12R1.27 CCC(C)NCc1ccccc1 ab8df84230779f2ea3e6a09700944eac [0,2,0,0,0,0|1,0,0]=3 6658 B12R1.27 CCC(C)NCc1ccccn1 600531c2c0367b3cbfd9810ef9c18666 [0,2,0,0,0,0|2,0,0]=4 6659 B12R1.27 CCC(C)NCc1cccnc1 03aa38772555301826d5e6a7450f6276 [0,2,0,0,0,0|2,0,0]=4 6660 B12R1.27 CCC(C)NCc1ccncc1 8f2ef9d0f5df7ed3c4b3d292b12e10fb [0,2,0,0,0,0|2,0,0]=4 6661 B12R1.27 CCC(C)OCc1ccccc1 ecd56e0e8d83f20f8ba3d53f4367b277 [0,2,0,0,0,0|1,0,0]=3 6662 B12R1.27 CCC(C)OCc1ccccn1 cdbc114ff1e98274e0c76d4efba7fd19 [0,2,0,0,0,0|2,0,0]=4 6663 B12R1.27 CCC(C)OCc1cccnc1 48e9afbe8701af90763c0a4646314a57 [0,2,0,0,0,0|2,0,0]=4 6664 B12R1.27 CCC(C)OCc1ccncc1 a48ab0f470a95fc03f35a49430e127c9 [0,2,0,0,0,0|2,0,0]=4 6665 B12R1.27 CCC(O)CNc1ccccc1 3a32ac0a6b49d877750df15cf382268b [0,2,0,0,0,0|1,0,0]=3 6666 B12R1.27 CCC(O)CNc1ccccn1 6864d6686de3983b3129898abd14e11f [0,2,0,0,0,0|2,0,0]=4 6667 B12R1.27 CCC(O)CNc1cccnc1 5ec705eaa989393421bbf1121531428c [0,2,0,0,0,0|2,0,0]=4 6668 B12R1.27 CCC(O)CNc1ccncc1 0b60e4dad8ea5561a0d2716be536ff21 [0,2,0,0,0,0|2,0,0]=4 6669 B12R1.27 CCN(C)CCc1ccccc1 7c4ca4f684c66e96c63c7f2e129ac623 [0,2,0,0,0,0|1,0,0]=3 6670 B12R1.27 CCN(C)CCc1ccccn1 2fc992e6b94f2894c06f88d1be2c6eae [0,2,0,0,0,0|2,0,0]=4 6671 B12R1.27 CCN(C)CCc1cccnc1 8f102e3d75ada77333a942e239825207 [0,2,0,0,0,0|2,0,0]=4 6672 B12R1.27 CCN(C)CCc1ccncc1 b74613155a01263f6023f3efd6abab19 [0,2,0,0,0,0|2,0,0]=4 6673 B12R1.27 CC[C@@H](C)CNc1ccccc1 7adb7de69cc286747885efdd5e0d3ab0 [0,2,0,0,0,0|1,0,0]=3 6674 B12R1.27 CC[C@@H](C)CNc1ccccn1 b147644fe4c42e26e6b4ca990988fc8c [0,2,0,0,0,0|2,0,0]=4 6675 B12R1.27 CC[C@@H](C)CNc1cccnc1 1eb105ddecf8c3249110848ecff4eaa7 [0,2,0,0,0,0|2,0,0]=4 6676 B12R1.27 CC[C@@H](C)CNc1ccncc1 ea454cc837b589ad6fa29f9da9abac60 [0,2,0,0,0,0|2,0,0]=4 6677 B12R1.27 CC[C@@H](C)COc1ccccn1 874982a66f916edcb8896717a7802590 [0,2,0,0,0,0|2,0,0]=4 6678 B12R1.27 CC[C@@H](C)COc1cccnc1 58227191aae01f35afcd7cf132697857 [0,2,0,0,0,0|2,0,0]=4 6679 B12R1.27 CC[C@@H](C)COc1ccncc1 d0894bc1ae7cda042c896f44faa1550c [0,2,0,0,0,0|2,0,0]=4 6680 B12R1.27 CC[C@@H](C)NCc1ccccc1 1448d746eef22413d3964f8047936159 [0,2,0,0,0,0|1,0,0]=3 6681 B12R1.27 CC[C@@H](C)NCc1ccccn1 abcbefa3b0b43406c128be8257adf8b2 [0,2,0,0,0,0|2,0,0]=4 6682 B12R1.27 CC[C@@H](C)NCc1cccnc1 b119e02beb918b7f43cb64ab2c69b801 [0,2,0,0,0,0|2,0,0]=4 6683 B12R1.27 CC[C@@H](C)OCc1ccccc1 0a5e215baf34a258dd8987ff4d2156b3 [0,2,0,0,0,0|1,0,0]=3 6684 B12R1.27 CC[C@@H](C)OCc1ccccn1 01fb0c2d8a73e699c5cca2351e7c51da [0,2,0,0,0,0|2,0,0]=4 6685 B12R1.27 CC[C@@H](C)OCc1cccnc1 2a740981d9be19ca809d229b469f45a2 [0,2,0,0,0,0|2,0,0]=4 6686 B12R1.27 CC[C@@H](O)CNc1ccccc1 765034dc37ea09fed7d7c3321191febe [0,2,0,0,0,0|1,0,0]=3 6687 B12R1.27 CC[C@@H](O)CNc1cccnc1 804d6049e9a11075b053115d69a8a4fd [0,2,0,0,0,0|2,0,0]=4 6688 B12R1.27 CC[C@@H](O)CNc1ccncc1 d1898f70a0d74eecc26d475907d4eaff [0,2,0,0,0,0|2,0,0]=4 6689 B12R1.27 CC[C@H](C)CNc1ccccc1 1ad1285ada078333483cb7913624769f [0,2,0,0,0,0|1,0,0]=3 6690 B12R1.27 CC[C@H](C)CNc1ccccn1 75c9b55178b9e6cbffbfe52153637e1b [0,2,0,0,0,0|2,0,0]=4 6691 B12R1.27 CC[C@H](C)CNc1cccnc1 2e0a2075fe988129d1dcbf5d21b158ec [0,2,0,0,0,0|2,0,0]=4 6692 B12R1.27 CC[C@H](C)CNc1ccncc1 1476b49c3603a7542420a49c2bf3dc59 [0,2,0,0,0,0|2,0,0]=4 6693 B12R1.27 CC[C@H](C)COc1ccccn1 f5b749782758cf24dab04e1718b2b720 [0,2,0,0,0,0|2,0,0]=4 6694 B12R1.27 CC[C@H](C)COc1cccnc1 07e42e29a9d594c30776c88035bd838e [0,2,0,0,0,0|2,0,0]=4 6695 B12R1.27 CC[C@H](C)COc1ccncc1 91877b6a13f619eb114c1ca0ccf0b7a7 [0,2,0,0,0,0|2,0,0]=4 6696 B12R1.27 CC[C@H](C)NCc1ccccc1 1d652b15c79b972376b40d93f2c0c28b [0,2,0,0,0,0|1,0,0]=3 6697 B12R1.27 CC[C@H](C)NCc1ccccn1 db87df854d63d8a538c09dd589fcce72 [0,2,0,0,0,0|2,0,0]=4 6698 B12R1.27 CC[C@H](C)NCc1cccnc1 fa7be05a72600688ba61bb2a45c0e2c1 [0,2,0,0,0,0|2,0,0]=4 6699 B12R1.27 CC[C@H](C)OCc1ccccc1 b8de8bd5177d460679bde97bee24bb31 [0,2,0,0,0,0|1,0,0]=3 6700 B12R1.27 CC[C@H](C)OCc1ccccn1 095ff59c775b3964aafbd1681dc69b03 [0,2,0,0,0,0|2,0,0]=4 6701 B12R1.27 CC[C@H](C)OCc1cccnc1 dc7942b08bf13064943cbe342b7c887c [0,2,0,0,0,0|2,0,0]=4 6702 B12R1.27 CN(C=O)CCc1ccccc1 9fb02e1cb373d4704048d9ef6c04ee21 [0,2,0,0,0,0|1,0,0]=3 6703 B12R1.27 CN(C=O)CCc1ccccn1 16a2ece4ff1bacf526fae60eca9f8ffa [0,2,0,0,0,0|2,0,0]=4 6704 B12R1.27 CN(C=O)CCc1cccnc1 ccdb98ff89857da134ddd0f017e9db4f [0,2,0,0,0,0|2,0,0]=4 6705 B12R1.27 CN(C=O)CCc1ccncc1 f145a26c0f8191f8592a6b75153f43a0 [0,2,0,0,0,0|2,0,0]=4 6706 B12R1.27 CN(CF)CCc1ccccc1 af958a660e6bf737d02c2dfab1bc467d [0,2,0,0,0,0|1,0,0]=3 6707 B12R1.27 CN(CF)CCc1ccccn1 e47249cec0a9e47647623cac83a45a8e [0,2,0,0,0,0|2,0,0]=4 6708 B12R1.27 CN(CF)CCc1cccnc1 e55726a3c32e233d630a4f29602b811f [0,2,0,0,0,0|2,0,0]=4 6709 B12R1.27 CN(CF)CCc1ccncc1 6e2d36b26079cda0d2af1bea77a09d35 [0,2,0,0,0,0|2,0,0]=4 6710 B12R1.27 CN(CO)CCc1ccccc1 c9a67cdf713e4c874ec2d63ed5e8590a [0,2,0,0,0,0|1,0,0]=3 6711 B12R1.27 CN(CO)CCc1ccccn1 aa0d4ac6d05fc927494412ee9fe9c7cc [0,2,0,0,0,0|2,0,0]=4 6712 B12R1.27 CN(CO)CCc1cccnc1 b13669a1ddf1ac46ef1460e055843b9e [0,2,0,0,0,0|2,0,0]=4 6713 B12R1.27 CN(CO)CCc1ccncc1 d571b134ccefa2efaeb2d36d2248e45c [0,2,0,0,0,0|2,0,0]=4 6714 B12R1.27 CNC(=O)CNc1ccccc1 9c8781c492a9bef282f2e4766dfd7321 [0,2,0,0,0,0|1,0,1]=4 6715 B12R1.27 COC(=O)CNc1ccccc1 4732dba1106eb1ebf4644524cb0d5858 [0,2,0,0,0,0|0,0,1]=3 6716 B12R1.27 COC(=O)CNc1ccccn1 422ec05b49687667e2eb26080da1b005 [0,2,0,0,0,0|1,0,1]=4 6717 B12R1.27 COC(=O)CNc1cccnc1 bb8fa453cbe767f1bfa38300e2133b6f [0,2,0,0,0,0|1,0,1]=4 6718 B12R1.27 COC(=O)CNc1ccncc1 4b6a9e8b399f3b2656c00a1a6d53d873 [0,2,0,0,0,0|1,0,1]=4 6719 B12R1.27 COC(=O)COc1ccccn1 b9320fa8fadd3b157619c972c855ab22 [0,2,0,0,0,0|1,0,1]=4 6720 B12R1.27 COC(=O)COc1cccnc1 4796298b812d84cf06b77d8bd60f9b41 [0,2,0,0,0,0|1,0,1]=4 6721 B12R1.27 COC(=O)COc1ccncc1 0e6c838d44328ff91eb92d7c7be39fd1 [0,2,0,0,0,0|1,0,1]=4 6722 B12R1.27 COC(C)CNc1ccccc1 8b7aea6540e0014f2969161722152c0a [0,2,0,0,0,0|0,0,0]=2 6723 B12R1.27 COC(C)CNc1ccccn1 aa1fffc4826b028b66ca3b6131bb2129 [0,2,0,0,0,0|1,0,0]=3 6724 B12R1.27 COC(C)CNc1cccnc1 22ea1776f5c64fa404e2b1d10875769b [0,2,0,0,0,0|1,0,0]=3 6725 B12R1.27 COC(C)CNc1cccnn1 57b8f2e31a89437037bb968036b0a7ad [0,2,0,0,0,0|2,0,0]=4 6726 B12R1.27 COC(C)CNc1ccncc1 8583756de850d35d798b9d18e790369d [0,2,0,0,0,0|1,0,0]=3 6727 B12R1.27 COC(C)CNc1ccncn1 9a338fed3fdbe41865e288d21845d7b6 [0,2,0,0,0,0|2,0,0]=4 6728 B12R1.27 COC(C)CNc1ccnnc1 1ef6344f5f57a524b522bc16ce4f3f7a [0,2,0,0,0,0|2,0,0]=4 6729 B12R1.27 COC(C)CNc1cnccn1 4934fe98e881c8caac1de5e17b4dc92d [0,2,0,0,0,0|2,0,0]=4 6730 B12R1.27 COC(C)CNc1cncnc1 76d1148a167534b4fcc70bd965040319 [0,2,0,0,0,0|2,0,0]=4 6731 B12R1.27 COC(C)CNc1ncccn1 8570879f1ddd8a7a1e5f6c89edecdeea [0,2,0,0,0,0|2,0,0]=4 6732 B12R1.27 COC(C)COc1ccccn1 f8dc8bfeccf22df73c7ed2e356fc48da [0,2,0,0,0,0|1,0,0]=3 6733 B12R1.27 COC(C)COc1cccnc1 9293f71aa0063e3b71a6c85117d16856 [0,2,0,0,0,0|1,0,0]=3 6734 B12R1.27 COC(C)COc1ccncc1 5fbc7e5892edbad02dcb9a66b68a62df [0,2,0,0,0,0|1,0,0]=3 6735 B12R1.27 COC(C)COc1ccnnc1 c736b03fcccbeacc05d0d73575cc4d1b [0,2,0,0,0,0|2,0,0]=4 6736 B12R1.27 COC(C)COc1cnccn1 168521879b84e34b8c393d32fd7d174c [0,2,0,0,0,0|2,0,0]=4 6737 B12R1.27 COC(C)COc1cncnc1 018a2a8d74b79afe6852ad6a79d6a6d6 [0,2,0,0,0,0|2,0,0]=4 6738 B12R1.27 COC(C)COc1ncccn1 0fcc0297343c993aabe4b47abb5acb0d [0,2,0,0,0,0|2,0,0]=4 6739 B12R1.27 CO[C@@H](C)CNc1ccccc1 1db51b6397d595cc5bd1ef07b3dce178 [0,2,0,0,0,0|0,0,0]=2 6740 B12R1.27 CO[C@@H](C)CNc1ccccn1 3f6f24d683b32bf983db741333c2969d [0,2,0,0,0,0|1,0,0]=3 6741 B12R1.27 CO[C@@H](C)CNc1cccnc1 ed45e74a30d0fad7831c896f4455a3e9 [0,2,0,0,0,0|1,0,0]=3 6742 B12R1.27 CO[C@@H](C)CNc1cccnn1 a7aab28edd21d3a5ef3d70cba3e8d7f9 [0,2,0,0,0,0|2,0,0]=4 6743 B12R1.27 CO[C@@H](C)CNc1ccncc1 321a70901c24d6141307a3fd83345c5f [0,2,0,0,0,0|1,0,0]=3 6744 B12R1.27 CO[C@@H](C)CNc1ccncn1 917b47bd5f497576d3e7486855c6ee57 [0,2,0,0,0,0|2,0,0]=4 6745 B12R1.27 CO[C@@H](C)CNc1ccnnc1 bd91b33e1ab00e0320ecd558add50c2b [0,2,0,0,0,0|2,0,0]=4 6746 B12R1.27 CO[C@@H](C)CNc1cnccn1 53ae0935256e105b3eb7c609b854c909 [0,2,0,0,0,0|2,0,0]=4 6747 B12R1.27 CO[C@@H](C)CNc1cncnc1 ae65d70c0954de37db4895592764b4d0 [0,2,0,0,0,0|2,0,0]=4 6748 B12R1.27 CO[C@@H](C)CNc1ncccn1 0812a69d040d25016f59a08e6acb2161 [0,2,0,0,0,0|2,0,0]=4 6749 B12R1.27 CO[C@@H](C)COc1ccccn1 74e5eb55678aa99f2f01dd02e58c0f99 [0,2,0,0,0,0|1,0,0]=3 6750 B12R1.27 CO[C@@H](C)COc1cccnc1 4625df0874e428ea62a16a84848b31c3 [0,2,0,0,0,0|1,0,0]=3 6751 B12R1.27 CO[C@@H](C)COc1ccncc1 a06e60f07f6a57574e8cbc8ff90265e7 [0,2,0,0,0,0|1,0,0]=3 6752 B12R1.27 CO[C@@H](C)COc1ccnnc1 6c807b2fe478ce11e5850217979ae864 [0,2,0,0,0,0|2,0,0]=4 6753 B12R1.27 CO[C@@H](C)COc1cnccn1 b74633bf8dc1ffc4614cbf0963cc0979 [0,2,0,0,0,0|2,0,0]=4 6754 B12R1.27 CO[C@@H](C)COc1cncnc1 b7287c1396ba7fd311664ce2851613b9 [0,2,0,0,0,0|2,0,0]=4 6755 B12R1.27 CO[C@@H](C)COc1ncccn1 d43b5c2f21fcbe512af85251c28b8a25 [0,2,0,0,0,0|2,0,0]=4 6756 B12R1.27 CO[C@H](C)CNc1ccccc1 b7b86a2dea3233b080c54d71a8f46990 [0,2,0,0,0,0|0,0,0]=2 6757 B12R1.27 CO[C@H](C)CNc1ccccn1 04ec0231ca9bc4cf1eff96f841c37724 [0,2,0,0,0,0|1,0,0]=3 6758 B12R1.27 CO[C@H](C)CNc1cccnc1 3d28dbb191d334198e2e90ddce2fa1a4 [0,2,0,0,0,0|1,0,0]=3 6759 B12R1.27 CO[C@H](C)CNc1cccnn1 308d9b61ca0613da225819a6631aa0ff [0,2,0,0,0,0|2,0,0]=4 6760 B12R1.27 CO[C@H](C)CNc1ccncc1 bd2ba612a637b68c883a6591cf32e881 [0,2,0,0,0,0|1,0,0]=3 6761 B12R1.27 CO[C@H](C)CNc1ccncn1 7bf1aa7877bed7ec80381d13b25beaa6 [0,2,0,0,0,0|2,0,0]=4 6762 B12R1.27 CO[C@H](C)CNc1ccnnc1 0b1e03d7a3c7cf42a00b9ce336a3dc0b [0,2,0,0,0,0|2,0,0]=4 6763 B12R1.27 CO[C@H](C)CNc1cnccn1 b719a317b586b472c3ca3ba92317ee19 [0,2,0,0,0,0|2,0,0]=4 6764 B12R1.27 CO[C@H](C)CNc1cncnc1 57edc74303f1d79aedad731207c3d117 [0,2,0,0,0,0|2,0,0]=4 6765 B12R1.27 CO[C@H](C)CNc1ncccn1 b988e20ae9c69cfad8a575078571ad98 [0,2,0,0,0,0|2,0,0]=4 6766 B12R1.27 CO[C@H](C)COc1ccccn1 48788836bfd03aade6f0bd2c51b60c5c [0,2,0,0,0,0|1,0,0]=3 6767 B12R1.27 CO[C@H](C)COc1cccnc1 a0e969ee0f3c10fe22a63e3d03e64109 [0,2,0,0,0,0|1,0,0]=3 6768 B12R1.27 CO[C@H](C)COc1ccncc1 8e99d9b0419ebb5515c91639e755a31d [0,2,0,0,0,0|1,0,0]=3 6769 B12R1.27 CO[C@H](C)COc1ccnnc1 f945c9bbfb6b3f9636756fc0824691de [0,2,0,0,0,0|2,0,0]=4 6770 B12R1.27 CO[C@H](C)COc1cnccn1 f10e17992a6825010ede7d0e515d88a7 [0,2,0,0,0,0|2,0,0]=4 6771 B12R1.27 CO[C@H](C)COc1cncnc1 2e85b0fd0e5e5e9f49a37e10ec2a6b1b [0,2,0,0,0,0|2,0,0]=4 6772 B12R1.27 CO[C@H](C)COc1ncccn1 f5255e9db0e1162de21d873188fcd514 [0,2,0,0,0,0|2,0,0]=4 6773 B12R1.27 C[C@@H](CO)CNc1ccccc1 8acaf8396f10bf3948fe3b52f4656e75 [0,2,0,0,0,0|2,0,0]=4 6774 B12R1.27 C[C@@H](CO)NCc1ccccc1 a52866c987a35d6e1a5b62fda8afddea [0,2,0,0,0,0|2,0,0]=4 6775 B12R1.27 C[C@H](C=O)NCc1ccccc1 645b627cd889138b5240bcb1ce686b72 [0,2,0,0,0,0|2,0,0]=4 6776 B12R1.27 C[C@H](C=O)OCc1ccccc1 d71860644cbe1541da13b3966902f7f7 [0,2,0,0,0,0|2,0,0]=4 6777 B12R1.27 C[C@H](CO)CNc1ccccc1 de01f7c1f1d3b008ec664fad35110bba [0,2,0,0,0,0|2,0,0]=4 6778 B12R1.27 C[C@H](CO)NCc1ccccc1 6eed9f4ff81e8b8226b9282b8f3ad13f [0,2,0,0,0,0|2,0,0]=4 6779 B12R1.27 C[C@H](CS)OCc1ccccc1 76a62ad706fe4942b152f21141bdace8 [0,2,0,0,0,0|2,0,0]=4 6780 B12R1.27 O=C(CF)NCc1ccccc1 44d0634b73cc2a3134198abb702adc32 [0,2,0,0,0,0|2,0,0]=4 6781 B12R1.27 O=C(CO)CNc1ccccc1 1cf374c57dfb525ce3f48cecf3edf550 [0,2,0,0,0,0|2,0,0]=4 6782 B12R1.27 O=C(CO)NCc1ccccc1 f4f787a5214848c6970058ebdb73c876 [0,2,0,0,0,0|2,0,0]=4 6783 B12R1.27 O=C(CS)NCc1ccccc1 f91da9c658c39a4f0c257ce61b60a1a7 [0,2,0,0,0,0|2,0,0]=4 6784 B12R1.27 OC(CF)CNc1ccccc1 e518893c8dbaaac7e0289d266d42fc20 [0,2,0,0,0,0|2,0,0]=4 6785 B12R1.27 OCC(F)CNc1ccccc1 12f6637854cd5607d7beeb33d98c9d66 [0,2,0,0,0,0|2,0,0]=4 6786 B12R1.27 OCC(O)CNc1ccccc1 2c98ea52c81c0230088b12196d6eb24a [0,2,0,0,0,0|2,0,0]=4 6787 B12R1.27 OC[C@@H](F)CNc1ccccc1 df0a72159854bbc7d14ee531e659ec9c [0,2,0,0,0,0|2,0,0]=4 6788 B12R1.27 OC[C@@H](O)CNc1ccccc1 d5ed593b781b051c17ac5c0f665c9b28 [0,2,0,0,0,0|2,0,0]=4 6789 B12R1.27 OC[C@H](F)CNc1ccccc1 9734eac13b001b84d3ee28ab012b0276 [0,2,0,0,0,0|2,0,0]=4 6790 B12R1.27 OC[C@H](O)CNc1ccccc1 4df6835ea35fcadc1546d95d2a23469d [0,2,0,0,0,0|2,0,0]=4 6791 B12R1.32 C#CCN(C)Cc1ccccc1 e56580931f8cdab6398e6e077f7d4a03 [0,2,0,0,0,0|1,0,1]=4 6792 B12R1.32 C=CCN(C)Cc1ccccc1 f858c6ed41b995ef747d3394b7bc7ac3 [0,2,0,0,0,0|1,0,1]=4 6793 B12R1.32 CC(CC#N)Nc1ccccc1 9d497ef86eee6b3cf19732b73151dfc5 [0,2,0,0,0,0|2,0,0]=4 6794 B12R1.32 CC(CCO)Nc1ccccc1 9bf70c52b6fbdda0acbad0fbf8bda5d0 [0,2,0,0,0,0|2,0,0]=4 6795 B12R1.32 CC(Cc1ccccn1)NCF d5fdd6b98c347b6317b5d0d8cf3c28b6 [0,2,0,0,0,0|2,0,0]=4 6796 B12R1.32 CC(Cc1ccccn1)NCO eb641c414d0b15108bf9321647b7890c [0,2,0,0,0,0|2,0,0]=4 6797 B12R1.32 CC(Cc1ccccn1)OCF d6c424851ea201f763a1418247a6eb34 [0,2,0,0,0,0|1,0,0]=3 6798 B12R1.32 CC(Cc1cccnc1)NCF 0a8331e6b65f8d98e5c22c4682170fe6 [0,2,0,0,0,0|2,0,0]=4 6799 B12R1.32 CC(Cc1cccnc1)NCO 2d1e9d214ab4e58b5282fe30111314e4 [0,2,0,0,0,0|2,0,0]=4 6800 B12R1.32 CC(Cc1ccncc1)NCF 552d22a85f958469339986039ae7dce3 [0,2,0,0,0,0|2,0,0]=4 6801 B12R1.32 CC(Cc1ccncc1)NCO def23991f96c3f6436149b61afb90490 [0,2,0,0,0,0|2,0,0]=4 6802 B12R1.32 CC(Cc1cnccn1)OCF 19c4f4c9a50c77974aa8cdac147d1ec7 [0,2,0,0,0,0|2,0,0]=4 6803 B12R1.32 CCCC(C)Nc1ccccc1 0980d123cfa1556625b2cd315916fb5f [0,2,0,0,0,0|1,0,0]=3 6804 B12R1.32 CCCC(C)Nc1ccccn1 2669f8567b938ac2a918e85bd69bb770 [0,2,0,0,0,0|2,0,0]=4 6805 B12R1.32 CCCC(C)Nc1cccnc1 af2a7472e895c61981327f4b8de00ee9 [0,2,0,0,0,0|2,0,0]=4 6806 B12R1.32 CCCC(C)Nc1ccncc1 bc7c26623f29f55d18fe6bfa5e660a5e [0,2,0,0,0,0|2,0,0]=4 6807 B12R1.32 CCCC(C)Oc1ccccn1 f14a322e30e4491e36792a6fd64a30e7 [0,2,0,0,0,0|2,0,0]=4 6808 B12R1.32 CCCC(C)Oc1cccnc1 16283b7b4266224a92efdc8338a94776 [0,2,0,0,0,0|2,0,0]=4 6809 B12R1.32 CCCC(C)Oc1ccncc1 b9d7beb71b6c3dd797277820c00f9552 [0,2,0,0,0,0|2,0,0]=4 6810 B12R1.32 CCCN(C)Cc1ccccc1 4eed5f3692a34dc05deac3e14f757f4f [0,2,0,0,0,0|1,0,0]=3 6811 B12R1.32 CCCN(C)Cc1ccccn1 2ba7f31870dc6781d668ec555cfac4b5 [0,2,0,0,0,0|2,0,0]=4 6812 B12R1.32 CCCN(C)Cc1cccnc1 60746a1075dd28e04eb10086fae0b820 [0,2,0,0,0,0|2,0,0]=4 6813 B12R1.32 CCCN(C)Cc1ccncc1 a69c5a082934587e8fadc56e06a02243 [0,2,0,0,0,0|2,0,0]=4 6814 B12R1.32 CCC[C@H](C)Nc1ccccc1 14114dc7aca9a95d33818d8f8cfafa73 [0,2,0,0,0,0|1,0,0]=3 6815 B12R1.32 CCNC(C)Cc1ccccn1 3f739570fdaf944ffb41444c69149a83 [0,2,0,0,0,0|2,0,0]=4 6816 B12R1.32 CCNC(C)Cc1cccnc1 1c73ce06501092b14624237b8eaa830e [0,2,0,0,0,0|2,0,0]=4 6817 B12R1.32 CCNC(C)Cc1ccncc1 1ac39eab33f6c8633237d01993a17382 [0,2,0,0,0,0|2,0,0]=4 6818 B12R1.32 CCOC(C)Cc1ccccc1 37a2c2b5ef50b1a7cf2088b7456e4451 [0,2,0,0,0,0|0,0,0]=2 6819 B12R1.32 CCOC(C)Cc1ccccn1 144eae020541eabb52d7b3534ceef0a4 [0,2,0,0,0,0|1,0,0]=3 6820 B12R1.32 CCOC(C)Cc1cnccn1 3ecdf3d8e361b30d87e2f6f581391495 [0,2,0,0,0,0|2,0,0]=4 6821 B12R1.32 CCO[C@@H](C)Cc1ccccc1 19276107fa4d022850aeee4089dafd0c [0,2,0,0,0,0|0,0,0]=2 6822 B12R1.32 CCO[C@H](C)Cc1ccccc1 2f8e91d1dc9d2f9667dcff63e87e082c [0,2,0,0,0,0|0,0,0]=2 6823 B12R1.32 CN(CC#N)Cc1ccccc1 5c32846a8b8f40e8ba55bc3d3a77884c [0,2,0,0,0,0|2,0,0]=4 6824 B12R1.32 CN(CC=O)Cc1ccccc1 7580b9a13b83ef7e7f2ffe8dfb9a649a [0,2,0,0,0,0|2,0,0]=4 6825 B12R1.32 CN(CCF)Cc1ccccc1 c2bce3f6897fd6361961da43db186c6c [0,2,0,0,0,0|2,0,0]=4 6826 B12R1.32 CN(CCO)Cc1ccccc1 757bf36fdf4b02517da3241e86467be6 [0,2,0,0,0,0|2,0,0]=4 6827 B12R1.32 CN(CCS)Cc1ccccc1 8e8f744accb260bbf35bc2715f513a4e [0,2,0,0,0,0|2,0,0]=4 6828 B12R1.32 COCC(=O)Nc1ccccn1 f9e6fd9fc57ce0d213e8a8a98f19e960 [0,2,0,0,0,0|1,0,1]=4 6829 B12R1.32 COCC(=O)Nc1cccnc1 e27fb687fb4d23b787105034a2444ccc [0,2,0,0,0,0|1,0,1]=4 6830 B12R1.32 COCC(C)Nc1ccccc1 918c3e9faef698920f78ca93350fda53 [0,2,0,0,0,0|0,0,0]=2 6831 B12R1.32 COCC(C)Nc1ccccn1 b87c4274a798014c5caa22801a140abd [0,2,0,0,0,0|1,0,0]=3 6832 B12R1.32 COCC(C)Nc1cccnc1 b812752e64d8737319fd6f3db07b6bc1 [0,2,0,0,0,0|1,0,0]=3 6833 B12R1.32 COCC(C)Nc1cccnn1 706a02eb6ddc599c7da65191d8bff4aa [0,2,0,0,0,0|2,0,0]=4 6834 B12R1.32 COCC(C)Nc1ccncc1 33b554ac3febbeb05911740b59f936a4 [0,2,0,0,0,0|1,0,0]=3 6835 B12R1.32 COCC(C)Nc1ccncn1 5f719d5ba83ffe96b94fa9664f636602 [0,2,0,0,0,0|2,0,0]=4 6836 B12R1.32 COCC(C)Nc1ccnnc1 8cd64052623ef14215699acb7ecbce80 [0,2,0,0,0,0|2,0,0]=4 6837 B12R1.32 COCC(C)Nc1cnccn1 889b7cc55a844b93564b89b38cf0517e [0,2,0,0,0,0|2,0,0]=4 6838 B12R1.32 COCC(C)Nc1cncnc1 0e508ec3dccdbcdc81634e93e9db5a2e [0,2,0,0,0,0|2,0,0]=4 6839 B12R1.32 COCC(C)Nc1ncccn1 ed074a007ddb3aaecb983c3f1308f4eb [0,2,0,0,0,0|2,0,0]=4 6840 B12R1.32 COCC(C)Oc1ccccn1 668fa5e1f0515f975b72eaca09bba005 [0,2,0,0,0,0|1,0,0]=3 6841 B12R1.32 COCC(C)Oc1cccnc1 e8657e7fea231a3cbb0976e5d4a5b3d8 [0,2,0,0,0,0|1,0,0]=3 6842 B12R1.32 COCC(C)Oc1ccncc1 971ee2e47f6b711ed0fcda630805e921 [0,2,0,0,0,0|1,0,0]=3 6843 B12R1.32 COCC(C)Oc1ccnnc1 044ee401f3d10fc4489e5c6c82b7044b [0,2,0,0,0,0|2,0,0]=4 6844 B12R1.32 COCC(C)Oc1cnccn1 0c9552f56f369faf7edd37c2f274a26c [0,2,0,0,0,0|2,0,0]=4 6845 B12R1.32 COCC(C)Oc1cncnc1 6b24792dd03db001bc69444a60c77567 [0,2,0,0,0,0|2,0,0]=4 6846 B12R1.32 COCC(C)Oc1ncccn1 ac382cecf32b2f838ef531f80c1fdd40 [0,2,0,0,0,0|2,0,0]=4 6847 B12R1.32 COCN(C)Cc1ccccc1 4d05c3d6ddf3ecec9a6b681c1068023b [0,2,0,0,0,0|0,0,0]=2 6848 B12R1.32 COCN(C)Cc1ccccn1 be6855095994cc4fb8e97c0a5352a8a9 [0,2,0,0,0,0|1,0,0]=3 6849 B12R1.32 COCN(C)Cc1cccnc1 f50236404b504213455088d1b436a4c1 [0,2,0,0,0,0|1,0,0]=3 6850 B12R1.32 COCN(C)Cc1ccncc1 2c07abbe7586e08e1f7bb635b66559e0 [0,2,0,0,0,0|1,0,0]=3 6851 B12R1.32 COCN(C)Cc1ccnnc1 625af7867fd8d52f59eb88db81d25159 [0,2,0,0,0,0|2,0,0]=4 6852 B12R1.32 COCN(C)Cc1cnccn1 b71aa0573c49daf69cc2f163b159c115 [0,2,0,0,0,0|2,0,0]=4 6853 B12R1.32 COCN(C)Cc1cncnc1 f34e02720a027720579645a3f3146454 [0,2,0,0,0,0|2,0,0]=4 6854 B12R1.32 COCN(C)Cc1ncccn1 809c437b916af26b6a2bcc039099351b [0,2,0,0,0,0|2,0,0]=4 6855 B12R1.32 COC[C@@H](C)Nc1ccccc1 b6337fbd6f770477a80a235354ba550b [0,2,0,0,0,0|0,0,0]=2 6856 B12R1.32 COC[C@@H](C)Nc1cccnc1 516207c81acf2dd1d4472d7b45572390 [0,2,0,0,0,0|1,0,0]=3 6857 B12R1.32 COC[C@@H](C)Nc1cccnn1 ccee5bf26bb2372a5999a0b0af733626 [0,2,0,0,0,0|2,0,0]=4 6858 B12R1.32 COC[C@@H](C)Nc1ccncn1 e5a429e6965c597cb7c868a083c3ea07 [0,2,0,0,0,0|2,0,0]=4 6859 B12R1.32 COC[C@H](C)Nc1ccccc1 6b0bb5bdf147fc56918f57a798a463a2 [0,2,0,0,0,0|0,0,0]=2 6860 B12R1.32 COC[C@H](C)Nc1cccnc1 0cec544e296a1ace9f6fb9794ec8ae21 [0,2,0,0,0,0|1,0,0]=3 6861 B12R1.32 COC[C@H](C)Nc1cccnn1 9fd5102cd92dfa039072b660fc3d61c4 [0,2,0,0,0,0|2,0,0]=4 6862 B12R1.32 COC[C@H](C)Nc1ccncn1 c8f27b99cc25e16a1494f4e3f4ad4898 [0,2,0,0,0,0|2,0,0]=4 6863 B12R1.32 CSCN(C)Cc1ccccc1 d9791fc92d257d5436d9d59fe9a2c04e [0,2,0,0,0,0|0,1,0]=3 6864 B12R1.32 CSCN(C)Cc1ccccn1 800949e21971faefc87feb49b8f46bb4 [0,2,0,0,0,0|1,1,0]=4 6865 B12R1.32 CSCN(C)Cc1cccnc1 477b2a8c97766858e2c1454088c6776f [0,2,0,0,0,0|1,1,0]=4 6866 B12R1.32 CSCN(C)Cc1ccncc1 854245fcfb993ce0bf06ba09f5a61c33 [0,2,0,0,0,0|1,1,0]=4 6867 B12R1.32 C[C@@H](CCO)Nc1ccccc1 fc83b26b05d5bb1e6a4de978429a6aa3 [0,2,0,0,0,0|2,0,0]=4 6868 B12R1.32 C[C@H](CCO)Nc1ccccc1 83604672ebfdf7df8b733c8cb4f2aa8a [0,2,0,0,0,0|2,0,0]=4 6869 B12R1.32 NOCC(=O)Nc1ccccc1 c5d51d2b3f28976c6bd3c98cfe9f6a86 [0,2,0,0,0,0|1,0,1]=4 6870 B12R1.252 C/C(=C/CNc1ccccc1)/I 0655b4b8bd1a651f428f8af38afb9805 [0,2,0,0,0,0|1,0,1]=4 6871 B12R1.252 C/C(=C\CNc1ccccc1)/Cl 03a2a67b224185dfa00dfc501ddc5144 [0,2,0,0,0,0|1,0,1]=4 6872 B12R1.252 C=C(Br)CNCc1ccccc1 9c1b05ca270d752c1d4010b95922e620 [0,2,0,0,0,0|1,0,1]=4 6873 B12R1.252 C=C(Br)COCc1ccccc1 03171f9a997e7b5e8cadd59a879b8b6c [0,2,0,0,0,0|1,0,1]=4 6874 B12R1.252 C=C(C)CCNc1ccccc1 6b5b9510ef6be8f5a83e582e3308e56d [0,2,0,0,0,0|1,0,0]=3 6875 B12R1.252 C=C(C)CCNc1ccccn1 5994b7e570337056fbe6b8ee68c83a74 [0,2,0,0,0,0|2,0,0]=4 6876 B12R1.252 C=C(C)CCNc1cccnc1 dcc89e34d299a787ec22fb495cec5588 [0,2,0,0,0,0|2,0,0]=4 6877 B12R1.252 C=C(C)CCNc1ccncc1 922d92a6de36274534be2ae1cfc3557f [0,2,0,0,0,0|2,0,0]=4 6878 B12R1.252 C=C(C)CCOc1ccccn1 b9dcf3d8853aa13bb161ef3e0a8cb2ac [0,2,0,0,0,0|2,0,0]=4 6879 B12R1.252 C=C(C)CCOc1cccnc1 d43cc30ba2b0fd5d44c99c3588da0768 [0,2,0,0,0,0|2,0,0]=4 6880 B12R1.252 C=C(C)CCOc1ccncc1 898536726fe290623b1b4e2f99fbff1d [0,2,0,0,0,0|2,0,0]=4 6881 B12R1.252 C=C(C)CNCc1ccccc1 5d90204cfd05ab0918bdacf95677a05b [0,2,0,0,0,0|1,0,0]=3 6882 B12R1.252 C=C(C)CNCc1ccccn1 788a85ae04da57a30dfed7c4f6861e88 [0,2,0,0,0,0|2,0,0]=4 6883 B12R1.252 C=C(C)CNCc1cccnc1 192e89945e3f944c819998a53866b100 [0,2,0,0,0,0|2,0,0]=4 6884 B12R1.252 C=C(C)CNCc1ccncc1 e4f63cc6fa926c0fb5bcf5ca7df3c639 [0,2,0,0,0,0|2,0,0]=4 6885 B12R1.252 C=C(C)COCc1ccccc1 f4499d14dd2f7bb4726f716f15e929df [0,2,0,0,0,0|1,0,0]=3 6886 B12R1.252 C=C(C)COCc1ccccn1 6969eb42119ffe7768529c61d80d21e6 [0,2,0,0,0,0|2,0,0]=4 6887 B12R1.252 C=C(C)COCc1cccnc1 b1309dd5e0e34a6f1f94f4da7e73dca6 [0,2,0,0,0,0|2,0,0]=4 6888 B12R1.252 C=C(C)COCc1ccncc1 59009e1728de50bbf4f23e46b346867c [0,2,0,0,0,0|2,0,0]=4 6889 B12R1.252 C=C(Cl)CNCc1ccccc1 d045578b64ad4263f98d93d0c0da8316 [0,2,0,0,0,0|1,0,1]=4 6890 B12R1.252 C=C(Cl)COCc1ccccc1 8ea87585e2ec6fc9c83af9159d3e33eb [0,2,0,0,0,0|1,0,1]=4 6891 B12R1.252 C=C(F)CNCc1ccccc1 e1a9166891b5eedd5de2496e23c16415 [0,2,0,0,0,0|1,0,1]=4 6892 B12R1.252 C=C(F)COCc1ccccc1 0270311e0993ffc2a11a2318afb6410f [0,2,0,0,0,0|1,0,1]=4 6893 B12R1.252 C=C(I)COCc1ccccc1 516dafeab05685e2cd864f8688136ad5 [0,2,0,0,0,0|1,0,1]=4 6894 B12R1.252 CC(=CCNc1ccccc1)C eb01c4541faf3d2e0c0e5ab3c7071819 [0,2,0,0,0,0|1,0,1]=4 6895 B12R1.252 CC(=CCNc1ccccc1)Cl f13a71d1d4148a74f0302cf2c11de8f3 [0,2,0,0,0,0|1,0,1]=4 6896 B12R1.252 CC(=CCNc1ccccc1)I ca45f16e4e3e563d8f77df266f95064c [0,2,0,0,0,0|1,0,1]=4 6897 B12R1.252 CC(=O)CCNc1ccccc1 9b0f0a0043bcfdd99ee44d3d72b922e5 [0,2,0,0,0,0|1,0,0]=3 6898 B12R1.252 CC(=O)CCNc1ccccn1 997919901794ee27201838f3f268a693 [0,2,0,0,0,0|2,0,0]=4 6899 B12R1.252 CC(=O)CCNc1cccnc1 d55d133f13b833b5bf8507a979c71c53 [0,2,0,0,0,0|2,0,0]=4 6900 B12R1.252 CC(=O)CCNc1ccncc1 bbf0d1b9e62272e08678140c87e735f6 [0,2,0,0,0,0|2,0,0]=4 6901 B12R1.252 CC(=O)CCOc1ccccn1 f0d6b589e7af691479be38abbd6bcdf3 [0,2,0,0,0,0|2,0,0]=4 6902 B12R1.252 CC(=O)CCOc1cccnc1 67dae2709723517ab5af883d0837054b [0,2,0,0,0,0|2,0,0]=4 6903 B12R1.252 CC(=O)CCOc1ccncc1 1ac74c4f9261a84ccdad1c4e049e9ece [0,2,0,0,0,0|2,0,0]=4 6904 B12R1.252 CC(=O)CNCc1ccccc1 5e4599c3af112643425e1a35238a896f [0,2,0,0,0,0|1,0,0]=3 6905 B12R1.252 CC(=O)CNCc1ccccn1 6857f6976c347e411d9abdd48f8982fb [0,2,0,0,0,0|2,0,0]=4 6906 B12R1.252 CC(=O)CNCc1cccnc1 39d89333d7252b4434a1fdfd17a4d718 [0,2,0,0,0,0|2,0,0]=4 6907 B12R1.252 CC(=O)COCc1ccccc1 18daaa7c0d669a182de591929c861cbe [0,2,0,0,0,0|1,0,0]=3 6908 B12R1.252 CC(=O)COCc1ccccn1 f8ed3ffb815bee7f1737eacfe042d64f [0,2,0,0,0,0|2,0,0]=4 6909 B12R1.252 CC(=O)COCc1cccnc1 36638c01e0a61511be9d007508b97b48 [0,2,0,0,0,0|2,0,0]=4 6910 B12R1.252 CC(=O)NCCc1ccccc1 1052e9521fedb3e85cab4ef571c55982 [0,2,0,0,0,0|1,0,0]=3 6911 B12R1.252 CC(=O)NCCc1ccccn1 3ad8e2876430ef8ccd3cbeba8ed6119f [0,2,0,0,0,0|2,0,0]=4 6912 B12R1.252 CC(=O)NCCc1cccnc1 3962e9654ba13e9ef1bdd3c037e7deff [0,2,0,0,0,0|2,0,0]=4 6913 B12R1.252 CC(=O)NCCc1ccncc1 56311f224412b2ab7d4e3e56f79fd239 [0,2,0,0,0,0|2,0,0]=4 6914 B12R1.252 CC(=O)OCNc1ccccc1 6887be863fb786ec7dd333ad6d1f93a1 [0,2,0,0,0,0|1,0,0]=3 6915 B12R1.252 CC(=O)OCNc1ccccn1 a41f1b71ededa97eb4355e9af8654026 [0,2,0,0,0,0|2,0,0]=4 6916 B12R1.252 CC(=O)OCNc1cccnc1 4178bffb832b0edcfc9121cf9bba84c2 [0,2,0,0,0,0|2,0,0]=4 6917 B12R1.252 CC(=O)OCNc1ccncc1 108d237aa1f6f8444cb5b9cf1463791c [0,2,0,0,0,0|2,0,0]=4 6918 B12R1.252 CC(=O)OCOc1ccccn1 86abcd8d807149e2e6ef73302de6ba90 [0,2,0,0,0,0|2,0,0]=4 6919 B12R1.252 CC(=O)OCOc1cccnc1 276102d131e97a552c86e2e9163e6724 [0,2,0,0,0,0|2,0,0]=4 6920 B12R1.252 CC(=O)OCOc1ccncc1 cfb5cc299f2c001f2ecc804da49cda8d [0,2,0,0,0,0|2,0,0]=4 6921 B12R1.252 CC(C)CCNc1ccccc1 a9665cd268e7b4518a4ee939be46ff28 [0,2,0,0,0,0|1,0,0]=3 6922 B12R1.252 CC(C)CCNc1ccccn1 5b6942b64e33834b458baec7cf378581 [0,2,0,0,0,0|2,0,0]=4 6923 B12R1.252 CC(C)CCNc1cccnc1 69f5877c25712220cf9d8582cf74056f [0,2,0,0,0,0|2,0,0]=4 6924 B12R1.252 CC(C)CCNc1ccncc1 51f5e7e7cccdd7bf4f868dbc1d306bf9 [0,2,0,0,0,0|2,0,0]=4 6925 B12R1.252 CC(C)CCOc1ccccn1 7f883afab874ab8f83be331ad8cd7edb [0,2,0,0,0,0|2,0,0]=4 6926 B12R1.252 CC(C)CCOc1cccnc1 b89b58f2b508e626016a4b78466a2d25 [0,2,0,0,0,0|2,0,0]=4 6927 B12R1.252 CC(C)CCOc1ccncc1 d280f435e28fd77803bc44ac9ebf5e18 [0,2,0,0,0,0|2,0,0]=4 6928 B12R1.252 CC(C)CNCc1ccccc1 c48ab8ad76cb980676fd518bfed01255 [0,2,0,0,0,0|1,0,0]=3 6929 B12R1.252 CC(C)CNCc1ccccn1 6d7ebb6c45d12163344e2670abad50d7 [0,2,0,0,0,0|2,0,0]=4 6930 B12R1.252 CC(C)CNCc1cccnc1 317cc81cae733d174c088ce8c918791e [0,2,0,0,0,0|2,0,0]=4 6931 B12R1.252 CC(C)CNCc1ccncc1 e68ace07204ad5f64fa8daf124fe226c [0,2,0,0,0,0|2,0,0]=4 6932 B12R1.252 CC(C)COCc1ccccc1 5769ac6c29ea9be863f0068a3148d1e9 [0,2,0,0,0,0|1,0,0]=3 6933 B12R1.252 CC(C)COCc1ccccn1 41f471be8d0443a395a59a6edd4b2170 [0,2,0,0,0,0|2,0,0]=4 6934 B12R1.252 CC(C)COCc1cccnc1 e949ee90c476dd3afee631c02891b751 [0,2,0,0,0,0|2,0,0]=4 6935 B12R1.252 CC(C)COCc1ccncc1 243716518cbf836169ff83c6e87d1a68 [0,2,0,0,0,0|2,0,0]=4 6936 B12R1.252 CC(C)NCCc1ccccc1 800f62166be48d31d0f1f8e8246a3d11 [0,2,0,0,0,0|1,0,0]=3 6937 B12R1.252 CC(C)NCCc1ccccn1 60db3ccccaed87369474311fbbb2ee61 [0,2,0,0,0,0|2,0,0]=4 6938 B12R1.252 CC(C)NCCc1cccnc1 f39609cf740b878733069b3389a379d4 [0,2,0,0,0,0|2,0,0]=4 6939 B12R1.252 CC(C)NCCc1ccncc1 2e03fedf55e71e95c0abd0f4865dc22e [0,2,0,0,0,0|2,0,0]=4 6940 B12R1.252 CC(C)OCCc1ccccc1 cd2036e50db53ec52d80c5b70290b19c [0,2,0,0,0,0|0,0,0]=2 6941 B12R1.252 CC(C)OCCc1ccccn1 618810b4708a73ec52035c34c4054b87 [0,2,0,0,0,0|1,0,0]=3 6942 B12R1.252 CC(C)OCCc1cccnc1 ad83d4217e0420d4f686447a978fc953 [0,2,0,0,0,0|1,0,0]=3 6943 B12R1.252 CC(C)OCCc1ccncc1 07cefd4f30952a7fff1efa12f3f8cb0e [0,2,0,0,0,0|1,0,0]=3 6944 B12R1.252 CC(C)OCCc1ccncn1 f1ce6c97a497c9e91937eebb9f30c7a6 [0,2,0,0,0,0|2,0,0]=4 6945 B12R1.252 CC(C)OCCc1cnccn1 ae26b65e22ea6fcf5c22fdff048110ff [0,2,0,0,0,0|2,0,0]=4 6946 B12R1.252 CC(C)OCCc1ncccn1 c1c5cf56502b5e60b3dba4a7a219c587 [0,2,0,0,0,0|2,0,0]=4 6947 B12R1.252 CC(C)OCNc1ccccc1 4ab9f406843d3d3dea8c678f7ec5fd29 [0,2,0,0,0,0|1,0,0]=3 6948 B12R1.252 CC(C)OCNc1ccccn1 f79533e956cd51a6f0cee4ac927e1136 [0,2,0,0,0,0|2,0,0]=4 6949 B12R1.252 CC(C)OCNc1cccnc1 6dd37a3ca9a4168d344f1af36676e50f [0,2,0,0,0,0|2,0,0]=4 6950 B12R1.252 CC(C)OCNc1ccncc1 8f9b47fcb224f8aeae405dd2ac59e733 [0,2,0,0,0,0|2,0,0]=4 6951 B12R1.252 CC(C)OCOc1ccccn1 1f60fa9657a31d54ae86707f451d8353 [0,2,0,0,0,0|2,0,0]=4 6952 B12R1.252 CC(C)OCOc1cccnc1 0adf6c0a61ffae293502a60ec48e9b78 [0,2,0,0,0,0|2,0,0]=4 6953 B12R1.252 CC(C)OCOc1ccncc1 2419024f861ffb40c39021803c819ad7 [0,2,0,0,0,0|2,0,0]=4 6954 B12R1.252 CC(F)COCc1ccccc1 ceaaa348669e5aa8cbad2a4c64558f8e [0,2,0,0,0,0|1,0,0]=3 6955 B12R1.252 CC(F)COCc1ccccn1 476695497df80cb7c084184b5b43d035 [0,2,0,0,0,0|2,0,0]=4 6956 B12R1.252 CC(F)COCc1cccnc1 c074e95bfd5d6d05bfe23c42186cba2a [0,2,0,0,0,0|2,0,0]=4 6957 B12R1.252 CC(O)CCNc1ccccc1 5c6c9358fbd8939fc6c9f54dcb2d3a37 [0,2,0,0,0,0|1,0,0]=3 6958 B12R1.252 CC(O)CCNc1ccccn1 97031b4d64979d289ef04acc206d003e [0,2,0,0,0,0|2,0,0]=4 6959 B12R1.252 CC(O)CCNc1cccnc1 ddabe466465a030ebf6055c0cc168740 [0,2,0,0,0,0|2,0,0]=4 6960 B12R1.252 CC(O)CCNc1ccncc1 c1ccc95455595767ca368700397c2d43 [0,2,0,0,0,0|2,0,0]=4 6961 B12R1.252 CC(O)CNCc1ccccc1 19d19f96fb686d7cbd72f5df359e9dd8 [0,2,0,0,0,0|1,0,0]=3 6962 B12R1.252 CC(O)CNCc1ccccn1 e28c29c938e18ad1238cd975f89a06a8 [0,2,0,0,0,0|2,0,0]=4 6963 B12R1.252 CC(O)CNCc1cccnc1 0379a455e7b583f17fba58d3189059b6 [0,2,0,0,0,0|2,0,0]=4 6964 B12R1.252 CC(O)CNCc1ccncc1 e21fcdc654ebe2a7b579b387cc55b8af [0,2,0,0,0,0|2,0,0]=4 6965 B12R1.252 CC(S)COCc1ccccc1 a2dbb8c27ced04cd31e27a2a08aed095 [0,2,0,0,0,0|1,0,0]=3 6966 B12R1.252 CC(S)COCc1ccccn1 a4f3c7b4dcc63c52aaa45bb366b1ace4 [0,2,0,0,0,0|2,0,0]=4 6967 B12R1.252 CC(S)COCc1cccnc1 355ce467de5bbf28efe4538348b90e14 [0,2,0,0,0,0|2,0,0]=4 6968 B12R1.252 CN(C)CCNc1ccccc1 d3b2e620d30900fb427915c44cfde5dc [0,2,0,0,0,0|1,0,0]=3 6969 B12R1.252 CN(C)CCNc1ccccn1 3770115323c648ae32f4fd74bb45de81 [0,2,0,0,0,0|2,0,0]=4 6970 B12R1.252 CN(C)CCNc1cccnc1 22a4008b463a870f2daa263a95fbffba [0,2,0,0,0,0|2,0,0]=4 6971 B12R1.252 CN(C)CCNc1ccncc1 d9f8952e88bdc30a4e0e7629ce419405 [0,2,0,0,0,0|2,0,0]=4 6972 B12R1.252 CN(C)CCOc1ccccn1 97e00588b90af414fe2d070a8bfe7282 [0,2,0,0,0,0|2,0,0]=4 6973 B12R1.252 CN(C)CCOc1cccnc1 f5e21fc4088e0b2f79fcf350bb578a86 [0,2,0,0,0,0|2,0,0]=4 6974 B12R1.252 CN(C)CCOc1ccncc1 97bba66a3292910c48ac90e816f26fa6 [0,2,0,0,0,0|2,0,0]=4 6975 B12R1.252 CN(C)CNCc1ccccc1 0202e986c8da8d9c48034425b18c3dfe [0,2,0,0,0,0|1,0,0]=3 6976 B12R1.252 CN(C)CNCc1ccccn1 3e94ae66f4eb87252a917a8d226960eb [0,2,0,0,0,0|2,0,0]=4 6977 B12R1.252 CN(C)CNCc1cccnc1 0ce03a303d2964fc78c4354a4a9686bb [0,2,0,0,0,0|2,0,0]=4 6978 B12R1.252 CN(C)CNCc1ccncc1 5e49afaadf13dc7066741f62250ed2bc [0,2,0,0,0,0|2,0,0]=4 6979 B12R1.252 CN(C)COCc1ccccc1 a063060d7f5ce478c07330412cbf8447 [0,2,0,0,0,0|1,0,0]=3 6980 B12R1.252 CN(C)COCc1ccccn1 3a10a8f32d4655fe62f905c50c31c2d8 [0,2,0,0,0,0|2,0,0]=4 6981 B12R1.252 CN(C)COCc1cccnc1 0f0029a575393373338b79601babfc55 [0,2,0,0,0,0|2,0,0]=4 6982 B12R1.252 CN(C)COCc1ccncc1 64013abc6fb1891b992e5cf59135b9d7 [0,2,0,0,0,0|2,0,0]=4 6983 B12R1.252 CS(=O)CCNc1ccccc1 5cc8a55dee9bbafc2b2ae46532475526 [0,2,0,0,0,0|0,1,0]=3 6984 B12R1.252 CS(=O)CCNc1ccccn1 32809cdd694b5d2997184adf79ab8936 [0,2,0,0,0,0|1,1,0]=4 6985 B12R1.252 CS(=O)CCNc1cccnc1 c989b0c74f35fcb5f1937809390bfccd [0,2,0,0,0,0|1,1,0]=4 6986 B12R1.252 CS(=O)CCNc1ccncc1 9c85c1df8c533539c8e3b95bc4a48623 [0,2,0,0,0,0|1,1,0]=4 6987 B12R1.252 CS(=O)CCOc1ccccn1 30133f9bf19ef8b3fdfb27b7644f2fa7 [0,2,0,0,0,0|1,1,0]=4 6988 B12R1.252 CS(=O)CCOc1cccnc1 fba82d99e9c5926738121fef3b403577 [0,2,0,0,0,0|1,1,0]=4 6989 B12R1.252 CS(=O)CCOc1ccncc1 42f0efa364a33090ad2bbdd483f409f6 [0,2,0,0,0,0|1,1,0]=4 6990 B12R1.252 C[C@@H](F)COCc1ccccc1 ba1a50f79e3a1a52d90fe2949f8a3658 [0,2,0,0,0,0|1,0,0]=3 6991 B12R1.252 C[C@@H](F)COCc1ccccn1 25305c43f86a522a8b001eca7d58c6e1 [0,2,0,0,0,0|2,0,0]=4 6992 B12R1.252 C[C@@H](F)COCc1cccnc1 aed0ead164612a30bbdf73120135ebce [0,2,0,0,0,0|2,0,0]=4 6993 B12R1.252 C[C@@H](O)CCNc1ccccc1 3c324f6ae4acc93f637fccf82ee7ce0d [0,2,0,0,0,0|1,0,0]=3 6994 B12R1.252 C[C@@H](O)CCNc1cccnc1 d2f9effd7c499379710e94d2300db828 [0,2,0,0,0,0|2,0,0]=4 6995 B12R1.252 C[C@@H](O)CCNc1ccncc1 1357dd9581462a38875d3aa4d1c252b3 [0,2,0,0,0,0|2,0,0]=4 6996 B12R1.252 C[C@@H](O)CNCc1ccccc1 6c2312c00225852faacfd748f3e179a9 [0,2,0,0,0,0|1,0,0]=3 6997 B12R1.252 C[C@@H](O)CNCc1ccccn1 451f5ffb0f29e3e72e062344afb5a2f0 [0,2,0,0,0,0|2,0,0]=4 6998 B12R1.252 C[C@@H](O)CNCc1cccnc1 b84ffcc76f02e485a00f4000a256d608 [0,2,0,0,0,0|2,0,0]=4 6999 B12R1.252 C[C@@H](O)CNCc1ccncc1 ae74cf20bb99ef533f01677aac980ef0 [0,2,0,0,0,0|2,0,0]=4 7000 B12R1.252 C[C@H](F)COCc1ccccc1 bbc793e84de595855390c7dc0e162e4e [0,2,0,0,0,0|1,0,0]=3 7001 B12R1.252 C[C@H](F)COCc1ccccn1 1c3e68e8b7d209c95b5abd8e99134585 [0,2,0,0,0,0|2,0,0]=4 7002 B12R1.252 C[C@H](F)COCc1cccnc1 0c09d4ffa6c243373fe47064ad603e31 [0,2,0,0,0,0|2,0,0]=4 7003 B12R1.252 C[C@H](O)CCNc1ccccc1 6e2f4bd6880dfbdf2c0288d2956dbdc6 [0,2,0,0,0,0|1,0,0]=3 7004 B12R1.252 C[C@H](O)CCNc1cccnc1 a74a77e227ccf23689573201eeb443f8 [0,2,0,0,0,0|2,0,0]=4 7005 B12R1.252 C[C@H](O)CCNc1ccncc1 b387b9f25ac0f7430597235bfa1a1caf [0,2,0,0,0,0|2,0,0]=4 7006 B12R1.252 C[C@H](O)CNCc1ccccc1 300dc860ca45284f1e63efe30c8515f8 [0,2,0,0,0,0|1,0,0]=3 7007 B12R1.252 C[C@H](O)CNCc1ccccn1 b271f5c0c0f30c343eeedababca7e2eb [0,2,0,0,0,0|2,0,0]=4 7008 B12R1.252 C[C@H](O)CNCc1cccnc1 4f2f0e9e68ec9a4c8887410d5a461943 [0,2,0,0,0,0|2,0,0]=4 7009 B12R1.252 C[C@H](O)CNCc1ccncc1 efb723b5ed38065d1ff8f191a8967ccc [0,2,0,0,0,0|2,0,0]=4 7010 B12R1.252 FC(F)CCNc1ccccc1 197e931474a81ea0a384c18be7d88578 [0,2,0,0,0,0|2,0,0]=4 7011 B12R1.252 FC(F)CNCc1ccccc1 b372a4b49b84fd81f05ebb43fbf5746e [0,2,0,0,0,0|2,0,0]=4 7012 B12R1.252 FC(F)COCc1ccccc1 2df81e9a81e7d6e6e6f5c475fa361af0 [0,2,0,0,0,0|2,0,0]=4 7013 B12R1.252 NC(=O)CCNc1ccccc1 e3f281a2334f3d253ae1981a98fa192d [0,2,0,0,0,0|2,0,0]=4 7014 B12R1.252 NC(=O)CNCc1ccccc1 83654b4ad4ce52b5beb58e8e02b043be [0,2,0,0,0,0|2,0,0]=4 7015 B12R1.252 NC(=O)COCc1ccccc1 eacdadd1a099559aa1699a209237e0c7 [0,2,0,0,0,0|2,0,0]=4 7016 B12R1.252 NC(=S)CCNc1ccccc1 fdd014489a9f5fc5a2655cbf4a4fb01b [0,2,0,0,0,0|2,0,0]=4 7017 B12R1.252 NC(=S)COCc1ccccc1 397a628005598ffe9bcc09a6e0a362e3 [0,2,0,0,0,0|2,0,0]=4 7018 B12R1.252 O=C(O)CCNc1ccccc1 ed7f72bbe0b1599eda9c30db2d051414 [0,2,0,0,0,0|2,0,0]=4 7019 B12R1.252 O=C(O)CNCc1ccccc1 db9e4b752c6e68fd22fb535c2b9167d2 [0,2,0,0,0,0|2,0,0]=4 7020 B12R1.252 O=C(O)COCc1ccccc1 a919d4e5b6621fc6b657c329a5a5b2a3 [0,2,0,0,0,0|2,0,0]=4 7021 B12R1.252 O=S(O)CCNc1ccccc1 0ff7b55f6ed3d9a491931fe66155130d [0,2,0,0,0,0|1,1,0]=4 7022 B12R1.252 O=S(O)COCc1ccccc1 b3f70ea663599ebd17c7712fcc9ee3f6 [0,2,0,0,0,0|1,1,0]=4 7023 B12R1.252 O=[N+]([O-])CNCc1ccccc1 003ae0a8ef4956ccaf12e059439e2939 [0,2,0,0,0,0|2,0,0]=4 7024 B12R1.252 O=[N+]([O-])COCc1ccccc1 ee8d233480e436ac44b29eeacba4e8fe [0,2,0,0,0,0|2,0,0]=4 7025 B12R1.43 CC(=O)C(C)Nc1ccccc1 a5a89e613210df479342158a0b1bf72b [0,2,0,0,0,0|2,0,0]=4 7026 B12R1.43 CC(=O)N(C)Cc1ccccc1 b985bf2c7484ae6a34647301b4683566 [0,2,0,0,0,0|2,0,0]=4 7027 B12R1.43 CC(C)C(C)Nc1ccccc1 48093fab6ce2f9bea5eaf7557d6a555a [0,2,0,0,0,0|2,0,0]=4 7028 B12R1.43 CC(C)N(C)Cc1ccccc1 d5edd43e495581ab07d4c878cf7efc6a [0,2,0,0,0,0|2,0,0]=4 7029 B12R1.43 CC(C)[C@@H](C)Nc1ccccc1 638de983f09ad8573a19e829866f679b [0,2,0,0,0,0|2,0,0]=4 7030 B12R1.43 CC(C)[C@H](C)Nc1ccccc1 37a4cc2968d8598e2dd44bb0f3ee65d4 [0,2,0,0,0,0|2,0,0]=4 7031 B12R1.43 CC(O)C(C)Nc1ccccc1 807016486516eda629177f9c4eb1e753 [0,2,0,0,0,0|2,0,0]=4 7032 B12R1.118 CCC(C=O)Nc1ccccc1 8973b461ada5e90cb6534721bdd5a0a6 [0,2,0,0,0,0|2,0,0]=4 7033 B12R1.118 CCC(CC)Nc1ccccc1 62a5bbda4663c06f44e205dbfccb7cfa [0,2,0,0,0,0|2,0,0]=4 7034 B12R1.118 CCC(CO)Nc1ccccc1 4bbd0090e2c789b85e6c79fc920a972e [0,2,0,0,0,0|2,0,0]=4 7035 B12R1.118 CCN(C=O)Cc1ccccc1 05bd4b36907bafd365c275012bc499e0 [0,2,0,0,0,0|2,0,0]=4 7036 B12R1.118 CC[C@@H](CO)Nc1ccccc1 4e6d1044dff6b69bba19855888009bcf [0,2,0,0,0,0|2,0,0]=4 7037 B12R1.118 CC[C@H](CO)Nc1ccccc1 6e84965dfbcccf2d9d399d53a4428cff [0,2,0,0,0,0|2,0,0]=4 7038 B12R1.194 CCC(C)(C)Nc1ccccc1 17a09be9f9cdec5da28d382a8493f798 [0,2,0,0,0,0|2,0,0]=4 7039 B12R1.891 CC(C)(C)CNc1ccccc1 866f0c000f012585c56b315997251133 [0,2,0,0,0,0|2,0,0]=4 7040 B12R1.891 CC(C)(C)NCc1ccccc1 7201c1c22c9fa04427965e3124c0e1d6 [0,2,0,0,0,0|2,0,0]=4 7041 B12R1.891 CC(C)(F)CNc1ccccc1 b0242d6e7e1a9c8e30a280dd6d0dab3d [0,2,0,0,0,0|2,0,0]=4 7042 B12R1.891 CC(C)(O)CNc1ccccc1 f100447f9f947bdcf8b3cb6f09283ae4 [0,2,0,0,0,0|2,0,0]=4 7043 B12R1.891 CC(F)(F)CNc1ccccc1 082b0f20fce6d46920eb2d5531e00578 [0,2,0,0,0,0|2,0,0]=4 7044 B12R1.891 CS(=O)(=O)CNc1ccccc1 b140962be5bd942e91165cc653df790b [0,2,0,0,0,0|1,1,0]=4 7045 B12R2.294 Sc1ccc(cc1)NC2CC2 0824eade139ba6c64308f26ae03b3bd0 [0,1,0,1,0,0|2,0,0]=4 7046 B12R2.27 CCN1CC1c2ccccc2 9688627107d4117581407497e721ccee [0,1,0,1,0,0|1,0,0]=3 7047 B12R2.27 CCN1C[C@@H]1c2ccccc2 c32dec6f3160b9b7bc8c2839caf72878 [0,1,0,1,0,0|1,0,0]=3 7048 B12R2.27 FCN1CC1c2ccccc2 961cd8c1338ecdce6a27ac300fedcc98 [0,1,0,1,0,0|1,0,0]=3 7049 B12R2.27 FCN1C[C@@H]1c2ccccc2 186c23a739812eaa2456c8641683ea36 [0,1,0,1,0,0|1,0,0]=3 7050 B12R2.27 O=CN1CC1c2ccccc2 762f19a034f772a367d3e7ac6806d5e0 [0,1,0,1,0,0|1,0,1]=4 7051 B12R2.27 O=CN1C[C@@H]1c2ccccc2 3cd739dd6b25e8af9413dc2836c79b56 [0,1,0,1,0,0|1,0,1]=4 7052 B12R2.27 OCN1CC1c2ccccc2 380946bf56a518a4f82b6f06607820f1 [0,1,0,1,0,0|1,0,0]=3 7053 B12R2.27 OCN1C[C@@H]1c2ccccc2 b0131158d23691f2ccd2899d00b705c5 [0,1,0,1,0,0|1,0,0]=3 7054 B12R2.931 CCOC1Cc2c1cccc2 3c89ff4e209e0c2fdac6354471a794bb [0,1,0,1,0,0|0,0,0]=2 7055 B12R2.931 FCOC1Cc2c1cccc2 8a2a59b07ef62954890e5ca9132b929f [0,1,0,1,0,0|0,0,0]=2 7056 B12R2.931 N#CNC1Cc2c1cccc2 4acf83ea777f3f4bc9a4041ee13e4a3e [0,1,0,1,0,0|1,0,1]=4 7057 B12R2.32 CCN1Cc2ccccc2C1 20c2942768350a956e6d394a0b65e9b5 [0,1,0,1,0,0|2,0,0]=4 7058 B12R2.225 Clc1ccccc1OC2CC2 a4bab8f7130a623ddfe359429eb2845e [0,1,0,1,0,0|2,0,0]=4 7059 B12R2.1286 Brc1cccc(c1)OC2CC2 86a1316c992baf3081c1c927bc09a287 [0,1,0,1,0,0|2,0,0]=4 7060 B12R2.1286 Cc1cccc(c1)NC2CC2 5416fc1bda4e7fcd886b594e4b5d1c15 [0,1,0,1,0,0|2,0,0]=4 7061 B12R2.1286 Cc1cccc(c1)OC2CC2 c5e41ef21eaec44bf0109887340004b0 [0,1,0,1,0,0|2,0,0]=4 7062 B12R2.1286 Clc1cccc(c1)NC2CC2 da0b3d09a41ad9d3b62eef57d7091303 [0,1,0,1,0,0|2,0,0]=4 7063 B12R2.1286 Clc1cccc(c1)OC2CC2 3517e32596ee199dca8f3a8989d328df [0,1,0,1,0,0|2,0,0]=4 7064 B12R2.1286 Fc1cccc(c1)NC2CC2 f9cd48a2521ccf98e9a7217233e95127 [0,1,0,1,0,0|2,0,0]=4 7065 B12R2.1286 Fc1cccc(c1)OC2CC2 fd5bcec64f0f04cfa2f0c44c0567737a [0,1,0,1,0,0|2,0,0]=4 7066 B12R2.1286 Ic1cccc(c1)OC2CC2 c806530f93f705072682a29e36637503 [0,1,0,1,0,0|2,0,0]=4 7067 B12R2.1286 Sc1cccc(c1)OC2CC2 5fb16c6390673deaae2d1fc21856fb80 [0,1,0,1,0,0|2,0,0]=4 7068 B12R2.1 CCN1CCc2c1cccn2 c6dc67a825bc35ffc313764f68fe419e [0,1,0,1,0,0|2,0,0]=4 7069 B12R2.1 CCN1CCc2c1ccnc2 1336a1241175b4a8fca67f4db3577c1b [0,1,0,1,0,0|2,0,0]=4 7070 B12R2.1 CCN1CCc2c1cncc2 28fbe5c10ed83bf591b4c3945d902409 [0,1,0,1,0,0|2,0,0]=4 7071 B12R2.1 CCN1CCc2c1nccc2 12def77c50510f33b92190b9b59aae18 [0,1,0,1,0,0|2,0,0]=4 7072 B12R2.1 FCN1CCc2c1cccn2 4377bfe78ba7f41c2b687c6b1c905846 [0,1,0,1,0,0|2,0,0]=4 7073 B12R2.1 FCN1CCc2c1cncc2 abff8c9c8f2767321dc8e650048f7236 [0,1,0,1,0,0|2,0,0]=4 7074 B12R2.1 FCN1CCc2c1nccc2 9141164ad6d29af56584f279428a9be4 [0,1,0,1,0,0|2,0,0]=4 7075 B12R2.1 O=CN1CCc2c1cccc2 952fb58dcbced8913394c41c3e29378e [0,1,0,1,0,0|1,0,1]=4 7076 B12R2.1 OCN1CCc2c1cccc2 b6afa4fa6bad5e1cd18ef7eeaa43164b [0,1,0,1,0,0|1,0,0]=3 7077 B12R2.1 OCN1CCc2c1cccn2 6bc3bb677f88da8fd8301f0c9a392f1b [0,1,0,1,0,0|2,0,0]=4 7078 B12R2.1 OCN1CCc2c1ccnc2 a76413ee6f28e7676135b29e9ea6001b [0,1,0,1,0,0|2,0,0]=4 7079 B12R2.1 OCN1CCc2c1cncc2 6f9b8a4d65c1bbdd614762f05d2461d7 [0,1,0,1,0,0|2,0,0]=4 7080 B12R2.1 OCN1CCc2c1nccc2 a47c7d48541048f1d1671782051639e3 [0,1,0,1,0,0|2,0,0]=4 7081 B12R2.11 CC1CC1Nc2ccccc2 6c2b1ed9451679c2c2b0f3748602bd6d [0,1,0,1,0,0|1,0,0]=3 7082 B12R2.11 CC1CC1Nc2cccnc2 e0f55178f08b4b2b54d9d876d97d2290 [0,1,0,1,0,0|2,0,0]=4 7083 B12R2.11 F[C@@H]1C[C@@H]1Nc2ccccc2 25c07123a823d9ea2969aff7da72cef4 [0,1,0,1,0,0|2,0,0]=4 7084 B12R2.11 F[C@@H]1C[C@H]1Nc2ccccc2 b0efbced164dabbe532e6255951097b4 [0,1,0,1,0,0|2,0,0]=4 7085 B12R2.11 F[C@H]1C[C@@H]1Nc2ccccc2 e610ffc6a467ed241d6c7f91606b201b [0,1,0,1,0,0|2,0,0]=4 7086 B12R2.2057 c1cc(ccn1)COC2CC2 da3247f4bbaea1ae4c65fbee8045d76d [0,1,0,1,0,0|2,0,0]=4 7087 B12R2.2057 c1cc(ccn1)NCC2CC2 849918da92a0c0498a218bfd0f4ee058 [0,1,0,1,0,0|2,0,0]=4 7088 B12R2.2057 c1cc(ccn1)OCC2CC2 c00853e2b14f5a610ec89d61eadf6a66 [0,1,0,1,0,0|2,0,0]=4 7089 B12R2.2057 c1ccc(cc1)CNC2CC2 0722218fcfefdcb8b8f0e8dc60326858 [0,1,0,1,0,0|1,0,0]=3 7090 B12R2.2057 c1ccc(cc1)COC2CC2 4f6efb1abdd284b3ec5fbe724b10a332 [0,1,0,1,0,0|1,0,0]=3 7091 B12R2.2057 c1ccc(cc1)NCC2CC2 14003b7d6af1ed476ecb017534f042ad [0,1,0,1,0,0|1,0,0]=3 7092 B12R2.2057 c1ccc(nc1)CNC2CC2 072625a4614190be9cbf10388fa5861b [0,1,0,1,0,0|2,0,0]=4 7093 B12R2.2057 c1ccc(nc1)COC2CC2 abde439d2a0ddaaa61aa7afca3b1da4d [0,1,0,1,0,0|2,0,0]=4 7094 B12R2.2057 c1ccc(nc1)NCC2CC2 a4bb220accadbaa000279249a4daf5cf [0,1,0,1,0,0|2,0,0]=4 7095 B12R2.2057 c1ccc(nc1)OCC2CC2 05ede210d3ae4cc4a2c3f7154d855ada [0,1,0,1,0,0|2,0,0]=4 7096 B12R2.2057 c1cncc(c1)CNC2CC2 de74061854556603c3b7f6c7b31bcca1 [0,1,0,1,0,0|2,0,0]=4 7097 B12R2.2057 c1cncc(c1)COC2CC2 4f1f4bbe9c5cccaf786a2469b1a1b939 [0,1,0,1,0,0|2,0,0]=4 7098 B12R2.2057 c1cncc(c1)NCC2CC2 116af6c2af65d4c96c0cfbf27938bace [0,1,0,1,0,0|2,0,0]=4 7099 B12R2.2057 c1cncc(c1)OCC2CC2 6e3515b4fef3884dcd9b31bc8938b0e1 [0,1,0,1,0,0|2,0,0]=4 7100 B12R2.2058 c1cc(ccn1)NC2CCC2 ff52b84334e7a4aaf2d6969c56a15034 [0,1,0,1,0,0|2,0,0]=4 7101 B12R2.2058 c1cc(ccn1)NC2COC2 14d953918d7dcb02ab6c12f780d085b6 [0,1,0,1,0,0|1,0,0]=3 7102 B12R2.2058 c1cc(ccn1)OC2COC2 bdc70c71b5050b9cdb045af1479dc30f [0,1,0,1,0,0|1,0,0]=3 7103 B12R2.2058 c1cc(cnn1)NC2COC2 832de64a070e45283ca4c8c704290819 [0,1,0,1,0,0|2,0,0]=4 7104 B12R2.2058 c1cc(cnn1)OC2COC2 1cdf19e114e99f8966fbb5da824c5c85 [0,1,0,1,0,0|2,0,0]=4 7105 B12R2.2058 c1ccc(cc1)CN2CCC2 79f0a156a4476249fe3e90dbe2fa6274 [0,1,0,1,0,0|1,0,0]=3 7106 B12R2.2058 c1ccc(cc1)NC2COC2 638d2081ed3e07246cd09300ecb8f6dc [0,1,0,1,0,0|0,0,0]=2 7107 B12R2.2058 c1ccc(nc1)CN2CCC2 ad09a5bf93c910029918799e4e089e07 [0,1,0,1,0,0|2,0,0]=4 7108 B12R2.2058 c1ccc(nc1)NC2CCC2 fb43cdd397450ab6a78add51a3593170 [0,1,0,1,0,0|2,0,0]=4 7109 B12R2.2058 c1ccc(nc1)OC2CCC2 01ad94c84aae3cf4e74cc0f7661c85b5 [0,1,0,1,0,0|2,0,0]=4 7110 B12R2.2058 c1ccc(nc1)OC2COC2 e57c93d451b0b6b991d0fd1596a311ca [0,1,0,1,0,0|1,0,0]=3 7111 B12R2.2058 c1cnc(nc1)NC2COC2 9193c846df9ff55a5933be2d90f6c6ee [0,1,0,1,0,0|2,0,0]=4 7112 B12R2.2058 c1cncc(c1)CN2CCC2 b1361fa162d89a1875554b0e74a89d35 [0,1,0,1,0,0|2,0,0]=4 7113 B12R2.2058 c1cncc(c1)NC2CCC2 dd91e6f1e99e09367d72a057d00ff1a5 [0,1,0,1,0,0|2,0,0]=4 7114 B12R2.2058 c1cncc(c1)NC2COC2 2aae7bd2fd3ce1179be00cfde2c027d7 [0,1,0,1,0,0|1,0,0]=3 7115 B12R2.2058 c1cncc(c1)OC2CCC2 7a6fdcb9cb0be6f7ba06c65562ff0c48 [0,1,0,1,0,0|2,0,0]=4 7116 B12R2.2058 c1cncc(c1)OC2COC2 a8dd711f09c8c96411b2f1503a563f21 [0,1,0,1,0,0|1,0,0]=3 7117 B8R1.8 CCNc1cccs1 f92887221cdfe270aa88f70a5b6538c3 [1,0,0,0,1,0|2,0,0]=4 7118 B8R1.8 CCNc1ccsc1 cda8850b0edc8792e319ed7aad994bf3 [1,0,0,0,1,0|2,0,0]=4 7119 B8R1.8 CCOc1ccco1 e09af78840aa7c50339c3ce236ba2f4c [1,0,0,0,1,0|2,0,0]=4 7120 B8R1.8 CCOc1cccs1 d21292a98c2ee3c1ea9b8b00e074b6ef [1,0,0,0,1,0|2,0,0]=4 7121 B8R1.8 CCOc1ccsc1 e97ca04b8e5d46ec67b2ebe625463cd4 [1,0,0,0,1,0|2,0,0]=4 7122 B8R1.8 OCNc1cccs1 2c9e101236047184adb7524dbc050fa0 [1,0,0,0,1,0|2,0,0]=4 7123 B8R1.8 OCNc1ccsc1 baaeacb9206ca69c746a94490c876825 [1,0,0,0,1,0|2,0,0]=4